#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wro n GLU 2 N 0.00 0.18 -3.62 2.12 0.28 -1.26 -4.78 120.64 113.56 2wro n GLU 2 Ca 0.00 -0.38 -0.15 0.00 -0.16 0.00 0.00 57.16 56.47 2wro n GLU 2 Cb 0.00 0.50 -0.14 0.00 1.43 0.00 0.00 31.44 33.23 2wro n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2wro s ALA 3 N -1.23 -0.40 0.52 -1.84 0.00 -1.14 -4.92 121.76 112.75 2wro s ALA 3 Ca 0.05 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 52.64 2wro s ALA 3 Cb -0.01 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 2wro s ALA 3 CO 0.02 -0.75 0.84 0.21 0.00 0.00 0.00 175.76 176.07 2wro s LYS 4 N 2.37 3.38 0.00 0.00 2.20 -1.26 -1.00 119.74 125.43 2wro s LYS 4 Ca 0.03 0.20 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 2wro s LYS 4 Cb -0.13 -2.32 0.00 0.00 -1.51 0.00 0.00 37.83 33.87 2wro s LYS 4 CO -0.09 -0.37 0.00 0.00 -0.36 0.00 0.00 175.35 174.53 2wro n ALA 5 N -2.40 0.00 0.00 3.13 0.00 0.34 -4.69 120.51 116.90 2wro n ALA 5 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2wro n ALA 5 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2wro n ALA 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2wro n ILE 6 N 0.00 0.00 -3.01 0.00 5.41 -1.26 -4.74 119.36 115.76 2wro n ILE 6 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.78 2wro n ILE 6 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2wro n ILE 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wro s ALA 7 N -2.69 -3.83 0.72 -1.39 0.00 0.14 -4.92 121.76 109.78 2wro s ALA 7 Ca 0.00 1.17 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 2wro s ALA 7 Cb 0.00 -2.86 0.02 0.00 0.00 0.00 0.00 23.12 20.28 2wro s ALA 7 CO 0.00 -2.23 1.07 1.03 0.00 0.00 0.00 175.76 175.63 2wro s ARG 8 N 2.44 2.75 -0.71 0.00 0.52 -1.26 -2.46 118.95 120.23 2wro s ARG 8 Ca 0.20 0.76 -0.07 0.00 -0.52 0.00 0.00 55.73 56.10 2wro s ARG 8 Cb -0.01 -1.98 0.01 0.00 0.52 0.00 0.00 34.95 33.48 2wro s ARG 8 CO -0.18 -1.18 0.64 0.66 0.02 0.00 0.00 175.30 175.26 2wro n TYR 9 N -3.16 -2.60 -0.00 -0.53 4.02 -1.26 -4.90 117.16 108.74 2wro n TYR 9 Ca 0.07 1.04 -0.16 0.00 -0.01 0.00 0.00 57.90 58.84 2wro n TYR 9 Cb 0.55 -3.24 -0.14 0.00 -0.02 0.00 0.00 39.34 36.49 2wro n TYR 9 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2wro n VAL 10 N -1.79 1.72 -1.97 -0.72 0.31 -0.82 -4.98 118.33 110.08 2wro n VAL 10 Ca -0.14 -0.72 -0.02 0.00 -0.01 0.00 0.00 64.34 63.45 2wro n VAL 10 Cb 0.60 -1.45 0.01 0.00 -0.91 0.00 0.00 33.84 32.09 2wro n VAL 10 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2wro n ARG 11 N -3.31 -0.51 -3.61 5.55 0.00 -1.25 -4.90 116.66 108.63 2wro n ARG 11 Ca -0.25 0.49 -0.03 0.00 -0.00 0.00 0.00 57.85 58.06 2wro n ARG 11 Cb 1.05 -2.71 -0.06 0.00 0.00 0.00 0.00 32.46 30.74 2wro n ARG 11 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2wro s ILE 12 N -3.06 -0.16 -0.05 5.15 2.07 -1.06 -4.88 121.20 119.22 2wro s ILE 12 Ca 0.07 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 59.06 2wro s ILE 12 Cb -0.01 -1.00 -0.12 0.00 0.13 0.00 0.00 42.46 41.46 2wro s ILE 12 CO 0.21 0.00 0.70 -0.24 -1.91 0.00 0.00 174.94 173.70 2wro n SER 13 N 4.21 0.10 0.04 4.50 2.88 -1.19 -3.52 113.62 120.64 2wro n SER 13 Ca -0.17 0.71 -0.07 0.00 -1.33 0.00 0.00 58.87 58.01 2wro n SER 13 Cb 0.56 -0.56 -0.05 0.00 -0.75 0.00 0.00 64.21 63.42 2wro n SER 13 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2wro h PRO 14 N 2.02 -0.32 -0.59 -1.46 0.11 -1.89 -2.36 132.00 127.50 2wro h PRO 14 Ca -0.31 0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.93 2wro h PRO 14 Cb 0.87 0.07 -0.10 0.00 0.11 0.00 0.00 31.00 31.95 2wro h PRO 14 CO 0.43 -0.21 -0.20 0.54 -0.21 0.00 0.00 178.00 178.34 2wro n ARG 15 N -3.84 -0.11 -0.17 1.05 1.74 -1.26 0.23 116.66 114.31 2wro n ARG 15 Ca -0.04 0.91 -0.05 0.00 -0.77 0.00 0.00 57.85 57.90 2wro n ARG 15 Cb 0.19 -1.35 0.05 0.00 -1.02 0.00 0.00 32.46 30.33 2wro n ARG 15 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2wro h LYS 16 N 0.00 0.49 0.27 5.56 1.57 -1.78 -2.79 116.57 119.90 2wro h LYS 16 Ca 0.23 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 2wro h LYS 16 Cb 0.38 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2wro h LYS 16 CO -0.59 0.33 -0.13 0.28 -0.57 0.00 0.00 179.45 178.77 2wro h VAL 17 N 0.51 0.56 0.00 0.50 2.07 0.34 -3.21 116.25 117.01 2wro h VAL 17 Ca 0.22 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2wro h VAL 17 Cb 0.12 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2wro h VAL 17 CO -0.15 0.13 0.00 -1.14 0.02 0.00 0.00 177.57 176.44 2wro n ARG 18 N -5.03 0.00 -0.10 1.57 0.63 0.30 -2.70 116.66 111.31 2wro n ARG 18 Ca -0.08 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.68 2wro n ARG 18 Cb 0.25 -1.06 -0.06 0.00 0.45 0.00 0.00 32.46 32.04 2wro n ARG 18 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2wro n LEU 19 N -0.40 1.87 0.00 6.15 7.94 -1.06 -4.21 117.00 127.29 2wro n LEU 19 Ca 0.00 0.32 0.09 0.00 -1.11 0.00 0.00 56.01 55.31 2wro n LEU 19 Cb 0.00 -0.74 0.47 0.00 0.53 0.00 0.00 43.42 43.68 2wro n LEU 19 CO 0.00 0.08 0.78 1.33 -1.11 0.00 0.00 177.39 178.47 2wro n VAL 20 N -4.31 0.42 0.01 1.96 0.24 -1.10 -2.02 118.33 113.54 2wro n VAL 20 Ca -0.31 0.11 -0.08 0.00 -2.04 0.00 0.00 64.34 62.02 2wro n VAL 20 Cb 0.66 -0.80 -0.13 0.00 -1.47 0.00 0.00 33.84 32.10 2wro n VAL 20 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 2wro h VAL 21 N 0.00 1.20 -0.28 3.34 2.07 -1.77 -3.28 116.25 117.53 2wro h VAL 21 Ca 0.00 -3.00 0.00 0.00 0.82 0.00 0.00 66.70 64.52 2wro h VAL 21 Cb 0.17 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 2wro h VAL 21 CO 0.00 0.69 0.00 0.47 0.02 0.00 0.00 177.57 178.75 2wro n ASP 22 N -3.18 2.62 -0.10 0.57 10.43 -0.86 -2.32 116.55 123.71 2wro n ASP 22 Ca -0.10 -2.27 0.03 0.00 2.57 0.00 0.00 54.79 55.02 2wro n ASP 22 Cb 1.01 -0.46 -0.01 0.00 1.84 0.00 0.00 41.12 43.50 2wro n ASP 22 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 2wro n LEU 23 N 0.33 0.77 0.00 0.64 7.94 -1.24 -4.59 117.00 120.85 2wro n LEU 23 Ca 0.12 -0.69 0.00 0.00 -1.11 0.00 0.00 56.01 54.33 2wro n LEU 23 Cb 0.53 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.48 2wro n LEU 23 CO 0.12 0.17 0.03 2.30 -1.11 0.00 0.00 177.39 178.89 2wro n ILE 24 N -0.57 0.00 -1.69 1.96 -5.35 -1.19 -5.01 119.36 107.50 2wro n ILE 24 Ca 0.02 -0.24 -0.26 0.00 -0.27 0.00 0.00 62.75 62.01 2wro n ILE 24 Cb 0.12 1.13 -0.05 0.00 -1.74 0.00 0.00 39.64 39.10 2wro n ILE 24 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2wro s ARG 25 N -0.36 2.03 0.00 6.28 3.52 -0.98 -2.31 118.95 127.12 2wro s ARG 25 Ca 0.00 0.69 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 2wro s ARG 25 Cb 0.00 -4.71 0.00 0.00 -1.56 0.00 0.00 34.95 28.68 2wro s ARG 25 CO 0.00 -3.70 0.00 0.41 -0.81 0.00 0.00 175.30 171.20 2wro n GLY 26 N 6.42 1.51 0.00 8.12 0.00 -1.18 -4.95 105.19 115.10 2wro n GLY 26 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2wro n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wro n LYS 27 N -0.58 1.56 -0.70 1.61 5.02 -0.98 -4.88 118.16 119.20 2wro n LYS 27 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 2wro n LYS 27 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.02 2wro n LYS 27 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2wro n SER 28 N -2.00 0.10 -0.07 4.39 3.41 -1.26 -0.63 113.62 117.56 2wro n SER 28 Ca 0.00 -1.09 -0.10 0.00 -0.26 0.00 0.00 58.87 57.42 2wro n SER 28 Cb 0.00 -0.06 -0.09 0.00 -0.26 0.00 0.00 64.21 63.80 2wro n SER 28 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2wro h LEU 29 N 0.00 0.00 -1.25 1.04 5.85 -1.90 -3.17 115.31 115.88 2wro h LEU 29 Ca -0.03 -0.63 0.03 0.00 0.84 0.00 0.00 57.88 58.09 2wro h LEU 29 Cb 0.10 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 2wro h LEU 29 CO 0.03 0.89 0.52 -0.08 -0.34 0.00 0.00 178.44 179.45 2wro h GLU 30 N -1.00 0.96 0.15 1.25 4.81 -1.93 0.69 114.58 119.50 2wro h GLU 30 Ca -0.03 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2wro h GLU 30 Cb 0.72 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2wro h GLU 30 CO -0.02 0.64 -0.07 0.93 -0.73 0.00 0.00 179.01 179.76 2wro h GLU 31 N 0.99 -0.19 0.56 1.92 5.08 -1.98 -2.94 114.58 118.03 2wro h GLU 31 Ca 0.30 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.66 2wro h GLU 31 Cb -0.01 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2wro h GLU 31 CO -0.08 0.07 -0.45 0.00 -1.00 0.00 0.00 179.01 177.54 2wro h ALA 32 N 0.38 -1.17 -0.36 3.43 0.00 -1.31 0.56 119.26 120.79 2wro h ALA 32 Ca -0.02 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.80 2wro h ALA 32 Cb 0.34 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2wro h ALA 32 CO 0.03 -1.17 0.76 0.00 0.00 0.00 0.00 179.25 178.87 2wro h ARG 33 N -0.98 0.00 0.03 0.00 3.08 0.28 0.57 114.38 117.36 2wro h ARG 33 Ca -0.07 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.61 2wro h ARG 33 Cb 0.82 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.82 2wro h ARG 33 CO 0.00 0.00 -2.27 0.09 -1.07 0.00 0.00 179.97 176.72 2wro n ASN 34 N -3.07 1.64 0.00 7.04 5.03 -0.76 -4.07 115.26 121.06 2wro n ASN 34 Ca 0.07 0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.54 2wro n ASN 34 Cb 0.89 -0.30 0.00 0.00 -1.02 0.00 0.00 39.78 39.35 2wro n ASN 34 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2wro n ILE 35 N -3.23 0.00 0.26 2.41 2.08 0.20 -2.59 119.36 118.49 2wro n ILE 35 Ca -0.38 1.15 0.02 0.00 0.56 0.00 0.00 62.75 64.10 2wro n ILE 35 Cb 1.04 -2.05 0.13 0.00 -0.75 0.00 0.00 39.64 38.01 2wro n ILE 35 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2wro n LEU 36 N -1.06 0.00 0.08 1.39 -0.00 -1.03 -1.09 117.00 115.28 2wro n LEU 36 Ca 0.00 0.11 -0.12 0.00 -0.00 0.00 0.00 56.01 56.00 2wro n LEU 36 Cb 0.00 -0.11 -0.05 0.00 -0.00 0.00 0.00 43.42 43.26 2wro n LEU 36 CO 0.00 -0.10 0.16 -0.09 -0.00 0.00 0.00 177.39 177.37 2wro h ARG 37 N 0.00 0.29 -1.06 1.47 2.43 -1.64 -3.28 114.38 112.58 2wro h ARG 37 Ca 0.00 -0.35 -0.59 0.00 -0.81 0.00 0.00 59.98 58.23 2wro h ARG 37 Cb 0.02 0.11 -0.40 0.00 -0.42 0.00 0.00 29.97 29.27 2wro h ARG 37 CO 0.00 1.07 -0.46 0.66 -1.51 0.00 0.00 179.97 179.73 2wro n TYR 38 N -3.66 3.00 -3.74 2.20 4.01 -0.25 -4.92 117.16 113.80 2wro n TYR 38 Ca -0.06 -2.57 -0.30 0.00 -0.16 0.00 0.00 57.90 54.82 2wro n TYR 38 Cb 0.86 -0.47 -0.15 0.00 -0.31 0.00 0.00 39.34 39.27 2wro n TYR 38 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2wro s THR 39 N -4.91 0.88 -0.01 -0.72 2.01 -1.13 -5.02 115.64 106.74 2wro s THR 39 Ca 0.52 -1.32 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2wro s THR 39 Cb 0.42 -1.62 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 2wro s THR 39 CO -0.06 -0.61 1.35 0.21 -0.69 0.00 0.00 174.62 174.83 2wro s ASN 40 N 1.63 6.90 0.00 3.53 2.47 -1.26 -4.47 114.94 123.73 2wro s ASN 40 Ca 0.08 2.04 0.00 0.00 0.42 0.00 0.00 52.86 55.41 2wro s ASN 40 Cb -0.17 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.07 2wro s ASN 40 CO -0.23 -0.69 0.00 0.29 -3.72 0.00 0.00 177.10 172.76 2wro n LYS 41 N 5.32 0.00 -0.00 0.43 4.76 -1.26 -4.95 118.16 122.46 2wro n LYS 41 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2wro n LYS 41 Cb 0.44 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.63 2wro n LYS 41 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2wro n ARG 42 N -0.32 0.43 0.00 1.97 0.63 -1.26 -0.15 116.66 117.96 2wro n ARG 42 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2wro n ARG 42 Cb 0.00 -1.29 0.00 0.00 0.45 0.00 0.00 32.46 31.62 2wro n ARG 42 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wro n GLY 43 N 0.81 0.36 0.23 5.14 0.00 -1.26 -4.64 105.19 105.82 2wro n GLY 43 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2wro n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wro h ALA 44 N 0.00 -1.01 -0.96 4.61 0.00 -0.76 -0.13 119.26 121.01 2wro h ALA 44 Ca 0.00 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.88 2wro h ALA 44 Cb 0.00 0.22 -0.12 0.00 0.00 0.00 0.00 17.79 17.89 2wro h ALA 44 CO 0.00 -0.97 -0.52 0.98 0.00 0.00 0.00 179.25 178.74 2wro n TYR 45 N -3.73 -0.32 -0.25 0.00 9.36 -1.26 -1.25 117.16 119.72 2wro n TYR 45 Ca -0.07 1.19 -0.05 0.00 3.32 0.00 0.00 57.90 62.29 2wro n TYR 45 Cb 0.22 -0.64 0.10 0.00 -0.63 0.00 0.00 39.34 38.40 2wro n TYR 45 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2wro h PHE 46 N 0.00 1.12 0.00 2.98 0.04 -1.82 -2.78 116.94 116.48 2wro h PHE 46 Ca 0.19 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.85 2wro h PHE 46 Cb 0.43 -0.33 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 2wro h PHE 46 CO -0.95 0.87 -0.08 0.28 -0.60 0.00 0.00 178.31 177.82 2wro h VAL 47 N 1.07 0.55 0.15 -0.55 2.07 0.41 -2.77 116.25 117.18 2wro h VAL 47 Ca 0.24 -0.37 -0.26 0.00 0.82 0.00 0.00 66.70 67.13 2wro h VAL 47 Cb 0.24 1.24 0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2wro h VAL 47 CO -0.02 0.08 -1.22 0.00 0.02 0.00 0.00 177.57 176.43 2wro h ALA 48 N 1.92 0.02 0.00 1.67 0.00 -1.26 -2.86 119.26 118.75 2wro h ALA 48 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.00 2wro h ALA 48 Cb 0.24 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2wro h ALA 48 CO 0.01 0.65 0.00 1.63 0.00 0.00 0.00 179.25 181.54 2wro n LYS 49 N -3.94 0.52 -0.06 0.00 5.02 -1.07 0.69 118.16 119.34 2wro n LYS 49 Ca -0.19 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.12 2wro n LYS 49 Cb 0.92 -1.33 0.03 0.00 -0.02 0.00 0.00 35.03 34.63 2wro n LYS 49 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2wro n VAL 50 N -0.83 0.93 -0.07 -0.18 3.14 -1.08 -4.20 118.33 116.04 2wro n VAL 50 Ca 0.08 -1.01 -0.15 0.00 -2.96 0.00 0.00 64.34 60.30 2wro n VAL 50 Cb 0.04 0.43 -0.05 0.00 -1.06 0.00 0.00 33.84 33.20 2wro n VAL 50 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 2wro n LEU 51 N -0.57 1.36 0.05 6.55 0.00 0.22 -4.52 117.00 120.09 2wro n LEU 51 Ca 0.04 0.23 -0.03 0.00 0.00 0.00 0.00 56.01 56.24 2wro n LEU 51 Cb 0.42 -0.54 0.20 0.00 0.00 0.00 0.00 43.42 43.50 2wro n LEU 51 CO 0.00 0.13 0.68 -0.33 0.00 0.00 0.00 177.39 177.87 2wro h GLU 52 N -0.64 0.38 -0.65 1.96 3.07 -1.32 -1.43 114.58 115.95 2wro h GLU 52 Ca -0.32 -0.16 0.00 0.00 -0.50 0.00 0.00 59.36 58.37 2wro h GLU 52 Cb 1.18 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 2wro h GLU 52 CO -0.19 0.68 0.00 0.45 -1.40 0.00 0.00 179.01 178.54 2wro n SER 53 N -4.07 0.66 0.00 1.42 2.88 -1.26 -1.15 113.62 112.09 2wro n SER 53 Ca -0.01 -1.01 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 2wro n SER 53 Cb 0.45 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2wro n SER 53 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wro n ALA 54 N 0.32 0.00 -0.12 -1.46 0.00 -0.55 -4.63 120.51 114.07 2wro n ALA 54 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2wro n ALA 54 Cb 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.48 2wro n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wro n ALA 55 N 0.00 1.20 1.40 0.00 0.00 -0.30 -3.65 120.51 119.16 2wro n ALA 55 Ca 0.00 -0.98 0.11 0.00 0.00 0.00 0.00 53.44 52.58 2wro n ALA 55 Cb 0.15 -0.11 0.67 0.00 0.00 0.00 0.00 19.45 20.16 2wro n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wro n ALA 56 N -3.69 2.34 -1.04 0.00 0.00 -1.12 -0.77 120.51 116.23 2wro n ALA 56 Ca -0.47 -0.14 0.09 0.00 0.00 0.00 0.00 53.44 52.92 2wro n ALA 56 Cb 0.91 -1.37 0.21 0.00 0.00 0.00 0.00 19.45 19.20 2wro n ALA 56 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wro n ASN 57 N -1.02 3.16 -0.22 0.00 5.03 -1.25 -3.17 115.26 117.79 2wro n ASN 57 Ca 0.17 -3.07 0.01 0.00 0.87 0.00 0.00 54.58 52.56 2wro n ASN 57 Cb 0.08 -0.49 0.01 0.00 -1.02 0.00 0.00 39.78 38.36 2wro n ASN 57 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wro n ALA 58 N -0.94 1.60 -1.18 5.41 0.00 0.05 -4.38 120.51 121.07 2wro n ALA 58 Ca 0.19 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.72 2wro n ALA 58 Cb 0.78 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2wro n ALA 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wro n VAL 59 N -0.15 0.00 -0.04 0.00 0.31 -1.03 -0.78 118.33 116.64 2wro n VAL 59 Ca 0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.33 2wro n VAL 59 Cb 0.58 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.50 2wro n VAL 59 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2wro n ASN 60 N 0.00 -0.10 0.23 4.52 2.85 -1.19 0.42 115.26 122.00 2wro n ASN 60 Ca 0.00 0.93 0.08 0.00 -0.11 0.00 0.00 54.58 55.48 2wro n ASN 60 Cb 0.00 -0.40 0.57 0.00 1.24 0.00 0.00 39.78 41.19 2wro n ASN 60 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 2wro h ASN 61 N 0.00 0.00 0.00 1.20 4.21 -1.85 -3.36 115.58 115.78 2wro h ASN 61 Ca 0.02 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.45 2wro h ASN 61 Cb 0.04 0.00 -0.14 0.00 -1.12 0.00 0.00 38.32 37.10 2wro h ASN 61 CO -0.09 0.20 -0.55 1.41 -1.29 0.00 0.00 177.43 177.11 2wro n HIS 62 N -3.91 0.00 0.00 1.19 8.25 0.77 -4.97 115.22 116.55 2wro n HIS 62 Ca -0.02 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 2wro n HIS 62 Cb 0.28 0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2wro n HIS 62 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2wro n ASP 63 N 0.15 0.00 -0.37 0.41 5.75 1.44 -4.52 116.55 119.41 2wro n ASP 63 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.76 2wro n ASP 63 Cb 0.80 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.90 2wro n ASP 63 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2wro n MET 64 N 0.97 0.07 -2.29 0.11 2.81 0.04 -4.85 117.12 113.98 2wro n MET 64 Ca 0.00 -0.95 -0.00 0.00 -1.81 0.00 0.00 57.70 54.93 2wro n MET 64 Cb 0.00 -0.54 -0.00 0.00 -0.71 0.00 0.00 33.22 31.97 2wro n MET 64 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2wro n LEU 65 N -0.05 -4.59 -0.34 4.03 7.94 -1.26 -4.36 117.00 118.36 2wro n LEU 65 Ca 0.01 2.24 0.07 0.00 -1.11 0.00 0.00 56.01 57.21 2wro n LEU 65 Cb 0.65 -2.70 0.23 0.00 0.53 0.00 0.00 43.42 42.13 2wro n LEU 65 CO 0.00 -2.59 1.19 -0.08 -1.11 0.00 0.00 177.39 174.81 2wro h GLU 66 N 4.24 0.86 0.00 1.96 4.81 -1.97 -2.35 114.58 122.13 2wro h GLU 66 Ca -0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2wro h GLU 66 Cb 0.07 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.26 2wro h GLU 66 CO 0.00 0.57 0.00 -0.25 -0.73 0.00 0.00 179.01 178.60 2wro n ASP 67 N -4.69 0.00 -0.10 1.04 8.00 -1.26 -2.67 116.55 116.87 2wro n ASP 67 Ca 0.18 0.36 -0.16 0.00 0.71 0.00 0.00 54.79 55.88 2wro n ASP 67 Cb 0.36 -0.43 -0.13 0.00 -0.02 0.00 0.00 41.12 40.90 2wro n ASP 67 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wro n ARG 68 N -1.43 0.67 -0.62 -1.24 1.74 -0.90 -4.91 116.66 109.97 2wro n ARG 68 Ca 0.05 0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 56.96 2wro n ARG 68 Cb 0.17 -1.57 0.19 0.00 -1.02 0.00 0.00 32.46 30.24 2wro n ARG 68 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2wro n LEU 69 N -3.16 -1.61 -3.60 0.55 4.77 -1.09 0.19 117.00 113.05 2wro n LEU 69 Ca -0.39 -0.07 0.02 0.00 -0.03 0.00 0.00 56.01 55.54 2wro n LEU 69 Cb 1.04 -1.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2wro n LEU 69 CO 0.34 -3.18 1.10 -0.72 -1.33 0.00 0.00 177.39 173.60 2wro s TYR 70 N -2.32 -0.03 -0.49 -1.77 -0.85 0.08 -4.12 117.35 107.85 2wro s TYR 70 Ca 0.60 -0.04 -0.21 0.00 -0.52 0.00 0.00 57.07 56.90 2wro s TYR 70 Cb -0.18 0.53 0.04 0.00 0.38 0.00 0.00 41.96 42.74 2wro s TYR 70 CO 0.66 -0.20 0.71 0.08 -1.52 0.00 0.00 175.55 175.27 2wro s VAL 71 N -2.31 4.75 -2.00 -3.49 1.01 0.19 0.21 120.40 118.75 2wro s VAL 71 Ca 0.14 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.07 2wro s VAL 71 Cb 0.06 -4.32 0.10 0.00 0.00 0.00 0.00 36.38 32.22 2wro s VAL 71 CO -0.05 -0.80 0.55 0.29 0.00 0.00 0.00 175.10 175.09 2wro n LYS 72 N 6.50 0.22 -3.06 2.72 5.02 0.19 -3.12 118.16 126.64 2wro n LYS 72 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2wro n LYS 72 Cb 0.47 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 2wro n LYS 72 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wro n ALA 73 N -0.74 0.00 0.00 7.82 0.00 -0.83 -4.89 120.51 121.87 2wro n ALA 73 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2wro n ALA 73 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2wro n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wro n ALA 74 N -0.24 0.00 -3.71 0.00 0.00 -1.26 -3.28 120.51 112.02 2wro n ALA 74 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2wro n ALA 74 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 2wro n ALA 74 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2wro s TYR 75 N 0.00 -0.30 0.07 0.00 1.13 -1.10 -4.90 117.35 112.25 2wro s TYR 75 Ca 0.00 0.74 -0.21 0.00 -1.41 0.00 0.00 57.07 56.19 2wro s TYR 75 Cb 0.00 -0.03 -0.06 0.00 -1.10 0.00 0.00 41.96 40.76 2wro s TYR 75 CO 0.00 -0.25 0.64 0.54 -2.51 0.00 0.00 175.55 173.97 2wro s VAL 76 N 1.60 4.71 -0.03 -3.49 0.11 -1.26 -2.42 120.40 119.62 2wro s VAL 76 Ca -0.06 1.36 0.07 0.00 -2.93 0.00 0.00 61.98 60.42 2wro s VAL 76 Cb -0.11 -3.98 -0.02 0.00 -1.53 0.00 0.00 36.38 30.75 2wro s VAL 76 CO -0.08 0.49 -0.23 -0.62 -3.33 0.00 0.00 175.10 171.33 2wro s ASP 77 N -0.76 2.74 0.20 3.54 -1.08 -0.58 -4.98 116.67 115.75 2wro s ASP 77 Ca 0.32 -0.43 -0.17 0.00 -0.52 0.00 0.00 52.55 51.75 2wro s ASP 77 Cb -0.20 -0.44 -0.08 0.00 -1.46 0.00 0.00 42.92 40.75 2wro s ASP 77 CO 0.20 0.27 0.64 -0.70 0.52 0.00 0.00 175.17 176.10 2wro s GLU 78 N -0.42 4.10 0.00 4.34 2.12 -1.26 0.04 118.70 127.62 2wro s GLU 78 Ca 0.05 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.06 2wro s GLU 78 Cb -0.10 -2.86 0.00 0.00 0.26 0.00 0.00 34.13 31.43 2wro s GLU 78 CO 0.00 0.41 0.00 0.41 -0.54 0.00 0.00 175.26 175.54 2wro n GLY 79 N 0.66 2.29 3.58 -1.50 0.00 0.13 -4.84 105.19 105.51 2wro n GLY 79 Ca -0.03 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 2wro n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wro s PRO 80 N 4.45 3.76 -0.20 1.61 0.04 -1.26 -4.82 135.00 138.57 2wro s PRO 80 Ca 0.00 0.17 -0.29 0.00 0.04 0.00 0.00 61.00 60.92 2wro s PRO 80 Cb 0.00 -3.78 -0.02 0.00 0.04 0.00 0.00 34.50 30.74 2wro s PRO 80 CO 0.00 -0.70 1.46 0.00 0.04 0.00 0.00 177.00 177.80 2wro s ALA 81 N 2.73 3.44 -0.14 8.56 0.00 -1.26 -4.40 121.76 130.68 2wro s ALA 81 Ca 0.26 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 2wro s ALA 81 Cb -0.14 -3.76 -0.06 0.00 0.00 0.00 0.00 23.12 19.15 2wro s ALA 81 CO 0.14 -1.64 2.12 -0.51 0.00 0.00 0.00 175.76 175.87 2wro s LEU 82 N 4.42 3.75 -0.17 0.00 1.02 -1.26 -4.78 118.68 121.66 2wro s LEU 82 Ca 0.64 2.11 -0.22 0.00 0.02 0.00 0.00 54.13 56.68 2wro s LEU 82 Cb -0.23 -3.52 -0.03 0.00 0.02 0.00 0.00 46.19 42.44 2wro s LEU 82 CO 0.24 -1.67 0.67 -0.54 0.02 0.00 0.00 176.35 175.07 2wro s LYS 83 N 5.73 4.27 0.17 1.70 1.02 -1.26 0.13 119.74 131.50 2wro s LYS 83 Ca 0.96 0.72 0.05 0.00 0.02 0.00 0.00 55.97 57.72 2wro s LYS 83 Cb -0.36 -3.55 -0.05 0.00 -0.52 0.00 0.00 37.83 33.36 2wro s LYS 83 CO 0.37 -0.20 -0.09 1.03 -0.92 0.00 0.00 175.35 175.54 2wro s ARG 84 N 1.74 1.17 0.08 1.68 1.81 0.40 -4.97 118.95 120.86 2wro s ARG 84 Ca 0.32 -1.52 -0.09 0.00 -1.72 0.00 0.00 55.73 52.71 2wro s ARG 84 Cb -0.16 -0.72 -0.06 0.00 -0.45 0.00 0.00 34.95 33.56 2wro s ARG 84 CO 0.12 0.06 0.39 0.08 -0.68 0.00 0.00 175.30 175.27 2wro s VAL 85 N -3.27 5.11 -0.23 3.52 1.01 -1.26 0.86 120.40 126.14 2wro s VAL 85 Ca 0.20 0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.59 2wro s VAL 85 Cb 0.03 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.83 2wro s VAL 85 CO 0.03 0.28 -0.01 -0.22 0.00 0.00 0.00 175.10 175.19 2wro s LEU 86 N -1.93 2.12 1.04 3.92 2.96 0.18 -4.82 118.68 122.15 2wro s LEU 86 Ca 0.33 -1.11 -0.12 0.00 -0.22 0.00 0.00 54.13 53.01 2wro s LEU 86 Cb -0.14 -0.97 0.17 0.00 0.50 0.00 0.00 46.19 45.76 2wro s LEU 86 CO 0.18 -0.28 0.84 -2.65 -1.32 0.00 0.00 176.35 173.13 2wro n PRO 87 N 4.80 -1.25 -3.14 0.98 -0.02 -1.26 -2.86 135.00 132.26 2wro n PRO 87 Ca -0.10 -0.32 -0.08 0.00 -2.02 0.00 0.00 63.50 60.98 2wro n PRO 87 Cb 0.45 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 2wro n PRO 87 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2wro n ARG 88 N -3.80 0.70 -1.61 -0.52 3.00 -1.26 -4.87 116.66 108.30 2wro n ARG 88 Ca 0.07 -1.79 -0.44 0.00 -0.00 0.00 0.00 57.85 55.68 2wro n ARG 88 Cb 0.54 2.00 -0.01 0.00 0.00 0.00 0.00 32.46 34.99 2wro n ARG 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wro n ALA 89 N -1.27 0.08 -4.09 5.13 0.00 -1.26 -1.01 120.51 118.10 2wro n ALA 89 Ca -0.11 0.39 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2wro n ALA 89 Cb 0.43 -2.07 -0.04 0.00 0.00 0.00 0.00 19.45 17.78 2wro n ALA 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wro n ARG 90 N 0.71 -2.88 -2.80 0.00 1.74 -1.26 -3.33 116.66 108.83 2wro n ARG 90 Ca 0.09 0.35 -0.13 0.00 -0.77 0.00 0.00 57.85 57.39 2wro n ARG 90 Cb 0.33 -4.54 0.00 0.00 -1.02 0.00 0.00 32.46 27.23 2wro n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wro n GLY 91 N -1.91 -0.39 0.00 -0.13 0.00 -0.18 -4.99 105.19 97.59 2wro n GLY 91 Ca -0.21 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2wro n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wro n ARG 92 N -1.06 2.68 -3.17 1.61 1.74 -1.21 -4.90 116.66 112.35 2wro n ARG 92 Ca -0.11 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 56.99 2wro n ARG 92 Cb 0.30 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.73 2wro n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wro s ALA 93 N -3.37 -2.16 -0.21 7.54 0.00 -1.26 -4.62 121.76 117.68 2wro s ALA 93 Ca 0.00 1.64 0.02 0.00 0.00 0.00 0.00 51.96 53.61 2wro s ALA 93 Cb 0.00 -2.17 0.04 0.00 0.00 0.00 0.00 23.12 20.98 2wro s ALA 93 CO 0.00 -1.40 -0.15 -0.51 0.00 0.00 0.00 175.76 173.70 2wro s ASP 94 N 2.82 3.56 -0.61 0.00 -0.00 -1.13 -4.98 116.67 116.33 2wro s ASP 94 Ca 0.19 -0.91 -0.26 0.00 -0.00 0.00 0.00 52.55 51.56 2wro s ASP 94 Cb -0.14 -1.44 0.04 0.00 -0.00 0.00 0.00 42.92 41.38 2wro s ASP 94 CO -0.21 -0.09 1.09 0.27 -0.00 0.00 0.00 175.17 176.23 2wro s ILE 95 N 1.26 4.13 -0.19 0.77 -4.36 -1.26 0.49 121.20 122.04 2wro s ILE 95 Ca -0.00 0.45 -0.20 0.00 -0.26 0.00 0.00 60.65 60.63 2wro s ILE 95 Cb -0.16 -4.69 -0.03 0.00 1.25 0.00 0.00 42.46 38.83 2wro s ILE 95 CO -0.10 -1.37 0.57 -0.51 0.24 0.00 0.00 174.94 173.77 2wro s ILE 96 N 4.65 5.07 -0.55 8.37 2.07 0.25 -4.85 121.20 136.21 2wro s ILE 96 Ca 0.35 1.08 -0.19 0.00 -1.41 0.00 0.00 60.65 60.47 2wro s ILE 96 Cb -0.10 -3.89 0.08 0.00 0.13 0.00 0.00 42.46 38.67 2wro s ILE 96 CO 0.19 0.16 0.66 -0.54 -1.91 0.00 0.00 174.94 173.50 2wro s LYS 97 N 1.69 3.08 -0.61 3.50 1.02 -1.26 -0.45 119.74 126.70 2wro s LYS 97 Ca 0.27 -1.11 -0.06 0.00 0.02 0.00 0.00 55.97 55.09 2wro s LYS 97 Cb -0.16 -4.18 -0.12 0.00 -0.52 0.00 0.00 37.83 32.86 2wro s LYS 97 CO 0.10 -1.37 2.47 1.63 -0.92 0.00 0.00 175.35 177.26 2wro n LYS 98 N 6.22 2.01 0.00 1.68 5.02 0.12 -4.86 118.16 128.35 2wro n LYS 98 Ca -0.08 -1.22 0.00 0.00 -2.02 0.00 0.00 58.31 54.99 2wro n LYS 98 Cb 0.44 -2.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 2wro n LYS 98 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2wro n ARG 99 N 3.42 0.00 -4.07 1.97 5.12 -1.26 -4.02 116.66 117.81 2wro n ARG 99 Ca 0.43 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 56.22 2wro n ARG 99 Cb 0.37 0.00 -0.12 0.00 -1.16 0.00 0.00 32.46 31.55 2wro n ARG 99 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2wro s THR 100 N 0.00 0.54 -0.10 0.55 -1.32 -1.26 -2.55 115.64 111.50 2wro s THR 100 Ca 0.00 -1.01 -0.13 0.00 -1.21 0.00 0.00 61.69 59.34 2wro s THR 100 Cb 0.00 -0.59 0.03 0.00 -1.51 0.00 0.00 72.50 70.43 2wro s THR 100 CO 0.00 -0.34 0.33 -0.44 -2.21 0.00 0.00 174.62 171.96 2wro s SER 101 N -1.46 -0.31 -0.24 8.08 0.01 -1.23 0.19 113.70 118.74 2wro s SER 101 Ca -0.09 0.53 -0.07 0.00 1.31 0.00 0.00 55.95 57.64 2wro s SER 101 Cb -0.09 0.60 -0.03 0.00 0.21 0.00 0.00 66.02 66.71 2wro s SER 101 CO 0.00 -0.20 0.05 -1.38 0.41 0.00 0.00 173.24 172.12 2wro s HIS 102 N -0.20 3.07 0.07 2.43 -3.43 0.11 -1.93 115.29 115.40 2wro s HIS 102 Ca -0.03 -0.46 -0.10 0.00 -0.80 0.00 0.00 55.06 53.66 2wro s HIS 102 Cb -0.03 -2.20 -0.06 0.00 -1.43 0.00 0.00 32.58 28.86 2wro s HIS 102 CO 0.01 -0.35 0.40 0.42 -2.00 0.00 0.00 174.74 173.22 2wro s ILE 103 N 1.49 5.09 0.23 -5.38 1.01 -1.03 -1.53 121.20 121.08 2wro s ILE 103 Ca 0.06 0.47 0.10 0.00 0.00 0.00 0.00 60.65 61.27 2wro s ILE 103 Cb -0.15 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 2wro s ILE 103 CO 0.03 0.30 -0.09 0.42 0.00 0.00 0.00 174.94 175.60 2wro s THR 104 N -1.38 3.13 -0.18 2.92 -4.23 -1.02 -0.69 115.64 114.19 2wro s THR 104 Ca 0.32 -1.88 -0.12 0.00 -1.18 0.00 0.00 61.69 58.83 2wro s THR 104 Cb -0.14 -2.61 0.06 0.00 1.34 0.00 0.00 72.50 71.15 2wro s THR 104 CO 0.18 -0.25 0.46 -0.69 -0.54 0.00 0.00 174.62 173.78 2wro s VAL 105 N -2.04 -0.01 -0.15 2.29 1.01 -1.26 -2.71 120.40 117.53 2wro s VAL 105 Ca 0.28 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 2wro s VAL 105 Cb -0.07 -0.66 0.05 0.00 0.00 0.00 0.00 36.38 35.69 2wro s VAL 105 CO 0.16 0.02 0.03 0.27 0.00 0.00 0.00 175.10 175.59 2wro s ILE 106 N 1.07 0.38 0.28 2.22 -4.36 -1.20 0.13 121.20 119.71 2wro s ILE 106 Ca -0.07 -0.25 -0.01 0.00 -0.26 0.00 0.00 60.65 60.07 2wro s ILE 106 Cb -0.06 -0.78 0.06 0.00 1.25 0.00 0.00 42.46 42.92 2wro s ILE 106 CO -0.09 -0.05 0.39 0.18 0.24 0.00 0.00 174.94 175.61 2wro n LEU 107 N 5.12 0.00 -3.61 0.37 4.32 -0.17 0.57 117.00 123.59 2wro n LEU 107 Ca -0.08 -0.79 -0.07 0.00 -0.02 0.00 0.00 56.01 55.05 2wro n LEU 107 Cb 0.48 -0.26 -0.05 0.00 -1.62 0.00 0.00 43.42 41.98 2wro n LEU 107 CO 0.12 -0.70 0.92 -0.83 -1.22 0.00 0.00 177.39 175.68 2wro s GLY 108 N -3.47 -0.08 0.24 -0.72 0.00 0.55 -2.87 107.32 100.97 2wro s GLY 108 Ca 0.25 2.51 -0.30 0.00 0.00 0.00 0.00 44.72 47.19 2wro s GLY 108 CO 0.17 1.25 1.20 -0.54 0.00 0.00 0.00 173.10 175.18 2wro s GLU 109 N -0.79 4.50 0.00 2.90 2.02 -1.26 -0.74 118.70 125.33 2wro s GLU 109 Ca 0.03 1.93 0.00 0.00 0.02 0.00 0.00 54.97 56.95 2wro s GLU 109 Cb -0.02 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 31.02 2wro s GLU 109 CO -0.04 -0.03 0.00 1.17 0.02 0.00 0.00 175.26 176.38 2wro n LYS 110 N 1.84 0.00 -0.07 1.61 3.00 0.50 -4.84 118.16 120.20 2wro n LYS 110 Ca 0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.24 2wro n LYS 110 Cb 0.44 0.00 0.09 0.00 0.00 0.00 0.00 35.03 35.56 2wro n LYS 110 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2wro n HIS 111 N 0.00 -2.53 -2.88 5.64 1.44 -1.26 -5.03 115.22 110.59 2wro n HIS 111 Ca 0.00 -0.25 0.00 0.00 -2.01 0.00 0.00 57.72 55.46 2wro n HIS 111 Cb 0.00 -0.40 0.00 0.00 0.12 0.00 0.00 29.99 29.71 2wro n HIS 111 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2wro n GLY 112 N -1.79 -0.54 0.00 -1.39 0.00 -1.26 -5.01 105.19 95.19 2wro n GLY 112 Ca 0.04 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.24 2wro n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60