#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwv s ARG 3 N 0.00 3.98 0.87 1.09 0.52 -1.26 -5.08 118.95 119.07 3bwv s ARG 3 Ca 0.00 0.42 -0.11 0.00 -0.52 0.00 0.00 55.73 55.52 3bwv s ARG 3 Cb 0.00 -3.25 0.11 0.00 0.52 0.00 0.00 34.95 32.33 3bwv s ARG 3 CO 0.00 0.62 1.09 -0.65 0.02 0.00 0.00 175.30 176.39 3bwv s GLN 4 N -0.86 1.51 -0.02 3.54 -0.21 -1.26 -4.74 119.66 117.61 3bwv s GLN 4 Ca 0.24 0.77 0.05 0.00 0.02 0.00 0.00 55.36 56.44 3bwv s GLN 4 Cb -0.17 -1.84 -0.01 0.00 1.00 0.00 0.00 33.01 31.99 3bwv s GLN 4 CO 0.13 -2.05 -0.18 1.03 -2.12 0.00 0.00 175.29 172.10 3bwv s ARG 5 N -5.00 1.54 -0.16 2.91 0.52 -1.26 -0.92 118.95 116.59 3bwv s ARG 5 Ca 0.63 -0.64 0.02 0.00 -0.52 0.00 0.00 55.73 55.21 3bwv s ARG 5 Cb -0.17 -1.46 0.01 0.00 0.52 0.00 0.00 34.95 33.86 3bwv s ARG 5 CO 0.56 0.36 -0.21 0.42 0.02 0.00 0.00 175.30 176.45 3bwv s ILE 6 N -0.34 2.08 -0.11 1.52 1.01 -0.14 -1.69 121.20 123.53 3bwv s ILE 6 Ca 0.05 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.60 3bwv s ILE 6 Cb -0.08 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 3bwv s ILE 6 CO -0.00 0.54 0.32 0.00 0.00 0.00 0.00 174.94 175.81 3bwv s ALA 7 N 0.99 3.63 -0.08 9.38 0.00 0.26 -0.92 121.76 135.03 3bwv s ALA 7 Ca -0.03 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.57 3bwv s ALA 7 Cb -0.15 -2.37 0.01 0.00 0.00 0.00 0.00 23.12 20.61 3bwv s ALA 7 CO -0.06 0.23 -0.15 0.42 0.00 0.00 0.00 175.76 176.20 3bwv s ILE 8 N -0.03 1.39 0.00 0.00 1.01 0.06 -0.63 121.20 123.00 3bwv s ILE 8 Ca 0.19 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3bwv s ILE 8 Cb -0.14 -1.25 0.00 0.00 0.01 0.00 0.00 42.46 41.08 3bwv s ILE 8 CO 0.07 0.41 0.00 -0.67 0.00 0.00 0.00 174.94 174.75 3bwv n ASP 9 N 3.83 -0.04 0.00 3.58 2.03 -0.58 -0.83 116.55 124.54 3bwv n ASP 9 Ca -0.21 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.04 3bwv n ASP 9 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 3bwv n ASP 9 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3bwv n ASP 11 N -0.25 0.00 -0.63 1.67 8.00 -1.26 -3.41 116.55 120.67 3bwv n ASP 11 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.42 3bwv n ASP 11 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 3bwv n ASP 11 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3bwv n GLU 12 N 0.00 -0.56 0.01 -1.24 1.02 -0.49 -4.77 120.64 114.61 3bwv n GLU 12 Ca 0.00 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.90 3bwv n GLU 12 Cb 0.00 -4.61 0.00 0.00 -0.02 0.00 0.00 31.44 26.81 3bwv n GLU 12 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3bwv n VAL 13 N -2.84 0.02 0.04 2.62 0.31 -1.26 -4.80 118.33 112.42 3bwv n VAL 13 Ca -0.08 0.01 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 3bwv n VAL 13 Cb 0.28 -0.21 -0.13 0.00 -0.91 0.00 0.00 33.84 32.87 3bwv n VAL 13 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3bwv h LEU 14 N 0.00 0.10 -8.45 7.52 3.38 -1.87 -3.46 115.31 112.52 3bwv h LEU 14 Ca 0.00 -0.13 -0.69 0.00 0.09 0.00 0.00 57.88 57.16 3bwv h LEU 14 Cb 0.00 -0.03 -0.32 0.00 0.09 0.00 0.00 40.66 40.40 3bwv h LEU 14 CO 0.00 1.11 -0.87 0.00 0.09 0.00 0.00 178.44 178.76 3bwv s ALA 15 N -2.66 2.20 -1.40 1.53 0.00 -1.26 -4.53 121.76 115.65 3bwv s ALA 15 Ca -0.03 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.77 3bwv s ALA 15 Cb 0.09 -0.75 0.03 0.00 0.00 0.00 0.00 23.12 22.48 3bwv s ALA 15 CO 0.83 0.37 2.17 -3.47 0.00 0.00 0.00 175.76 175.66 3bwv n ASP 16 N 3.16 3.86 0.07 0.00 2.03 -0.01 -1.40 116.55 124.26 3bwv n ASP 16 Ca -0.18 -2.83 -0.04 0.00 0.52 0.00 0.00 54.79 52.25 3bwv n ASP 16 Cb 0.52 -1.63 0.16 0.00 -0.72 0.00 0.00 41.12 39.45 3bwv n ASP 16 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3bwv h THR 17 N 4.17 1.34 -0.13 5.18 1.35 -1.93 -2.88 112.91 120.00 3bwv h THR 17 Ca 0.55 -1.71 -0.22 0.00 -0.55 0.00 0.00 66.41 64.48 3bwv h THR 17 Cb 0.66 1.79 0.01 0.00 -1.73 0.00 0.00 68.15 68.87 3bwv h THR 17 CO 1.86 0.51 -0.79 0.25 -0.25 0.00 0.00 175.52 177.10 3bwv h LEU 18 N 0.24 0.84 -0.90 3.87 5.85 -1.98 -2.44 115.31 120.80 3bwv h LEU 18 Ca 0.01 -0.56 0.10 0.00 0.84 0.00 0.00 57.88 58.27 3bwv h LEU 18 Cb 0.95 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.65 3bwv h LEU 18 CO 0.08 1.35 0.54 1.23 -0.34 0.00 0.00 178.44 181.29 3bwv h GLY 19 N 0.72 1.41 0.94 3.75 0.00 -1.94 -0.30 103.07 107.65 3bwv h GLY 19 Ca -0.05 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 3bwv h GLY 19 CO 0.16 0.16 -0.09 0.00 0.00 0.00 0.00 176.54 176.76 3bwv h ALA 20 N 1.48 0.48 -0.39 3.60 0.00 -1.34 -1.90 119.26 121.19 3bwv h ALA 20 Ca 0.43 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 3bwv h ALA 20 Cb 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3bwv h ALA 20 CO -0.25 0.34 -0.33 0.28 0.00 0.00 0.00 179.25 179.29 3bwv h VAL 21 N 0.47 1.28 -0.34 0.00 2.07 -0.97 -1.93 116.25 116.82 3bwv h VAL 21 Ca 0.09 -1.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 3bwv h VAL 21 Cb 0.60 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3bwv h VAL 21 CO 0.04 0.50 0.12 0.58 0.02 0.00 0.00 177.57 178.82 3bwv h VAL 22 N 0.73 1.20 -0.45 2.57 2.07 -1.04 -0.06 116.25 121.27 3bwv h VAL 22 Ca 0.07 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 66.98 3bwv h VAL 22 Cb 0.92 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3bwv h VAL 22 CO 0.08 0.22 0.24 0.50 0.02 0.00 0.00 177.57 178.63 3bwv h LYS 23 N 0.40 0.46 0.02 1.57 3.64 -1.24 0.16 116.57 121.57 3bwv h LYS 23 Ca 0.11 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3bwv h LYS 23 Cb 0.23 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3bwv h LYS 23 CO -0.01 0.30 -0.01 0.00 -2.27 0.00 0.00 179.45 177.47 3bwv h ALA 24 N 1.23 -0.03 -0.62 5.00 0.00 -1.10 -1.61 119.26 122.13 3bwv h ALA 24 Ca 0.19 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3bwv h ALA 24 Cb 0.08 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 3bwv h ALA 24 CO -0.12 -0.40 0.30 0.28 0.00 0.00 0.00 179.25 179.31 3bwv h VAL 25 N -0.26 0.88 -0.18 0.00 2.07 -0.69 -0.47 116.25 117.60 3bwv h VAL 25 Ca -0.00 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.35 3bwv h VAL 25 Cb 0.25 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3bwv h VAL 25 CO 0.00 0.10 0.05 0.78 0.02 0.00 0.00 177.57 178.52 3bwv h ASN 26 N 0.54 0.04 -0.02 0.57 2.35 -0.55 -0.71 115.58 117.81 3bwv h ASN 26 Ca 0.29 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 3bwv h ASN 26 Cb 0.26 0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 3bwv h ASN 26 CO -0.23 0.05 0.01 -0.33 -1.65 0.00 0.00 177.43 175.29 3bwv h GLU 27 N 0.13 0.03 0.18 0.81 5.08 -0.90 -0.02 114.58 119.89 3bwv h GLU 27 Ca 0.08 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3bwv h GLU 27 Cb 0.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3bwv h GLU 27 CO -0.09 0.03 -0.09 0.00 -1.00 0.00 0.00 179.01 177.86 3bwv h ARG 28 N 0.02 -0.24 -0.42 2.33 3.08 -1.00 -3.21 114.38 114.95 3bwv h ARG 28 Ca 0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3bwv h ARG 28 Cb 0.01 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3bwv h ARG 28 CO -0.00 0.12 0.00 0.00 -1.07 0.00 0.00 179.97 179.02 3bwv n ALA 29 N -2.63 2.59 -2.63 0.04 0.00 -0.28 -4.88 120.51 112.71 3bwv n ALA 29 Ca -0.07 -0.33 -0.15 0.00 0.00 0.00 0.00 53.44 52.89 3bwv n ALA 29 Cb 0.24 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.68 3bwv n ALA 29 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3bwv n ASP 30 N 0.03 -4.14 -4.73 0.00 8.00 -0.16 -4.95 116.55 110.61 3bwv n ASP 30 Ca 0.06 0.05 -0.23 0.00 0.71 0.00 0.00 54.79 55.38 3bwv n ASP 30 Cb 0.25 -3.48 0.10 0.00 -0.02 0.00 0.00 41.12 37.97 3bwv n ASP 30 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3bwv s LEU 31 N -5.86 2.99 -0.33 0.64 1.43 -0.40 -4.99 118.68 112.16 3bwv s LEU 31 Ca 0.09 -0.48 0.17 0.00 -1.03 0.00 0.00 54.13 52.88 3bwv s LEU 31 Cb -0.04 -1.87 0.45 0.00 0.03 0.00 0.00 46.19 44.76 3bwv s LEU 31 CO 0.11 -1.80 0.98 -3.20 0.23 0.00 0.00 176.35 172.67 3bwv n ASN 32 N -2.74 1.18 -4.64 2.29 2.85 -1.26 -4.57 115.26 108.36 3bwv n ASN 32 Ca 0.15 -2.69 -0.46 0.00 -0.11 0.00 0.00 54.58 51.47 3bwv n ASN 32 Cb 0.61 -0.41 -0.03 0.00 1.24 0.00 0.00 39.78 41.18 3bwv n ASN 32 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 3bwv n ILE 33 N -0.10 0.81 -0.91 -1.44 5.41 -1.26 -5.14 119.36 116.73 3bwv n ILE 33 Ca 0.08 -0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.63 3bwv n ILE 33 Cb 0.82 -1.30 0.00 0.00 -0.71 0.00 0.00 39.64 38.45 3bwv n ILE 33 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 3bwv n LYS 34 N 2.11 3.73 0.00 0.38 -0.00 -1.26 -5.05 118.16 118.08 3bwv n LYS 34 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 3bwv n LYS 34 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.32 3bwv n LYS 34 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 3bwv n GLU 36 N 0.00 0.00 0.02 -1.58 0.00 -1.26 -3.55 120.64 114.28 3bwv n GLU 36 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.29 3bwv n GLU 36 Cb 0.00 0.00 0.40 0.00 0.00 0.00 0.00 31.44 31.84 3bwv n GLU 36 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 3bwv n SER 37 N 0.00 0.37 -1.04 -1.84 7.64 -1.26 -4.17 113.62 113.32 3bwv n SER 37 Ca 0.00 0.21 0.12 0.00 1.01 0.00 0.00 58.87 60.20 3bwv n SER 37 Cb 0.00 -0.20 0.16 0.00 -1.01 0.00 0.00 64.21 63.17 3bwv n SER 37 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3bwv n LEU 38 N -1.69 3.22 -4.68 -3.43 4.77 -1.23 -4.91 117.00 109.05 3bwv n LEU 38 Ca 0.06 -1.29 -0.45 0.00 -0.03 0.00 0.00 56.01 54.30 3bwv n LEU 38 Cb 0.36 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 3bwv n LEU 38 CO 0.31 0.63 1.44 0.59 -1.33 0.00 0.00 177.39 179.04 3bwv n ASN 39 N 1.39 3.70 0.00 -1.43 3.02 -1.26 -0.61 115.26 120.07 3bwv n ASN 39 Ca 0.17 0.99 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 3bwv n ASN 39 Cb 0.59 -1.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.29 3bwv n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3bwv n GLY 40 N 4.16 0.98 3.45 7.41 0.00 0.57 -4.96 105.19 116.80 3bwv n GLY 40 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 3bwv n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bwv s LYS 41 N -0.04 1.61 -0.01 1.61 1.02 0.22 -4.83 119.74 119.32 3bwv s LYS 41 Ca 0.00 -1.47 0.17 0.00 0.02 0.00 0.00 55.97 54.70 3bwv s LYS 41 Cb 0.00 -1.91 -0.22 0.00 -0.52 0.00 0.00 37.83 35.19 3bwv s LYS 41 CO 0.00 0.41 0.60 1.63 -0.92 0.00 0.00 175.35 177.07 3bwv n LYS 42 N 0.27 1.06 -1.56 1.68 5.02 -1.26 -3.67 118.16 119.70 3bwv n LYS 42 Ca -0.13 -0.06 0.08 0.00 -2.02 0.00 0.00 58.31 56.19 3bwv n LYS 42 Cb 0.56 -1.35 -0.05 0.00 -0.02 0.00 0.00 35.03 34.17 3bwv n LYS 42 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 3bwv n LEU 43 N -1.67 -1.43 0.17 -0.35 -0.00 -1.26 -5.09 117.00 107.38 3bwv n LEU 43 Ca 0.01 2.74 0.13 0.00 -0.00 0.00 0.00 56.01 58.90 3bwv n LEU 43 Cb 0.34 -3.21 0.55 0.00 -0.00 0.00 0.00 43.42 41.10 3bwv n LEU 43 CO 0.36 -1.47 0.90 1.23 -0.00 0.00 0.00 177.39 178.40 3bwv h GLY 52 N -0.59 0.00 1.90 1.47 0.00 -2.10 -3.51 103.07 100.25 3bwv h GLY 52 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.23 3bwv h GLY 52 CO 0.04 0.00 -0.05 1.47 0.00 0.00 0.00 176.54 177.99 3bwv n LEU 53 N -2.48 0.19 -0.81 3.11 -0.00 -1.26 -2.44 117.00 113.30 3bwv n LEU 53 Ca 0.02 0.47 0.00 0.00 -0.00 0.00 0.00 56.01 56.49 3bwv n LEU 53 Cb 0.25 -0.44 0.00 0.00 -0.00 0.00 0.00 43.42 43.23 3bwv n LEU 53 CO 0.22 -0.02 0.21 0.52 -0.00 0.00 0.00 177.39 178.32 3bwv n VAL 54 N -1.63 0.32 0.00 1.47 0.31 -1.26 -1.03 118.33 116.50 3bwv n VAL 54 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 3bwv n VAL 54 Cb 0.36 -0.57 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 3bwv n VAL 54 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3bwv n ASP 56 N 0.55 0.00 -0.10 4.52 9.92 -1.02 -1.23 116.55 129.20 3bwv n ASP 56 Ca 0.00 0.00 -0.07 0.00 -0.53 0.00 0.00 54.79 54.19 3bwv n ASP 56 Cb 0.21 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.69 3bwv n ASP 56 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 3bwv h ILE 57 N 0.00 0.99 0.00 0.53 2.04 -1.39 -2.59 117.51 117.10 3bwv h ILE 57 Ca 0.00 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.67 3bwv h ILE 57 Cb 0.00 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3bwv h ILE 57 CO 0.00 0.07 -0.31 -0.07 0.00 0.00 0.00 178.15 177.84 3bwv h LEU 58 N 0.36 0.00 -1.36 1.44 3.38 -1.43 -2.81 115.31 114.90 3bwv h LEU 58 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3bwv h LEU 58 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3bwv h LEU 58 CO -0.09 0.31 -0.00 0.29 0.09 0.00 0.00 178.44 179.03 3bwv n LYS 59 N -4.03 1.93 -2.26 1.13 5.02 -1.12 -4.82 118.16 114.01 3bwv n LYS 59 Ca -0.02 -1.36 -0.42 0.00 -2.02 0.00 0.00 58.31 54.49 3bwv n LYS 59 Cb 0.37 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 3bwv n LYS 59 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3bwv s GLU 60 N -2.01 4.36 0.25 1.97 2.02 -0.99 -4.89 118.70 119.42 3bwv s GLU 60 Ca 0.34 1.96 -0.31 0.00 0.02 0.00 0.00 54.97 56.98 3bwv s GLU 60 Cb 0.21 -3.28 -0.13 0.00 0.10 0.00 0.00 34.13 31.03 3bwv s GLU 60 CO 0.32 -0.36 1.54 -2.30 0.02 0.00 0.00 175.26 174.48 3bwv n PRO 61 N 3.86 2.40 0.00 0.39 -0.02 -1.26 -1.74 135.00 138.63 3bwv n PRO 61 Ca 0.10 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 3bwv n PRO 61 Cb 0.44 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 3bwv n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bwv n GLY 62 N 2.48 1.95 0.23 -1.23 0.00 -1.26 -4.98 105.19 102.38 3bwv n GLY 62 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 3bwv n GLY 62 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3bwv h PHE 63 N 0.00 -0.50 0.00 1.61 3.57 -1.65 -1.18 116.94 118.79 3bwv h PHE 63 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3bwv h PHE 63 Cb 0.00 0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.98 3bwv h PHE 63 CO 0.00 -0.27 0.00 0.74 -2.23 0.00 0.00 178.31 176.55 3bwv h PHE 64 N -0.25 0.00 0.00 0.41 0.04 -1.87 -2.86 116.94 112.41 3bwv h PHE 64 Ca 0.09 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.75 3bwv h PHE 64 Cb 0.39 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3bwv h PHE 64 CO -0.29 0.00 -0.54 -0.09 -0.60 0.00 0.00 178.31 176.78 3bwv h ARG 65 N 0.00 0.00 -0.55 1.51 9.65 -1.42 -3.30 114.38 120.27 3bwv h ARG 65 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3bwv h ARG 65 Cb 0.58 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 3bwv h ARG 65 CO 0.00 0.54 0.00 0.09 2.80 0.00 0.00 179.97 183.40 3bwv n ASN 66 N -3.61 3.63 -4.77 -3.80 3.02 -0.95 -4.85 115.26 103.93 3bwv n ASN 66 Ca -0.00 -1.99 -0.39 0.00 -0.03 0.00 0.00 54.58 52.17 3bwv n ASN 66 Cb 0.61 -0.36 -0.01 0.00 -0.61 0.00 0.00 39.78 39.40 3bwv n ASN 66 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3bwv s LEU 67 N -1.25 4.18 0.49 3.41 1.43 -1.24 -5.01 118.68 120.70 3bwv s LEU 67 Ca 0.43 2.46 -0.21 0.00 -1.03 0.00 0.00 54.13 55.79 3bwv s LEU 67 Cb 0.24 -4.00 -0.07 0.00 0.03 0.00 0.00 46.19 42.39 3bwv s LEU 67 CO 0.32 -0.78 1.11 -1.81 0.23 0.00 0.00 176.35 175.42 3bwv s ASP 68 N -1.00 6.11 0.00 2.29 1.01 -1.26 -4.91 116.67 118.91 3bwv s ASP 68 Ca 0.58 2.13 0.00 0.00 0.71 0.00 0.00 52.55 55.97 3bwv s ASP 68 Cb -0.33 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.01 3bwv s ASP 68 CO 0.42 -0.95 0.00 0.52 0.21 0.00 0.00 175.17 175.38 3bwv n VAL 69 N -0.86 0.00 -3.73 -1.27 0.31 -1.26 -0.83 118.33 110.69 3bwv n VAL 69 Ca 0.09 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.06 3bwv n VAL 69 Cb 0.50 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.36 3bwv n VAL 69 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3bwv s PRO 71 N 0.00 3.96 0.00 5.55 0.02 -1.26 -4.75 135.00 138.52 3bwv s PRO 71 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 61.00 60.92 3bwv s PRO 71 Cb 0.00 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.18 3bwv s PRO 71 CO 0.00 0.45 0.00 0.72 -0.33 0.00 0.00 177.00 177.84 3bwv n HIS 72 N 2.97 0.00 -0.23 6.54 8.25 -1.26 -4.25 115.22 127.24 3bwv n HIS 72 Ca -0.16 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.23 3bwv n HIS 72 Cb 0.53 -1.05 0.07 0.00 1.12 0.00 0.00 29.99 30.66 3bwv n HIS 72 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3bwv h ALA 73 N 0.00 0.97 -0.44 -1.41 0.00 -1.92 -1.18 119.26 115.27 3bwv h ALA 73 Ca 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3bwv h ALA 73 Cb 0.26 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3bwv h ALA 73 CO 0.00 0.66 0.11 1.96 0.00 0.00 0.00 179.25 181.98 3bwv h GLN 74 N 1.03 0.70 -0.17 0.00 4.20 -1.91 -0.88 115.11 118.08 3bwv h GLN 74 Ca 0.21 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 3bwv h GLN 74 Cb 0.40 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3bwv h GLN 74 CO 0.01 0.70 -0.01 1.49 -0.67 0.00 0.00 178.83 180.35 3bwv h GLU 75 N 0.57 0.31 -0.13 1.46 4.81 -1.94 -1.71 114.58 117.96 3bwv h GLU 75 Ca 0.14 -0.11 -0.22 0.00 -0.13 0.00 0.00 59.36 59.04 3bwv h GLU 75 Cb 0.31 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.67 3bwv h GLU 75 CO 0.00 0.54 -0.79 0.28 -0.73 0.00 0.00 179.01 178.31 3bwv h VAL 76 N 0.05 1.29 -0.65 0.32 2.07 -1.17 -1.35 116.25 116.82 3bwv h VAL 76 Ca 0.05 -2.02 -0.06 0.00 0.82 0.00 0.00 66.70 65.49 3bwv h VAL 76 Cb 0.41 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 3bwv h VAL 76 CO 0.01 0.63 0.17 0.58 0.02 0.00 0.00 177.57 178.98 3bwv h VAL 77 N 0.49 1.26 -0.66 2.57 2.07 -1.23 0.15 116.25 120.90 3bwv h VAL 77 Ca -0.05 -0.92 0.01 0.00 0.82 0.00 0.00 66.70 66.56 3bwv h VAL 77 Cb 1.41 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 3bwv h VAL 77 CO 0.16 0.35 0.43 0.50 0.02 0.00 0.00 177.57 179.03 3bwv h LYS 78 N 0.96 0.86 -0.42 1.57 3.64 -1.15 0.11 116.57 122.14 3bwv h LYS 78 Ca 0.21 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3bwv h LYS 78 Cb 0.35 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 3bwv h LYS 78 CO 0.00 0.57 0.10 1.96 -2.27 0.00 0.00 179.45 179.81 3bwv h GLN 79 N 0.88 0.67 -0.88 1.90 4.20 -0.94 -2.82 115.11 118.12 3bwv h GLN 79 Ca 0.24 -0.16 0.02 0.00 0.06 0.00 0.00 58.65 58.82 3bwv h GLN 79 Cb -0.09 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.56 3bwv h GLN 79 CO -0.06 0.68 0.58 -0.07 -0.67 0.00 0.00 178.83 179.30 3bwv h LEU 80 N 0.54 0.98 -2.53 1.46 3.38 -0.68 -1.53 115.31 116.93 3bwv h LEU 80 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3bwv h LEU 80 Cb 0.31 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3bwv h LEU 80 CO 0.00 0.69 0.00 -1.13 0.09 0.00 0.00 178.44 178.09 3bwv h ASN 81 N 1.14 0.00 0.27 -0.43 -1.24 -0.72 0.18 115.58 114.78 3bwv h ASN 81 Ca 0.34 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.30 3bwv h ASN 81 Cb -0.04 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 3bwv h ASN 81 CO -0.09 0.00 -0.24 -0.33 -1.29 0.00 0.00 177.43 175.48 3bwv h GLU 82 N 0.00 0.00 0.00 6.67 5.08 -1.16 -3.35 114.58 121.82 3bwv h GLU 82 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3bwv h GLU 82 Cb 0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3bwv h GLU 82 CO 0.00 0.24 -1.08 0.72 -1.00 0.00 0.00 179.01 177.90 3bwv n HIS 83 N -4.18 0.00 -4.62 4.33 8.25 -0.61 -5.05 115.22 113.33 3bwv n HIS 83 Ca -0.02 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.19 3bwv n HIS 83 Cb 0.30 -0.05 -0.14 0.00 1.12 0.00 0.00 29.99 31.22 3bwv n HIS 83 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3bwv s TYR 84 N -2.07 1.72 0.27 4.41 1.51 0.55 -4.40 117.35 119.33 3bwv s TYR 84 Ca -0.01 -0.37 -0.29 0.00 -1.01 0.00 0.00 57.07 55.39 3bwv s TYR 84 Cb 0.01 -1.03 -0.09 0.00 -0.11 0.00 0.00 41.96 40.73 3bwv s TYR 84 CO 0.06 0.07 1.16 -0.51 -1.11 0.00 0.00 175.55 175.22 3bwv s ASP 85 N -1.12 7.14 -0.18 2.29 1.01 -0.10 -4.05 116.67 121.67 3bwv s ASP 85 Ca 0.07 2.34 -0.02 0.00 0.71 0.00 0.00 52.55 55.65 3bwv s ASP 85 Cb -0.09 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.21 3bwv s ASP 85 CO 0.02 -0.26 -0.10 -0.63 0.21 0.00 0.00 175.17 174.40 3bwv s ILE 86 N -0.92 3.03 0.07 0.77 -1.09 -1.26 -0.96 121.20 120.83 3bwv s ILE 86 Ca 0.47 -0.63 0.07 0.00 -2.23 0.00 0.00 60.65 58.33 3bwv s ILE 86 Cb -0.33 -2.33 -0.04 0.00 -1.58 0.00 0.00 42.46 38.18 3bwv s ILE 86 CO 0.42 0.48 -0.15 -0.31 -1.23 0.00 0.00 174.94 174.15 3bwv s TYR 87 N 1.03 2.62 -0.16 3.97 1.51 -0.09 -4.79 117.35 121.44 3bwv s TYR 87 Ca -0.01 -0.22 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 3bwv s TYR 87 Cb -0.15 -1.45 -0.02 0.00 -0.11 0.00 0.00 41.96 40.24 3bwv s TYR 87 CO -0.02 0.33 -0.08 0.42 -1.11 0.00 0.00 175.55 175.09 3bwv s ILE 88 N -1.03 3.43 -0.07 2.71 -1.09 -0.46 -0.76 121.20 123.92 3bwv s ILE 88 Ca 0.17 -0.52 0.05 0.00 -2.23 0.00 0.00 60.65 58.13 3bwv s ILE 88 Cb -0.11 -2.49 -0.01 0.00 -1.58 0.00 0.00 42.46 38.28 3bwv s ILE 88 CO 0.08 0.49 -0.24 0.00 -1.23 0.00 0.00 174.94 174.04 3bwv s ALA 89 N 0.55 2.14 0.04 9.38 0.00 -0.01 -0.16 121.76 133.69 3bwv s ALA 89 Ca -0.05 -1.00 -0.22 0.00 0.00 0.00 0.00 51.96 50.68 3bwv s ALA 89 Cb -0.15 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.31 3bwv s ALA 89 CO 0.03 0.37 0.52 -0.08 0.00 0.00 0.00 175.76 176.59 3bwv s THR 90 N 0.03 0.03 0.32 0.00 -1.32 -0.37 -4.18 115.64 110.15 3bwv s THR 90 Ca -0.09 -0.25 -0.10 0.00 -1.21 0.00 0.00 61.69 60.04 3bwv s THR 90 Cb -0.15 -0.96 -0.07 0.00 -1.51 0.00 0.00 72.50 69.81 3bwv s THR 90 CO 0.05 -0.14 0.67 0.00 -2.21 0.00 0.00 174.62 172.99 3bwv s ALA 91 N -2.34 3.45 -0.28 11.08 0.00 -1.22 -1.71 121.76 130.74 3bwv s ALA 91 Ca -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 51.65 3bwv s ALA 91 Cb -0.01 -2.57 0.17 0.00 0.00 0.00 0.00 23.12 20.72 3bwv s ALA 91 CO -0.01 0.23 0.52 0.00 0.00 0.00 0.00 175.76 176.50 3bwv s ALA 92 N -2.11 -1.87 0.00 0.00 0.00 -1.26 -4.98 121.76 111.54 3bwv s ALA 92 Ca 0.49 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.86 3bwv s ALA 92 Cb -0.11 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 20.96 3bwv s ALA 92 CO 0.26 -1.38 0.00 0.28 0.00 0.00 0.00 175.76 174.92 3bwv n VAL 95 N 5.41 -0.65 -0.01 0.00 0.31 -1.26 -4.89 118.33 117.24 3bwv n VAL 95 Ca -0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.15 3bwv n VAL 95 Cb 0.51 -1.76 -0.12 0.00 -0.91 0.00 0.00 33.84 31.56 3bwv n VAL 95 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3bwv h PRO 96 N 0.00 0.28 -0.03 5.55 0.11 -1.97 -3.34 132.00 132.60 3bwv h PRO 96 Ca 0.00 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3bwv h PRO 96 Cb 0.31 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.52 3bwv h PRO 96 CO 0.00 1.03 -0.05 0.25 -0.21 0.00 0.00 178.00 179.02 3bwv n THR 97 N -4.35 0.00 -0.09 -1.15 -2.24 -1.26 -4.58 114.28 100.61 3bwv n THR 97 Ca -0.10 -0.47 -0.07 0.00 -2.27 0.00 0.00 64.05 61.13 3bwv n THR 97 Cb 0.61 1.47 0.11 0.00 -2.10 0.00 0.00 70.33 70.41 3bwv n THR 97 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3bwv h SER 98 N 4.45 0.77 0.01 3.42 4.64 -1.96 -1.70 113.55 123.18 3bwv h SER 98 Ca 0.00 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.09 3bwv h SER 98 Cb 0.97 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.82 3bwv h SER 98 CO 0.00 0.94 -0.15 0.15 -0.87 0.00 0.00 176.83 176.90 3bwv h PHE 99 N 0.67 -0.39 -0.33 4.77 3.57 -1.81 0.40 116.94 123.83 3bwv h PHE 99 Ca 0.10 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 3bwv h PHE 99 Cb 0.68 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 3bwv h PHE 99 CO 0.03 -0.23 0.17 1.25 -2.23 0.00 0.00 178.31 177.31 3bwv h HIS 100 N -0.26 0.47 -0.51 0.41 2.76 -1.82 -2.01 115.15 114.19 3bwv h HIS 100 Ca 0.05 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 3bwv h HIS 100 Cb 0.32 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 3bwv h HIS 100 CO -0.20 0.39 0.29 -0.44 -1.30 0.00 0.00 177.93 176.67 3bwv h ASP 101 N 0.41 0.62 -0.49 3.26 3.32 -1.11 -1.40 116.42 121.03 3bwv h ASP 101 Ca 0.12 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3bwv h ASP 101 Cb 0.09 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3bwv h ASP 101 CO -0.02 0.51 0.23 0.11 -1.72 0.00 0.00 179.24 178.36 3bwv h LYS 102 N 0.68 0.70 -0.36 3.56 1.57 -0.81 -0.67 116.57 121.24 3bwv h LYS 102 Ca 0.18 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.70 3bwv h LYS 102 Cb 0.02 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3bwv h LYS 102 CO -0.03 0.59 -0.38 0.10 -0.57 0.00 0.00 179.45 179.16 3bwv h TYR 103 N 0.64 1.03 -0.84 -1.35 -0.00 -1.10 -1.56 116.97 113.79 3bwv h TYR 103 Ca 0.17 -0.30 -0.04 0.00 0.00 0.00 0.00 58.73 58.56 3bwv h TYR 103 Cb 0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 36.73 36.60 3bwv h TYR 103 CO -0.01 1.10 0.38 0.93 -0.00 0.00 0.00 178.16 180.56 3bwv h GLU 104 N 0.71 1.22 -0.60 0.10 5.08 -1.15 -0.55 114.58 119.39 3bwv h GLU 104 Ca 0.06 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3bwv h GLU 104 Cb 0.96 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 3bwv h GLU 104 CO 0.09 0.96 0.36 2.35 -1.00 0.00 0.00 179.01 181.77 3bwv h TRP 105 N 1.20 0.79 -0.66 4.33 7.01 -0.87 -1.02 115.95 126.74 3bwv h TRP 105 Ca 0.28 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.22 3bwv h TRP 105 Cb 0.16 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 26.93 3bwv h TRP 105 CO 0.02 0.54 0.18 -0.07 -2.79 0.00 0.00 178.44 176.32 3bwv h LEU 106 N 0.81 0.98 -1.03 0.65 3.38 -0.86 -0.46 115.31 118.80 3bwv h LEU 106 Ca 0.22 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3bwv h LEU 106 Cb -0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3bwv h LEU 106 CO -0.04 0.95 0.07 -0.07 0.09 0.00 0.00 178.44 179.44 3bwv h LEU 107 N 0.97 0.72 -0.02 1.67 3.38 -0.90 0.19 115.31 121.32 3bwv h LEU 107 Ca 0.21 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3bwv h LEU 107 Cb 0.34 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3bwv h LEU 107 CO -0.00 0.75 -0.06 -0.08 0.09 0.00 0.00 178.44 179.14 3bwv h GLU 108 N 0.73 0.08 0.00 1.13 4.81 -0.75 -3.30 114.58 117.28 3bwv h GLU 108 Ca 0.15 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.16 3bwv h GLU 108 Cb 0.35 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 3bwv h GLU 108 CO 0.01 0.66 -1.70 0.66 -0.73 0.00 0.00 179.01 177.90 3bwv n TYR 109 N -4.73 0.59 -2.89 0.92 4.01 -0.22 -4.39 117.16 110.45 3bwv n TYR 109 Ca -0.08 0.19 -0.25 0.00 -0.16 0.00 0.00 57.90 57.59 3bwv n TYR 109 Cb 0.33 -0.95 -0.03 0.00 -0.31 0.00 0.00 39.34 38.38 3bwv n TYR 109 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3bwv n PHE 110 N -2.72 3.43 0.36 -0.72 3.01 0.67 -4.91 117.46 116.57 3bwv n PHE 110 Ca -0.13 -3.81 0.12 0.00 1.01 0.00 0.00 57.45 54.64 3bwv n PHE 110 Cb 0.84 -0.42 0.51 0.00 -0.01 0.00 0.00 39.48 40.40 3bwv n PHE 110 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 3bwv n PRO 111 N -0.22 0.19 0.07 -1.08 -0.04 -1.24 -1.99 135.00 130.69 3bwv n PRO 111 Ca 0.31 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.35 3bwv n PRO 111 Cb 0.47 -1.89 0.47 0.00 -0.04 0.00 0.00 33.50 32.52 3bwv n PRO 111 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 3bwv n PHE 112 N -2.24 0.59 -2.76 0.54 1.16 -1.26 -4.81 117.46 108.68 3bwv n PHE 112 Ca 0.01 0.19 -0.32 0.00 -1.87 0.00 0.00 57.45 55.46 3bwv n PHE 112 Cb 0.20 -0.80 -0.05 0.00 -1.61 0.00 0.00 39.48 37.21 3bwv n PHE 112 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3bwv s LEU 113 N -3.99 3.85 -0.22 5.98 1.43 -0.84 -5.04 118.68 119.84 3bwv s LEU 113 Ca 0.10 1.46 -0.17 0.00 -1.03 0.00 0.00 54.13 54.49 3bwv s LEU 113 Cb 0.13 -4.33 -0.03 0.00 0.03 0.00 0.00 46.19 41.98 3bwv s LEU 113 CO 0.51 -0.41 0.47 -0.62 0.23 0.00 0.00 176.35 176.53 3bwv s ASP 114 N -2.66 6.46 0.52 2.29 -1.08 -1.26 -4.93 116.67 116.01 3bwv s ASP 114 Ca 0.57 0.55 0.35 0.00 -0.52 0.00 0.00 52.55 53.50 3bwv s ASP 114 Cb -0.10 -2.26 1.86 0.00 -1.46 0.00 0.00 42.92 40.96 3bwv s ASP 114 CO 0.23 -0.18 2.07 -0.65 0.52 0.00 0.00 175.17 177.16 3bwv h PRO 115 N 7.65 0.00 0.00 4.34 0.11 -1.96 0.64 132.00 142.78 3bwv h PRO 115 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3bwv h PRO 115 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3bwv h PRO 115 CO 0.72 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.55 3bwv n GLN 116 N -2.75 0.07 -0.51 1.05 1.13 -1.26 -2.02 117.38 113.08 3bwv n GLN 116 Ca -0.02 0.33 0.09 0.00 -1.94 0.00 0.00 57.00 55.46 3bwv n GLN 116 Cb 0.08 -1.63 0.31 0.00 0.11 0.00 0.00 30.24 29.11 3bwv n GLN 116 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 3bwv n HIS 117 N -1.76 1.23 -3.12 1.08 8.25 0.22 -4.91 115.22 116.20 3bwv n HIS 117 Ca 0.03 -0.61 -0.40 0.00 -0.26 0.00 0.00 57.72 56.47 3bwv n HIS 117 Cb 0.18 -0.20 -0.06 0.00 1.12 0.00 0.00 29.99 31.03 3bwv n HIS 117 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3bwv s PHE 118 N -1.75 3.42 -0.19 4.41 0.08 -0.86 -1.36 117.98 121.73 3bwv s PHE 118 Ca 0.46 0.97 0.01 0.00 0.12 0.00 0.00 56.93 58.49 3bwv s PHE 118 Cb 0.29 -2.78 0.02 0.00 -0.57 0.00 0.00 43.02 39.99 3bwv s PHE 118 CO 0.22 -0.10 -0.17 0.08 -0.10 0.00 0.00 175.22 175.14 3bwv s VAL 119 N 1.63 2.22 -0.41 -0.44 1.01 0.77 -4.97 120.40 120.21 3bwv s VAL 119 Ca 0.30 -0.95 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 3bwv s VAL 119 Cb -0.16 -1.97 0.07 0.00 0.00 0.00 0.00 36.38 34.31 3bwv s VAL 119 CO 0.11 0.48 0.26 -0.36 0.00 0.00 0.00 175.10 175.59 3bwv s PHE 120 N 1.30 3.30 0.15 5.22 0.40 -1.26 -1.24 117.98 125.85 3bwv s PHE 120 Ca 0.04 -1.32 -0.07 0.00 -0.60 0.00 0.00 56.93 54.97 3bwv s PHE 120 Cb -0.14 -2.85 -0.02 0.00 0.51 0.00 0.00 43.02 40.52 3bwv s PHE 120 CO -0.11 -0.80 0.23 0.00 0.70 0.00 0.00 175.22 175.24 3bwv n GLY 122 N -0.18 -0.53 3.16 0.00 0.00 -1.26 -3.42 105.19 102.96 3bwv n GLY 122 Ca -0.07 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 3bwv n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bwv s ARG 123 N -2.55 2.85 0.00 1.61 0.52 -1.26 -4.93 118.95 115.18 3bwv s ARG 123 Ca -0.24 -0.80 0.16 0.00 -0.52 0.00 0.00 55.73 54.33 3bwv s ARG 123 Cb 0.07 -2.27 0.66 0.00 0.52 0.00 0.00 34.95 33.93 3bwv s ARG 123 CO 0.74 0.03 1.47 1.63 0.02 0.00 0.00 175.30 179.18 3bwv n LYS 124 N 3.94 1.52 0.04 3.54 5.02 -1.26 -3.53 118.16 127.42 3bwv n LYS 124 Ca -0.20 -0.79 0.03 0.00 -2.02 0.00 0.00 58.31 55.34 3bwv n LYS 124 Cb 0.52 -1.31 0.16 0.00 -0.02 0.00 0.00 35.03 34.38 3bwv n LYS 124 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3bwv n ASN 125 N 0.04 0.13 -0.00 4.39 6.94 -1.26 -2.18 115.26 123.32 3bwv n ASN 125 Ca 0.13 0.56 0.13 0.00 -0.02 0.00 0.00 54.58 55.38 3bwv n ASN 125 Cb 0.23 -0.57 0.44 0.00 -2.36 0.00 0.00 39.78 37.52 3bwv n ASN 125 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3bwv n ILE 126 N -1.67 0.00 -3.12 1.53 0.13 -1.23 -4.78 119.36 110.22 3bwv n ILE 126 Ca 0.00 -0.00 -0.40 0.00 -1.10 0.00 0.00 62.75 61.25 3bwv n ILE 126 Cb 0.03 -0.13 -0.06 0.00 -0.84 0.00 0.00 39.64 38.65 3bwv n ILE 126 CO 0.00 0.00 0.00 -0.63 2.80 0.00 0.00 176.55 178.72 3bwv s ILE 127 N -2.99 5.03 -0.62 9.51 1.01 -0.93 -5.02 121.20 127.19 3bwv s ILE 127 Ca 0.13 1.21 -0.21 0.00 0.00 0.00 0.00 60.65 61.78 3bwv s ILE 127 Cb 0.18 -3.95 0.08 0.00 0.01 0.00 0.00 42.46 38.79 3bwv s ILE 127 CO 0.61 0.14 0.84 -0.22 0.00 0.00 0.00 174.94 176.31 3bwv s LEU 128 N 1.71 4.84 0.09 2.97 2.96 -1.26 -4.67 118.68 125.32 3bwv s LEU 128 Ca 0.30 -1.18 -0.13 0.00 -0.22 0.00 0.00 54.13 52.90 3bwv s LEU 128 Cb -0.16 -2.37 0.02 0.00 0.50 0.00 0.00 46.19 44.17 3bwv s LEU 128 CO 0.11 -1.29 0.30 0.00 -1.32 0.00 0.00 176.35 174.16 3bwv s ALA 129 N 3.43 -0.62 0.29 5.97 0.00 -1.26 -5.01 121.76 124.56 3bwv s ALA 129 Ca 0.17 -0.24 0.06 0.00 0.00 0.00 0.00 51.96 51.95 3bwv s ALA 129 Cb -0.20 0.53 0.45 0.00 0.00 0.00 0.00 23.12 23.90 3bwv s ALA 129 CO 0.09 -0.54 1.70 -0.44 0.00 0.00 0.00 175.76 176.56 3bwv h ASP 130 N 2.69 0.29 -4.44 0.00 3.32 -1.71 -3.35 116.42 113.22 3bwv h ASP 130 Ca -0.33 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.42 3bwv h ASP 130 Cb 1.22 -0.08 -0.24 0.00 0.22 0.00 0.00 39.33 40.46 3bwv h ASP 130 CO 0.50 0.66 -0.59 -0.31 -1.72 0.00 0.00 179.24 177.78 3bwv s TYR 131 N -4.19 0.03 -0.10 4.55 1.51 -1.08 -0.71 117.35 117.36 3bwv s TYR 131 Ca -0.05 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 55.97 3bwv s TYR 131 Cb 0.13 -0.04 0.02 0.00 -0.11 0.00 0.00 41.96 41.95 3bwv s TYR 131 CO 0.78 -0.16 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.76 3bwv s LEU 132 N -0.77 1.61 -0.34 -1.29 2.96 -0.13 -0.58 118.68 120.14 3bwv s LEU 132 Ca -0.08 -0.37 -0.12 0.00 -0.22 0.00 0.00 54.13 53.34 3bwv s LEU 132 Cb -0.05 -0.97 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 3bwv s LEU 132 CO 0.00 -0.00 0.22 -0.63 -1.32 0.00 0.00 176.35 174.62 3bwv s ILE 133 N 1.02 5.07 -0.02 6.68 1.01 0.20 -0.23 121.20 134.91 3bwv s ILE 133 Ca -0.07 -0.32 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 3bwv s ILE 133 Cb -0.15 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.72 3bwv s ILE 133 CO -0.01 -0.02 0.26 -0.62 0.00 0.00 0.00 174.94 174.56 3bwv s ASP 134 N 1.68 -0.14 0.08 3.58 -1.08 -0.90 -1.52 116.67 118.37 3bwv s ASP 134 Ca 0.05 0.05 0.25 0.00 -0.52 0.00 0.00 52.55 52.38 3bwv s ASP 134 Cb -0.17 0.31 0.53 0.00 -1.46 0.00 0.00 42.92 42.12 3bwv s ASP 134 CO 0.09 -0.40 1.46 -0.90 0.52 0.00 0.00 175.17 175.94 3bwv n ASP 135 N 1.45 0.58 -4.50 -0.34 5.75 -1.26 -1.56 116.55 116.67 3bwv n ASP 135 Ca -0.21 0.10 -0.42 0.00 -0.01 0.00 0.00 54.79 54.25 3bwv n ASP 135 Cb 0.56 0.03 -0.09 0.00 -1.03 0.00 0.00 41.12 40.59 3bwv n ASP 135 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3bwv s ASN 136 N -3.78 6.19 0.59 -1.12 2.47 -1.26 -4.80 114.94 113.23 3bwv s ASN 136 Ca 0.09 -0.52 0.33 0.00 0.42 0.00 0.00 52.86 53.18 3bwv s ASN 136 Cb 0.15 -2.22 1.84 0.00 -1.45 0.00 0.00 41.25 39.57 3bwv s ASN 136 CO 0.68 -0.50 2.22 1.55 -3.72 0.00 0.00 177.10 177.33 3bwv h PRO 137 N 8.64 0.00 -0.29 0.43 0.13 -1.99 -1.95 132.00 136.97 3bwv h PRO 137 Ca -0.27 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.79 3bwv h PRO 137 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 3bwv h PRO 137 CO 0.76 0.04 -0.09 0.87 -0.23 0.00 0.00 178.00 179.35 3bwv h LYS 138 N 0.00 0.48 -0.02 0.86 6.56 -2.00 -1.15 116.57 121.30 3bwv h LYS 138 Ca -0.00 -0.13 -0.19 0.00 -1.06 0.00 0.00 60.65 59.27 3bwv h LYS 138 Cb 0.12 -0.06 0.01 0.00 -0.57 0.00 0.00 32.23 31.74 3bwv h LYS 138 CO 0.00 0.58 -0.75 1.96 -2.06 0.00 0.00 179.45 179.19 3bwv h GLN 139 N 0.45 0.54 -0.59 3.15 1.08 -1.81 -3.28 115.11 114.66 3bwv h GLN 139 Ca 0.09 -0.56 -0.04 0.00 -1.45 0.00 0.00 58.65 56.70 3bwv h GLN 139 Cb 0.44 0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.99 3bwv h GLN 139 CO 0.02 1.18 0.22 -0.07 -0.95 0.00 0.00 178.83 179.24 3bwv h LEU 140 N 0.12 0.80 -1.26 1.46 3.38 -1.24 -1.64 115.31 116.93 3bwv h LEU 140 Ca -0.09 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 3bwv h LEU 140 Cb 1.43 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 3bwv h LEU 140 CO 0.15 0.73 -0.34 1.05 0.09 0.00 0.00 178.44 180.12 3bwv h GLU 141 N 0.85 0.00 0.00 1.13 4.11 -1.28 -3.19 114.58 116.20 3bwv h GLU 141 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.63 3bwv h GLU 141 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3bwv h GLU 141 CO -0.02 0.34 -1.38 0.44 0.07 0.00 0.00 179.01 178.47 3bwv n ILE 142 N -3.83 0.07 -1.93 -1.06 -5.35 -0.91 -4.94 119.36 101.40 3bwv n ILE 142 Ca -0.01 -0.27 -0.41 0.00 -0.27 0.00 0.00 62.75 61.78 3bwv n ILE 142 Cb 0.42 0.36 -0.02 0.00 -1.74 0.00 0.00 39.64 38.66 3bwv n ILE 142 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3bwv s PHE 143 N -3.26 2.89 -1.21 4.28 5.36 -0.66 -4.37 117.98 121.01 3bwv s PHE 143 Ca 0.01 1.00 0.24 0.00 -0.96 0.00 0.00 56.93 57.21 3bwv s PHE 143 Cb 0.15 -3.91 0.29 0.00 -0.34 0.00 0.00 43.02 39.21 3bwv s PHE 143 CO 0.86 -2.92 1.26 0.39 -1.46 0.00 0.00 175.22 173.36 3bwv n GLU 144 N 1.95 0.24 -0.05 10.12 1.02 -1.26 -4.87 120.64 127.78 3bwv n GLU 144 Ca 0.06 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 3bwv n GLU 144 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 3bwv n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bwv n GLY 145 N 1.47 -0.37 3.66 0.62 0.00 -1.26 -5.03 105.19 104.28 3bwv n GLY 145 Ca 0.06 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 3bwv n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3bwv s LYS 146 N -0.43 4.25 -0.18 1.61 2.47 0.11 -4.91 119.74 122.66 3bwv s LYS 146 Ca 0.00 1.39 -0.22 0.00 -1.56 0.00 0.00 55.97 55.58 3bwv s LYS 146 Cb 0.00 -3.66 -0.02 0.00 -1.46 0.00 0.00 37.83 32.68 3bwv s LYS 146 CO 0.00 -0.65 0.68 -1.12 0.16 0.00 0.00 175.35 174.42 3bwv s SER 147 N 1.33 6.77 0.00 1.43 0.01 -1.26 -0.96 113.70 121.02 3bwv s SER 147 Ca 0.46 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.66 3bwv s SER 147 Cb -0.16 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.69 3bwv s SER 147 CO 0.08 -0.29 0.00 -0.38 0.41 0.00 0.00 173.24 173.06 3bwv n ILE 148 N 4.62 0.00 -3.65 1.44 5.41 0.67 -4.23 119.36 123.63 3bwv n ILE 148 Ca -0.00 0.00 -0.05 0.00 1.00 0.00 0.00 62.75 63.70 3bwv n ILE 148 Cb 0.50 -0.03 -0.06 0.00 -0.71 0.00 0.00 39.64 39.33 3bwv n ILE 148 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 3bwv s PHE 150 N 0.84 -1.14 0.24 1.39 5.36 -0.60 -2.12 117.98 121.95 3bwv s PHE 150 Ca 0.00 2.12 -0.30 0.00 -0.96 0.00 0.00 56.93 57.78 3bwv s PHE 150 Cb 0.00 0.66 -0.11 0.00 -0.34 0.00 0.00 43.02 43.24 3bwv s PHE 150 CO 0.00 -0.57 1.54 0.99 -1.46 0.00 0.00 175.22 175.71 3bwv s THR 151 N 2.25 2.42 0.05 0.12 2.01 -0.26 -4.28 115.64 117.95 3bwv s THR 151 Ca -0.08 0.34 -0.04 0.00 0.31 0.00 0.00 61.69 62.22 3bwv s THR 151 Cb -0.09 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 3bwv s THR 151 CO -0.18 0.05 0.07 0.00 -0.69 0.00 0.00 174.62 173.86 3bwv s ALA 152 N 0.33 0.07 0.28 7.40 0.00 -1.26 -4.84 121.76 123.73 3bwv s ALA 152 Ca 0.64 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.88 3bwv s ALA 152 Cb -0.45 0.28 0.59 0.00 0.00 0.00 0.00 23.12 23.55 3bwv s ALA 152 CO 0.41 -0.35 1.78 0.66 0.00 0.00 0.00 175.76 178.27 3bwv h SER 153 N 3.47 0.70 0.44 0.00 4.64 -1.90 -1.37 113.55 119.52 3bwv h SER 153 Ca -0.33 0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 3bwv h SER 153 Cb 1.18 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3bwv h SER 153 CO 0.55 0.31 -0.13 1.12 -0.87 0.00 0.00 176.83 177.80 3bwv h HIS 154 N 0.76 0.00 -0.51 4.77 2.07 -1.75 0.16 115.15 120.65 3bwv h HIS 154 Ca 0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.02 3bwv h HIS 154 Cb 0.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 3bwv h HIS 154 CO -0.04 0.13 0.00 0.27 -3.07 0.00 0.00 177.93 175.22 3bwv n ASN 155 N -3.60 3.43 0.23 3.10 0.23 -0.52 -4.29 115.26 113.84 3bwv n ASN 155 Ca -0.02 -1.97 0.16 0.00 -0.53 0.00 0.00 54.58 52.23 3bwv n ASN 155 Cb 0.26 -0.34 0.78 0.00 -2.08 0.00 0.00 39.78 38.41 3bwv n ASN 155 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 3bwv h VAL 156 N 3.47 0.00 -0.41 3.53 -1.51 -1.59 -1.12 116.25 118.62 3bwv h VAL 156 Ca 0.00 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.32 3bwv h VAL 156 Cb 0.88 0.93 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 3bwv h VAL 156 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 3bwv n TYR 157 N -2.66 0.53 -2.95 5.19 4.01 -1.26 -4.92 117.16 115.09 3bwv n TYR 157 Ca -0.01 -0.27 -0.40 0.00 -0.16 0.00 0.00 57.90 57.07 3bwv n TYR 157 Cb 0.14 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.12 3bwv n TYR 157 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 3bwv s GLU 158 N -1.46 4.51 0.00 -0.72 2.56 -0.43 -4.96 118.70 118.20 3bwv s GLU 158 Ca 0.40 1.11 0.00 0.00 0.00 0.00 0.00 54.97 56.47 3bwv s GLU 158 Cb 0.23 -3.38 0.00 0.00 2.00 0.00 0.00 34.13 32.98 3bwv s GLU 158 CO 0.32 0.24 0.21 0.72 -0.56 0.00 0.00 175.26 176.19 3bwv n HIS 159 N 2.94 0.00 0.21 5.30 8.25 -1.26 -4.81 115.22 125.85 3bwv n HIS 159 Ca -0.01 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.52 3bwv n HIS 159 Cb 0.50 0.00 0.46 0.00 1.12 0.00 0.00 29.99 32.07 3bwv n HIS 159 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3bwv h ARG 160 N 0.00 0.00 -6.46 -0.41 3.08 -2.00 -3.45 114.38 105.14 3bwv h ARG 160 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3bwv h ARG 160 Cb 0.10 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 29.99 3bwv h ARG 160 CO 0.00 0.29 -0.73 -0.06 -1.07 0.00 0.00 179.97 178.40 3bwv s PHE 161 N -3.91 2.78 -0.15 3.04 0.08 -1.26 -5.07 117.98 113.50 3bwv s PHE 161 Ca -0.01 -0.12 -0.39 0.00 0.12 0.00 0.00 56.93 56.52 3bwv s PHE 161 Cb 0.12 -1.49 -0.17 0.00 -0.57 0.00 0.00 43.02 40.91 3bwv s PHE 161 CO 0.66 0.40 1.54 -1.91 -0.10 0.00 0.00 175.22 175.81 3bwv n GLU 162 N 1.02 0.98 -4.11 0.44 4.07 -1.26 -4.97 120.64 116.81 3bwv n GLU 162 Ca -0.14 0.36 -0.35 0.00 -0.06 0.00 0.00 57.16 56.97 3bwv n GLU 162 Cb 0.52 -2.00 -0.10 0.00 -0.06 0.00 0.00 31.44 29.81 3bwv n GLU 162 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 3bwv s ARG 163 N 2.16 3.77 -0.05 5.31 3.52 -1.26 -4.53 118.95 127.87 3bwv s ARG 163 Ca 0.93 -0.36 0.06 0.00 -0.13 0.00 0.00 55.73 56.23 3bwv s ARG 163 Cb -1.08 -3.11 -0.01 0.00 -1.56 0.00 0.00 34.95 29.19 3bwv s ARG 163 CO 0.60 0.36 -0.25 0.14 -0.81 0.00 0.00 175.30 175.33 3bwv s VAL 164 N 0.11 2.04 -0.62 7.11 -7.23 -1.26 -5.03 120.40 115.52 3bwv s VAL 164 Ca 0.04 -1.07 -0.02 0.00 -1.81 0.00 0.00 61.98 59.12 3bwv s VAL 164 Cb -0.12 -1.72 0.16 0.00 0.56 0.00 0.00 36.38 35.25 3bwv s VAL 164 CO 0.01 0.57 0.42 -0.44 -0.31 0.00 0.00 175.10 175.35 3bwv s SER 165 N -0.23 5.15 0.00 4.85 0.01 -1.26 -1.10 113.70 121.12 3bwv s SER 165 Ca -0.02 -2.87 0.00 0.00 1.31 0.00 0.00 55.95 54.37 3bwv s SER 165 Cb -0.13 -1.83 0.00 0.00 0.21 0.00 0.00 66.02 64.27 3bwv s SER 165 CO 0.03 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 173.94 3bwv n GLY 166 N 3.44 1.40 0.21 3.44 0.00 -1.26 -4.31 105.19 108.11 3bwv n GLY 166 Ca 0.08 -1.87 -0.05 0.00 0.00 0.00 0.00 46.02 44.18 3bwv n GLY 166 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3bwv h TRP 167 N 0.00 0.46 0.00 1.61 4.06 -1.93 -2.17 115.95 117.98 3bwv h TRP 167 Ca 0.00 -0.13 -0.05 0.00 2.06 0.00 0.00 58.89 60.77 3bwv h TRP 167 Cb 0.00 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.05 3bwv h TRP 167 CO 0.00 0.75 -0.25 0.00 -3.56 0.00 0.00 178.44 175.38 3bwv h ARG 168 N 0.32 0.00 -0.11 0.49 2.47 -1.87 -0.55 114.38 115.13 3bwv h ARG 168 Ca 0.03 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.58 3bwv h ARG 168 Cb 0.88 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.19 3bwv h ARG 168 CO 0.07 0.25 -0.64 0.22 0.56 0.00 0.00 179.97 180.43 3bwv h ASP 169 N 0.00 0.49 -0.46 7.04 3.58 -1.67 -1.38 116.42 124.02 3bwv h ASP 169 Ca -0.00 -0.29 -0.01 0.00 0.42 0.00 0.00 57.03 57.14 3bwv h ASP 169 Cb 0.59 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.47 3bwv h ASP 169 CO 0.03 1.00 0.24 0.58 -2.88 0.00 0.00 179.24 178.22 3bwv h VAL 170 N 0.31 1.17 -0.78 2.25 2.07 -0.78 0.15 116.25 120.63 3bwv h VAL 170 Ca -0.01 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 3bwv h VAL 170 Cb 1.19 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 3bwv h VAL 170 CO 0.11 0.18 0.42 0.50 0.02 0.00 0.00 177.57 178.81 3bwv h LYS 171 N 0.60 1.10 -0.65 1.57 3.64 -0.90 -1.84 116.57 120.08 3bwv h LYS 171 Ca 0.16 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 3bwv h LYS 171 Cb 0.07 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 3bwv h LYS 171 CO -0.02 0.82 0.23 -0.97 -2.27 0.00 0.00 179.45 177.23 3bwv h ASN 172 N 1.09 0.90 0.02 4.20 -1.24 -0.87 0.45 115.58 120.12 3bwv h ASN 172 Ca 0.27 -0.14 0.01 0.00 0.71 0.00 0.00 56.30 57.15 3bwv h ASN 172 Cb 0.04 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 38.85 3bwv h ASN 172 CO -0.04 0.83 -0.05 0.22 -1.29 0.00 0.00 177.43 177.09 3bwv h TYR 173 N 0.95 -0.13 -0.27 0.67 3.20 -0.10 -2.06 116.97 119.23 3bwv h TYR 173 Ca 0.22 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.98 3bwv h TYR 173 Cb 0.23 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 3bwv h TYR 173 CO 0.02 -0.08 -0.30 0.74 -1.64 0.00 0.00 178.16 176.89 3bwv h PHE 174 N -0.10 0.64 -0.91 -3.82 0.04 -1.13 -2.55 116.94 109.10 3bwv h PHE 174 Ca 0.02 -0.16 0.08 0.00 2.80 0.00 0.00 57.97 60.71 3bwv h PHE 174 Cb 0.12 -0.15 -0.06 0.00 2.20 0.00 0.00 35.95 38.06 3bwv h PHE 174 CO -0.11 0.80 0.59 -0.91 -0.60 0.00 0.00 178.31 178.08 3bwv h ASN 175 N 0.48 0.88 0.90 2.17 -0.26 -0.85 -2.76 115.58 116.14 3bwv h ASN 175 Ca 0.06 0.01 -0.08 0.00 -0.56 0.00 0.00 56.30 55.74 3bwv h ASN 175 Cb 0.77 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.84 3bwv h ASN 175 CO 0.06 0.55 -0.37 0.77 -1.06 0.00 0.00 177.43 177.38 3bwv h SER 176 N 0.99 0.00 0.30 5.81 4.64 -0.95 -2.51 113.55 121.83 3bwv h SER 176 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3bwv h SER 176 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3bwv h SER 176 CO -0.16 0.37 -0.27 2.30 -0.87 0.00 0.00 176.83 178.20 3bwv n ILE 177 N -3.50 0.00 1.60 0.95 -5.35 -1.06 -5.12 119.36 106.89 3bwv n ILE 177 Ca -0.00 -0.10 0.14 0.00 -0.27 0.00 0.00 62.75 62.52 3bwv n ILE 177 Cb 0.52 0.30 0.61 0.00 -1.74 0.00 0.00 39.64 39.33 3bwv n ILE 177 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17