#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fw3 s TRP 5 N 0.00 2.74 0.22 4.41 1.48 -1.26 -1.17 118.94 125.36 3fw3 s TRP 5 Ca 0.00 -0.19 -0.12 0.00 -1.06 0.00 0.00 56.10 54.73 3fw3 s TRP 5 Cb 0.00 -1.29 -0.00 0.00 -1.16 0.00 0.00 33.47 31.02 3fw3 s TRP 5 CO 0.00 0.56 0.43 0.00 -4.06 0.00 0.00 176.95 173.87 3fw3 s TYR 7 N -3.99 3.53 0.27 0.00 2.02 -1.26 -3.70 117.35 114.23 3fw3 s TYR 7 Ca 0.19 1.02 0.00 0.00 -0.37 0.00 0.00 57.07 57.92 3fw3 s TYR 7 Cb 0.01 -2.45 0.60 0.00 -0.40 0.00 0.00 41.96 39.72 3fw3 s TYR 7 CO 0.05 -0.28 1.71 1.49 -1.57 0.00 0.00 175.55 176.95 3fw3 h GLU 8 N 0.59 0.42 0.00 -0.62 4.81 -1.88 -1.20 114.58 116.69 3fw3 h GLU 8 Ca -0.47 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 3fw3 h GLU 8 Cb 1.19 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 3fw3 h GLU 8 CO 0.63 0.28 -0.04 -0.24 -0.73 0.00 0.00 179.01 178.90 3fw3 h VAL 9 N 0.43 0.47 0.00 0.32 3.04 -1.93 0.42 116.25 119.00 3fw3 h VAL 9 Ca 0.49 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.98 3fw3 h VAL 9 Cb 0.85 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 3fw3 h VAL 9 CO -0.47 0.04 -0.28 0.00 -1.01 0.00 0.00 177.57 175.85 3fw3 n GLN 10 N -3.67 0.18 -0.02 4.17 6.02 -0.46 -3.96 117.38 119.64 3fw3 n GLN 10 Ca -0.02 0.09 -0.11 0.00 -0.01 0.00 0.00 57.00 56.95 3fw3 n GLN 10 Cb 0.14 -1.65 -0.05 0.00 1.02 0.00 0.00 30.24 29.70 3fw3 n GLN 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3fw3 h ALA 11 N 2.69 0.17 0.00 -1.58 0.00 -0.90 0.54 119.26 120.18 3fw3 h ALA 11 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3fw3 h ALA 11 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3fw3 h ALA 11 CO 0.00 -0.29 0.00 0.39 0.00 0.00 0.00 179.25 179.35 3fw3 n GLU 11 N -4.94 0.31 0.00 0.00 4.71 -1.25 -4.96 120.64 114.52 3fw3 n GLU 11 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 3fw3 n GLU 11 Cb 0.08 -1.22 0.00 0.00 -1.01 0.00 0.00 31.44 29.28 3fw3 n GLU 11 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 3fw3 n SER 11 N -0.72 0.00 -2.94 1.62 3.41 0.18 -5.12 113.62 110.04 3fw3 n SER 11 Ca 0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.25 3fw3 n SER 11 Cb 0.02 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.00 3fw3 n SER 11 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3fw3 n ASN 11 N 0.00 7.46 -3.54 4.04 6.94 -1.26 -4.87 115.26 124.03 3fw3 n ASN 11 Ca 0.00 -3.83 -0.16 0.00 -0.02 0.00 0.00 54.58 50.57 3fw3 n ASN 11 Cb 0.00 -1.06 -0.06 0.00 -2.36 0.00 0.00 39.78 36.30 3fw3 n ASN 11 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 3fw3 s TYR 11 N -4.08 -0.58 0.30 -2.53 -0.85 -1.26 -5.15 117.35 103.20 3fw3 s TYR 11 Ca 0.51 1.00 -0.29 0.00 -0.52 0.00 0.00 57.07 57.77 3fw3 s TYR 11 Cb 0.43 0.42 -0.10 0.00 0.38 0.00 0.00 41.96 43.09 3fw3 s TYR 11 CO -0.40 -0.54 1.18 -2.14 -1.52 0.00 0.00 175.55 172.13 3fw3 s PRO 11 N -1.17 4.53 0.12 -3.49 0.02 -1.26 -5.02 135.00 128.73 3fw3 s PRO 11 Ca -0.08 1.96 -0.23 0.00 0.02 0.00 0.00 61.00 62.66 3fw3 s PRO 11 Cb -0.00 -3.15 0.06 0.00 0.02 0.00 0.00 34.50 31.43 3fw3 s PRO 11 CO 0.08 0.06 0.58 0.00 -0.33 0.00 0.00 177.00 177.39 3fw3 s LEU 11 N -2.46 4.05 0.71 0.00 1.43 -0.32 -4.85 118.68 117.23 3fw3 s LEU 11 Ca -0.01 0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 53.39 3fw3 s LEU 11 Cb -0.01 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.68 3fw3 s LEU 11 CO -0.09 -0.24 1.07 0.68 0.23 0.00 0.00 176.35 178.01 3fw3 s VAL 12 N 2.19 3.80 0.28 -1.59 -7.23 -1.26 -0.90 120.40 115.69 3fw3 s VAL 12 Ca 0.18 0.58 0.02 0.00 -1.81 0.00 0.00 61.98 60.96 3fw3 s VAL 12 Cb -0.16 -3.45 0.29 0.00 0.56 0.00 0.00 36.38 33.62 3fw3 s VAL 12 CO 0.09 -0.76 1.68 -0.65 -0.31 0.00 0.00 175.10 175.15 3fw3 h PRO 13 N -0.70 0.31 0.00 4.82 0.11 -1.90 0.11 132.00 134.75 3fw3 h PRO 13 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fw3 h PRO 13 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3fw3 h PRO 13 CO 0.60 0.21 0.00 -0.39 -0.21 0.00 0.00 178.00 178.21 3fw3 h VAL 14 N 0.32 0.00 -0.30 3.15 -1.51 -1.95 -2.63 116.25 113.34 3fw3 h VAL 14 Ca 0.53 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 65.72 3fw3 h VAL 14 Cb 1.02 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 3fw3 h VAL 14 CO -0.56 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.07 3fw3 n LYS 15 N -2.39 2.17 -1.72 5.19 5.02 0.31 -5.06 118.16 121.68 3fw3 n LYS 15 Ca 0.02 -1.91 -0.41 0.00 -2.02 0.00 0.00 58.31 53.98 3fw3 n LYS 15 Cb 0.24 -1.33 0.01 0.00 -0.02 0.00 0.00 35.03 33.93 3fw3 n LYS 15 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3fw3 n TRP 16 N 0.84 2.37 0.00 2.13 8.01 -0.82 -4.82 117.44 125.16 3fw3 n TRP 16 Ca 0.13 0.49 0.00 0.00 -1.31 0.00 0.00 57.50 56.81 3fw3 n TRP 16 Cb 0.44 -2.42 0.00 0.00 -2.01 0.00 0.00 31.31 27.32 3fw3 n TRP 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3fw3 n GLY 20 N 0.72 0.59 7.00 6.99 0.00 -1.26 -4.59 105.19 114.63 3fw3 n GLY 20 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3fw3 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fw3 n GLY 21 N 5.00 3.01 1.02 -0.02 0.00 -1.26 -1.86 105.19 111.07 3fw3 n GLY 21 Ca 0.00 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.03 3fw3 n GLY 21 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fw3 n ASN 22 N 2.68 3.00 0.20 1.61 3.02 -0.70 -4.58 115.26 120.48 3fw3 n ASN 22 Ca 0.00 -1.94 0.14 0.00 -0.03 0.00 0.00 54.58 52.75 3fw3 n ASN 22 Cb 0.00 -0.28 0.68 0.00 -0.61 0.00 0.00 39.78 39.56 3fw3 n ASN 22 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fw3 n GLN 24 N -2.54 3.23 -0.10 0.00 1.13 -1.26 -4.99 117.38 112.86 3fw3 n GLN 24 Ca -0.00 -2.62 0.00 0.00 -1.94 0.00 0.00 57.00 52.44 3fw3 n GLN 24 Cb 0.16 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 28.84 3fw3 n GLN 24 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3fw3 n LYS 25 N 0.78 0.54 -0.02 -1.09 5.02 -0.86 -5.05 118.16 117.48 3fw3 n LYS 25 Ca 0.21 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.55 3fw3 n LYS 25 Cb 0.72 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.79 3fw3 n LYS 25 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3fw3 n ASP 26 N -1.98 1.96 -2.57 4.39 8.00 -1.26 -4.49 116.55 120.59 3fw3 n ASP 26 Ca 0.00 -1.49 -0.18 0.00 0.71 0.00 0.00 54.79 53.83 3fw3 n ASP 26 Cb 0.00 -0.03 0.02 0.00 -0.02 0.00 0.00 41.12 41.08 3fw3 n ASP 26 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3fw3 n ARG 27 N 0.52 2.25 -2.40 -1.24 1.74 -1.26 -4.77 116.66 111.49 3fw3 n ARG 27 Ca 0.06 -3.86 -0.27 0.00 -0.77 0.00 0.00 57.85 53.01 3fw3 n ARG 27 Cb 0.27 -1.73 0.02 0.00 -1.02 0.00 0.00 32.46 30.00 3fw3 n ARG 27 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3fw3 s GLN 28 N -3.32 3.19 0.15 5.56 -1.52 -1.26 -3.22 119.66 119.23 3fw3 s GLN 28 Ca 0.37 0.16 0.06 0.00 -1.95 0.00 0.00 55.36 54.00 3fw3 s GLN 28 Cb 0.43 -2.27 -0.04 0.00 -0.22 0.00 0.00 33.01 30.90 3fw3 s GLN 28 CO -0.07 -0.54 -0.13 -1.12 -0.25 0.00 0.00 175.29 173.18 3fw3 s SER 29 N -4.23 2.08 0.81 5.90 0.01 -1.26 -4.62 113.70 112.39 3fw3 s SER 29 Ca 0.52 -0.91 -0.09 0.00 1.31 0.00 0.00 55.95 56.78 3fw3 s SER 29 Cb -0.11 -0.07 0.13 0.00 0.21 0.00 0.00 66.02 66.18 3fw3 s SER 29 CO 0.46 -0.20 1.14 -2.16 0.41 0.00 0.00 173.24 172.89 3fw3 s PRO 30 N -3.17 1.49 0.19 12.44 0.04 -1.26 -4.59 135.00 140.14 3fw3 s PRO 30 Ca 0.14 -0.46 0.02 0.00 0.04 0.00 0.00 61.00 60.74 3fw3 s PRO 30 Cb -0.02 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 3fw3 s PRO 30 CO 0.03 -1.75 0.01 0.96 0.04 0.00 0.00 177.00 176.29 3fw3 s ILE 31 N -3.49 0.74 -0.03 0.56 -4.36 -1.26 -0.48 121.20 112.88 3fw3 s ILE 31 Ca 0.67 -1.99 -0.25 0.00 -0.26 0.00 0.00 60.65 58.81 3fw3 s ILE 31 Cb -0.07 -2.19 -0.04 0.00 1.25 0.00 0.00 42.46 41.42 3fw3 s ILE 31 CO 0.48 -0.42 0.79 0.21 0.24 0.00 0.00 174.94 176.23 3fw3 s ASN 32 N -3.20 7.13 -0.35 4.36 2.47 -1.26 -2.85 114.94 121.23 3fw3 s ASN 32 Ca 0.25 1.36 -0.11 0.00 0.42 0.00 0.00 52.86 54.78 3fw3 s ASN 32 Cb 0.06 -2.46 0.00 0.00 -1.45 0.00 0.00 41.25 37.40 3fw3 s ASN 32 CO 0.05 -0.13 0.21 -0.63 -3.72 0.00 0.00 177.10 172.88 3fw3 s ILE 33 N 0.72 4.84 -0.56 -5.21 1.01 0.01 -4.97 121.20 117.04 3fw3 s ILE 33 Ca 0.42 -0.52 -0.24 0.00 0.00 0.00 0.00 60.65 60.30 3fw3 s ILE 33 Cb -0.19 -3.56 0.04 0.00 0.01 0.00 0.00 42.46 38.76 3fw3 s ILE 33 CO 0.22 -0.08 0.95 -0.69 0.00 0.00 0.00 174.94 175.33 3fw3 s VAL 34 N 1.63 4.38 0.33 2.92 1.01 -1.26 -0.66 120.40 128.74 3fw3 s VAL 34 Ca 0.04 0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.30 3fw3 s VAL 34 Cb -0.18 -4.55 0.17 0.00 0.00 0.00 0.00 36.38 31.82 3fw3 s VAL 34 CO 0.08 -1.14 1.87 0.71 0.00 0.00 0.00 175.10 176.63 3fw3 h THR 35 N 6.02 1.20 0.00 3.92 1.35 -1.95 -1.05 112.91 122.40 3fw3 h THR 35 Ca -0.26 -0.75 -0.02 0.00 -0.55 0.00 0.00 66.41 64.83 3fw3 h THR 35 Cb 1.07 0.83 -0.00 0.00 -1.73 0.00 0.00 68.15 68.32 3fw3 h THR 35 CO 1.09 0.27 -0.09 0.71 -0.25 0.00 0.00 175.52 177.25 3fw3 h THR 36 N 0.59 0.23 -0.01 6.82 1.35 -2.03 -2.83 112.91 117.04 3fw3 h THR 36 Ca 0.13 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 3fw3 h THR 36 Cb 0.29 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 3fw3 h THR 36 CO 0.00 0.09 -0.39 0.29 -0.25 0.00 0.00 175.52 175.26 3fw3 n LYS 37 N -3.23 0.60 -2.92 4.72 5.02 -0.42 -4.86 118.16 117.07 3fw3 n LYS 37 Ca 0.00 -0.38 -0.41 0.00 -2.02 0.00 0.00 58.31 55.50 3fw3 n LYS 37 Cb 0.35 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.83 3fw3 n LYS 37 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fw3 s ALA 38 N -2.66 3.47 0.04 7.82 0.00 -1.07 -4.77 121.76 124.59 3fw3 s ALA 38 Ca 0.19 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.90 3fw3 s ALA 38 Cb 0.18 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 3fw3 s ALA 38 CO 0.60 -0.54 1.11 0.15 0.00 0.00 0.00 175.76 177.07 3fw3 s LYS 39 N 1.88 4.49 0.24 0.00 3.01 -1.00 -4.65 119.74 123.71 3fw3 s LYS 39 Ca 0.38 1.62 -0.30 0.00 -1.01 0.00 0.00 55.97 56.67 3fw3 s LYS 39 Cb -0.17 -3.39 -0.10 0.00 -1.01 0.00 0.00 37.83 33.16 3fw3 s LYS 39 CO 0.14 -0.16 1.37 0.08 0.51 0.00 0.00 175.35 177.29 3fw3 s VAL 40 N 0.99 2.87 -0.21 3.17 1.01 -1.26 -1.23 120.40 125.74 3fw3 s VAL 40 Ca 0.56 0.75 -0.01 0.00 0.00 0.00 0.00 61.98 63.27 3fw3 s VAL 40 Cb -0.26 -3.48 0.06 0.00 0.00 0.00 0.00 36.38 32.70 3fw3 s VAL 40 CO 0.29 0.12 -0.00 -0.62 0.00 0.00 0.00 175.10 174.89 3fw3 s ASP 41 N 0.24 3.28 0.00 3.32 -1.08 0.08 -4.86 116.67 117.65 3fw3 s ASP 41 Ca 0.57 -0.96 0.28 0.00 -0.52 0.00 0.00 52.55 51.93 3fw3 s ASP 41 Cb -0.40 -0.83 1.39 0.00 -1.46 0.00 0.00 42.92 41.62 3fw3 s ASP 41 CO 0.42 -0.27 1.97 0.29 0.52 0.00 0.00 175.17 178.10 3fw3 n LYS 42 N 4.90 0.33 0.00 4.34 4.01 -1.26 -2.02 118.16 128.45 3fw3 n LYS 42 Ca -0.10 0.02 0.13 0.00 -0.51 0.00 0.00 58.31 57.85 3fw3 n LYS 42 Cb 0.46 -1.50 0.46 0.00 -0.51 0.00 0.00 35.03 33.94 3fw3 n LYS 42 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 3fw3 n LYS 43 N -1.33 0.74 -2.31 1.97 5.02 -1.26 -4.54 118.16 116.46 3fw3 n LYS 43 Ca 0.12 -0.38 -0.34 0.00 -2.02 0.00 0.00 58.31 55.70 3fw3 n LYS 43 Cb 0.25 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.73 3fw3 n LYS 43 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3fw3 s LEU 44 N -2.51 3.35 0.00 -0.35 1.43 -0.86 -4.44 118.68 115.29 3fw3 s LEU 44 Ca 0.25 -1.21 -0.02 0.00 -1.03 0.00 0.00 54.13 52.12 3fw3 s LEU 44 Cb 0.19 -2.57 0.07 0.00 0.03 0.00 0.00 46.19 43.91 3fw3 s LEU 44 CO 0.51 -2.13 0.44 0.61 0.23 0.00 0.00 176.35 176.01 3fw3 n GLY 45 N 6.68 0.17 3.76 -3.19 0.00 -1.26 -4.74 105.19 106.61 3fw3 n GLY 45 Ca 0.38 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 3fw3 n GLY 45 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3fw3 s ARG 46 N -3.68 2.95 0.38 1.61 1.70 -1.26 -3.31 118.95 117.35 3fw3 s ARG 46 Ca 0.28 1.57 -0.21 0.00 -0.47 0.00 0.00 55.73 56.90 3fw3 s ARG 46 Cb -0.01 -1.95 -0.10 0.00 -0.57 0.00 0.00 34.95 32.31 3fw3 s ARG 46 CO 0.19 -1.17 0.92 -0.06 -1.08 0.00 0.00 175.30 174.10 3fw3 s PHE 47 N -1.99 3.42 -0.14 5.89 0.40 -1.26 -1.50 117.98 122.79 3fw3 s PHE 47 Ca 0.71 1.60 0.01 0.00 -0.60 0.00 0.00 56.93 58.65 3fw3 s PHE 47 Cb -0.24 -2.82 -0.00 0.00 0.51 0.00 0.00 43.02 40.46 3fw3 s PHE 47 CO 0.36 0.01 -0.16 -0.06 0.70 0.00 0.00 175.22 176.06 3fw3 s PHE 48 N -2.00 2.76 -0.14 0.36 0.08 0.16 -4.87 117.98 114.33 3fw3 s PHE 48 Ca 0.58 -0.95 -0.06 0.00 0.12 0.00 0.00 56.93 56.61 3fw3 s PHE 48 Cb -0.12 -1.86 -0.04 0.00 -0.57 0.00 0.00 43.02 40.44 3fw3 s PHE 48 CO 0.16 -0.41 0.08 -0.06 -0.10 0.00 0.00 175.22 174.89 3fw3 s PHE 49 N 0.66 3.36 -0.13 0.36 0.08 -1.26 -1.53 117.98 119.51 3fw3 s PHE 49 Ca -0.08 0.27 0.03 0.00 0.12 0.00 0.00 56.93 57.27 3fw3 s PHE 49 Cb -0.16 -1.98 0.01 0.00 -0.57 0.00 0.00 43.02 40.32 3fw3 s PHE 49 CO 0.02 0.42 -0.22 0.45 -0.10 0.00 0.00 175.22 175.79 3fw3 s SER 50 N -0.34 3.06 0.00 1.36 0.15 -0.33 -4.69 113.70 112.90 3fw3 s SER 50 Ca 0.09 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.16 3fw3 s SER 50 Cb -0.12 -1.41 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 3fw3 s SER 50 CO 0.02 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.16 3fw3 n GLY 50 N 3.96 1.15 0.22 9.45 0.00 -1.26 -0.99 105.19 117.72 3fw3 n GLY 50 Ca -0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.93 3fw3 n GLY 50 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3fw3 h TYR 51 N 0.00 0.00 0.00 1.61 -1.99 -1.88 -3.11 116.97 111.60 3fw3 h TYR 51 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3fw3 h TYR 51 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 3fw3 h TYR 51 CO 0.00 0.19 -0.67 -0.40 -0.00 0.00 0.00 178.16 177.29 3fw3 n ASP 52 N -3.29 0.61 -4.72 3.88 5.75 -1.26 -1.00 116.55 116.52 3fw3 n ASP 52 Ca 0.01 -0.08 -0.41 0.00 -0.01 0.00 0.00 54.79 54.29 3fw3 n ASP 52 Cb 0.45 0.33 -0.04 0.00 -1.03 0.00 0.00 41.12 40.84 3fw3 n ASP 52 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 3fw3 s LYS 53 N -3.11 4.60 -0.03 0.11 2.20 -1.18 -4.85 119.74 117.48 3fw3 s LYS 53 Ca 0.07 1.55 -0.30 0.00 -0.36 0.00 0.00 55.97 56.93 3fw3 s LYS 53 Cb 0.15 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 33.06 3fw3 s LYS 53 CO 0.73 0.05 1.16 0.15 -0.36 0.00 0.00 175.35 177.08 3fw3 s LYS 54 N 0.32 4.40 0.13 4.03 -0.14 -1.26 -4.29 119.74 122.93 3fw3 s LYS 54 Ca 0.50 1.64 0.03 0.00 -1.36 0.00 0.00 55.97 56.78 3fw3 s LYS 54 Cb -0.25 -3.50 -0.04 0.00 -1.68 0.00 0.00 37.83 32.36 3fw3 s LYS 54 CO 0.30 -0.35 -0.08 -0.65 -0.76 0.00 0.00 175.35 173.81 3fw3 s GLN 55 N 1.83 0.98 -0.75 1.68 -1.52 -0.32 -4.85 119.66 116.71 3fw3 s GLN 55 Ca 0.55 -1.41 -0.15 0.00 -1.95 0.00 0.00 55.36 52.40 3fw3 s GLN 55 Cb -0.25 -0.44 0.19 0.00 -0.22 0.00 0.00 33.01 32.30 3fw3 s GLN 55 CO 0.24 0.02 0.69 0.95 -0.25 0.00 0.00 175.29 176.94 3fw3 s THR 56 N -3.47 5.50 0.32 -0.19 -4.23 -1.26 -1.51 115.64 110.80 3fw3 s THR 56 Ca 0.15 -2.20 -0.22 0.00 -1.18 0.00 0.00 61.69 58.24 3fw3 s THR 56 Cb 0.04 -4.43 -0.10 0.00 1.34 0.00 0.00 72.50 69.35 3fw3 s THR 56 CO -0.01 -0.99 0.87 0.26 -0.54 0.00 0.00 174.62 174.21 3fw3 s TRP 57 N 0.56 3.57 0.08 3.99 0.52 -1.25 -4.70 118.94 121.71 3fw3 s TRP 57 Ca 0.14 1.59 -0.30 0.00 0.02 0.00 0.00 56.10 57.54 3fw3 s TRP 57 Cb -0.16 -2.79 -0.05 0.00 -1.15 0.00 0.00 33.47 29.32 3fw3 s TRP 57 CO -0.06 0.17 0.98 0.99 0.02 0.00 0.00 176.95 179.05 3fw3 s THR 58 N -1.75 4.56 -0.02 2.01 2.01 -1.26 -0.53 115.64 120.67 3fw3 s THR 58 Ca 0.51 2.03 0.05 0.00 0.31 0.00 0.00 61.69 64.59 3fw3 s THR 58 Cb -0.15 -4.30 -0.01 0.00 0.01 0.00 0.00 72.50 68.05 3fw3 s THR 58 CO 0.20 0.26 -0.18 0.54 -0.69 0.00 0.00 174.62 174.76 3fw3 s VAL 59 N 0.31 1.40 0.02 3.82 0.11 -0.27 -1.35 120.40 124.44 3fw3 s VAL 59 Ca 0.49 -0.75 0.01 0.00 -2.93 0.00 0.00 61.98 58.80 3fw3 s VAL 59 Cb -0.23 -1.17 -0.02 0.00 -1.53 0.00 0.00 36.38 33.43 3fw3 s VAL 59 CO 0.30 0.40 -0.05 0.00 -3.33 0.00 0.00 175.10 172.41 3fw3 s GLN 60 N -0.35 0.39 -0.35 1.54 -2.07 -0.05 -1.04 119.66 117.72 3fw3 s GLN 60 Ca 0.05 -0.50 -0.24 0.00 -1.82 0.00 0.00 55.36 52.86 3fw3 s GLN 60 Cb -0.07 -0.20 0.01 0.00 -1.09 0.00 0.00 33.01 31.66 3fw3 s GLN 60 CO -0.00 0.04 0.81 1.21 -1.32 0.00 0.00 175.29 176.02 3fw3 s ASN 61 N -1.01 6.60 -0.03 12.60 3.84 -0.32 -0.84 114.94 135.78 3fw3 s ASN 61 Ca -0.07 0.46 0.19 0.00 0.21 0.00 0.00 52.86 53.65 3fw3 s ASN 61 Cb -0.07 -2.41 0.60 0.00 -0.55 0.00 0.00 41.25 38.82 3fw3 s ASN 61 CO -0.00 -0.73 1.51 -0.46 -2.79 0.00 0.00 177.10 174.63 3fw3 n ASN 62 N 6.43 3.96 0.00 -4.21 0.23 -0.91 -0.74 115.26 120.02 3fw3 n ASN 62 Ca 0.04 -2.13 0.00 0.00 -0.53 0.00 0.00 54.58 51.96 3fw3 n ASN 62 Cb 0.48 -0.47 0.00 0.00 -2.08 0.00 0.00 39.78 37.72 3fw3 n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3fw3 n GLY 63 N 1.26 1.30 0.00 4.83 0.00 -1.26 -4.77 105.19 106.56 3fw3 n GLY 63 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3fw3 n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fw3 n HIS 64 N -2.00 0.00 -3.62 1.61 8.25 -1.26 -4.79 115.22 113.41 3fw3 n HIS 64 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 3fw3 n HIS 64 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 3fw3 n HIS 64 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3fw3 n SER 65 N -1.44 -1.12 -4.53 0.41 2.88 -1.26 -4.87 113.62 103.68 3fw3 n SER 65 Ca 0.00 -1.67 -0.34 0.00 -1.33 0.00 0.00 58.87 55.54 3fw3 n SER 65 Cb 0.24 1.84 -0.12 0.00 -0.75 0.00 0.00 64.21 65.42 3fw3 n SER 65 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3fw3 s VAL 66 N -2.35 3.62 -0.06 2.46 -7.23 -1.26 -2.13 120.40 113.45 3fw3 s VAL 66 Ca 0.12 -0.49 0.01 0.00 -1.81 0.00 0.00 61.98 59.80 3fw3 s VAL 66 Cb -0.02 -2.50 0.02 0.00 0.56 0.00 0.00 36.38 34.44 3fw3 s VAL 66 CO 0.04 0.57 -0.05 -0.32 -0.31 0.00 0.00 175.10 175.03 3fw3 s MET 67 N -0.39 1.02 -0.01 4.82 0.00 -0.02 -3.49 119.30 121.23 3fw3 s MET 67 Ca 0.06 -0.14 -0.22 0.00 0.00 0.00 0.00 55.69 55.38 3fw3 s MET 67 Cb -0.12 -1.04 -0.05 0.00 0.00 0.00 0.00 34.83 33.62 3fw3 s MET 67 CO 0.02 -0.12 0.66 -1.64 0.00 0.00 0.00 175.02 173.94 3fw3 s MET 68 N 1.13 4.39 -0.36 4.11 -1.94 0.31 -0.88 119.30 126.06 3fw3 s MET 68 Ca -0.07 0.84 -0.19 0.00 -1.71 0.00 0.00 55.69 54.56 3fw3 s MET 68 Cb -0.14 -3.37 0.00 0.00 2.01 0.00 0.00 34.83 33.33 3fw3 s MET 68 CO -0.01 0.28 0.56 -0.51 -0.01 0.00 0.00 175.02 175.33 3fw3 s LEU 69 N 0.06 4.36 0.11 -0.03 1.43 -0.46 -1.66 118.68 122.49 3fw3 s LEU 69 Ca 0.34 -0.03 0.23 0.00 -1.03 0.00 0.00 54.13 53.63 3fw3 s LEU 69 Cb -0.19 -2.65 0.01 0.00 0.03 0.00 0.00 46.19 43.39 3fw3 s LEU 69 CO 0.19 -0.55 0.99 0.18 0.23 0.00 0.00 176.35 177.39 3fw3 n LEU 70 N 5.88 0.63 -2.86 1.79 4.77 -0.15 -4.52 117.00 122.54 3fw3 n LEU 70 Ca -0.03 0.16 -0.21 0.00 -0.03 0.00 0.00 56.01 55.89 3fw3 n LEU 70 Cb 0.49 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.51 3fw3 n LEU 70 CO 0.47 -0.07 -0.09 -0.62 -1.33 0.00 0.00 177.39 175.75 3fw3 n GLU 71 N -2.32 -3.56 -3.30 3.23 1.02 -1.22 -1.44 120.64 113.06 3fw3 n GLU 71 Ca 0.00 0.82 -0.24 0.00 -0.02 0.00 0.00 57.16 57.72 3fw3 n GLU 71 Cb 0.50 -5.58 0.03 0.00 -0.02 0.00 0.00 31.44 26.38 3fw3 n GLU 71 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fw3 n ASN 72 N -2.27 -5.31 -0.93 1.62 3.02 -0.30 -4.86 115.26 106.22 3fw3 n ASN 72 Ca -0.13 -0.41 0.12 0.00 -0.03 0.00 0.00 54.58 54.13 3fw3 n ASN 72 Cb 0.62 -4.29 0.10 0.00 -0.61 0.00 0.00 39.78 35.60 3fw3 n ASN 72 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3fw3 n LYS 76 N -4.14 2.24 -4.02 3.52 5.02 -0.52 -4.82 118.16 115.43 3fw3 n LYS 76 Ca -0.05 -1.88 -0.10 0.00 -2.02 0.00 0.00 58.31 54.26 3fw3 n LYS 76 Cb 0.58 -1.45 -0.08 0.00 -0.02 0.00 0.00 35.03 34.06 3fw3 n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fw3 s ALA 77 N -1.96 0.25 0.20 7.82 0.00 -1.26 -4.63 121.76 122.17 3fw3 s ALA 77 Ca 0.27 -1.07 -0.21 0.00 0.00 0.00 0.00 51.96 50.96 3fw3 s ALA 77 Cb 0.20 0.93 0.05 0.00 0.00 0.00 0.00 23.12 24.29 3fw3 s ALA 77 CO 0.30 -0.63 0.60 -1.54 0.00 0.00 0.00 175.76 174.49 3fw3 s SER 78 N -3.00 -0.41 0.10 0.00 1.04 -0.16 -0.37 113.70 110.89 3fw3 s SER 78 Ca 0.21 -0.27 0.05 0.00 0.48 0.00 0.00 55.95 56.41 3fw3 s SER 78 Cb 0.04 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 3fw3 s SER 78 CO 0.02 -1.08 -0.12 0.27 0.98 0.00 0.00 173.24 173.32 3fw3 s ILE 79 N -3.82 1.09 0.36 -1.02 -4.36 -0.03 -1.19 121.20 112.22 3fw3 s ILE 79 Ca 0.05 -1.60 -0.03 0.00 -0.26 0.00 0.00 60.65 58.81 3fw3 s ILE 79 Cb -0.02 -1.35 0.01 0.00 1.25 0.00 0.00 42.46 42.35 3fw3 s ILE 79 CO -0.06 -0.46 0.53 -1.54 0.24 0.00 0.00 174.94 173.65 3fw3 n SER 80 N 0.68 -1.47 0.00 4.36 3.41 -0.58 -1.42 113.62 118.60 3fw3 n SER 80 Ca -0.17 -2.86 0.00 0.00 -0.26 0.00 0.00 58.87 55.59 3fw3 n SER 80 Cb 0.57 2.70 0.00 0.00 -0.26 0.00 0.00 64.21 67.22 3fw3 n SER 80 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fw3 n GLY 81 N -0.57 0.59 2.39 5.00 0.00 -1.26 -0.67 105.19 110.67 3fw3 n GLY 81 Ca -0.01 -0.84 -0.15 0.00 0.00 0.00 0.00 46.02 45.02 3fw3 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fw3 n GLY 82 N 0.00 -0.26 2.56 -0.02 0.00 -0.57 -0.77 105.19 106.14 3fw3 n GLY 82 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3fw3 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fw3 n GLY 83 N -0.80 0.30 3.78 -0.02 0.00 -1.26 -4.75 105.19 102.44 3fw3 n GLY 83 Ca -0.18 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 3fw3 n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fw3 s LEU 84 N -0.22 4.48 0.00 0.99 1.43 0.05 -4.98 118.68 120.43 3fw3 s LEU 84 Ca 0.00 1.68 0.30 0.00 -1.03 0.00 0.00 54.13 55.08 3fw3 s LEU 84 Cb 0.00 -3.58 1.55 0.00 0.03 0.00 0.00 46.19 44.19 3fw3 s LEU 84 CO 0.00 0.09 2.07 -0.81 0.23 0.00 0.00 176.35 177.93 3fw3 n PRO 85 N 1.12 0.52 -3.82 1.29 -0.04 -1.26 -4.53 135.00 128.28 3fw3 n PRO 85 Ca -0.03 -0.02 -0.08 0.00 -0.04 0.00 0.00 63.50 63.33 3fw3 n PRO 85 Cb 0.49 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 3fw3 n PRO 85 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fw3 s ALA 86 N -2.49 -0.99 0.44 0.55 0.00 -1.26 -5.13 121.76 112.88 3fw3 s ALA 86 Ca 0.31 -0.33 -0.22 0.00 0.00 0.00 0.00 51.96 51.73 3fw3 s ALA 86 Cb 0.20 0.90 -0.09 0.00 0.00 0.00 0.00 23.12 24.13 3fw3 s ALA 86 CO 0.45 -0.92 1.01 -1.25 0.00 0.00 0.00 175.76 175.05 3fw3 s PRO 87 N -3.91 4.04 -0.03 0.00 0.04 -1.26 -4.76 135.00 129.11 3fw3 s PRO 87 Ca 0.12 1.33 0.04 0.00 0.04 0.00 0.00 61.00 62.53 3fw3 s PRO 87 Cb -0.03 -2.26 -0.00 0.00 0.04 0.00 0.00 34.50 32.24 3fw3 s PRO 87 CO 0.03 -0.22 -0.15 0.71 0.04 0.00 0.00 177.00 177.41 3fw3 s TYR 88 N -1.94 1.49 -0.10 0.56 1.51 -0.51 -1.51 117.35 116.86 3fw3 s TYR 88 Ca 0.63 -0.39 -0.11 0.00 -1.01 0.00 0.00 57.07 56.18 3fw3 s TYR 88 Cb -0.16 -1.01 -0.05 0.00 -0.11 0.00 0.00 41.96 40.64 3fw3 s TYR 88 CO 0.20 -0.13 0.25 1.14 -1.11 0.00 0.00 175.55 175.91 3fw3 s GLN 89 N 0.00 3.82 0.00 -0.62 -2.07 0.09 -0.85 119.66 120.03 3fw3 s GLN 89 Ca -0.02 0.08 -0.30 0.00 -1.82 0.00 0.00 55.36 53.30 3fw3 s GLN 89 Cb -0.10 -3.27 -0.06 0.00 -1.09 0.00 0.00 33.01 28.49 3fw3 s GLN 89 CO 0.01 0.60 1.57 0.00 -1.32 0.00 0.00 175.29 176.16 3fw3 s ALA 90 N -0.61 3.63 -0.20 2.60 0.00 0.50 -0.71 121.76 126.96 3fw3 s ALA 90 Ca 0.17 1.00 -0.13 0.00 0.00 0.00 0.00 51.96 53.00 3fw3 s ALA 90 Cb -0.14 -3.68 -0.08 0.00 0.00 0.00 0.00 23.12 19.22 3fw3 s ALA 90 CO 0.06 -1.16 -0.31 1.63 0.00 0.00 0.00 175.76 175.99 3fw3 n LYS 91 N 6.10 0.49 -3.52 0.00 4.76 0.27 -1.15 118.16 125.11 3fw3 n LYS 91 Ca 0.16 0.21 -0.12 0.00 -2.87 0.00 0.00 58.31 55.68 3fw3 n LYS 91 Cb 0.42 -1.33 -0.04 0.00 -1.84 0.00 0.00 35.03 32.24 3fw3 n LYS 91 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 3fw3 s GLN 92 N -2.56 1.15 -0.06 1.97 1.03 -1.13 -0.98 119.66 119.07 3fw3 s GLN 92 Ca -0.30 -0.43 0.02 0.00 0.04 0.00 0.00 55.36 54.68 3fw3 s GLN 92 Cb 0.09 0.52 0.02 0.00 0.03 0.00 0.00 33.01 33.68 3fw3 s GLN 92 CO 0.40 -0.46 -0.10 -1.17 -2.54 0.00 0.00 175.29 171.42 3fw3 s LEU 93 N -2.48 1.55 0.28 2.60 0.20 -0.66 -0.69 118.68 119.48 3fw3 s LEU 93 Ca -0.01 -0.26 0.00 0.00 0.69 0.00 0.00 54.13 54.55 3fw3 s LEU 93 Cb -0.00 -0.75 -0.02 0.00 -0.43 0.00 0.00 46.19 44.99 3fw3 s LEU 93 CO -0.09 0.01 0.29 -1.38 -0.29 0.00 0.00 176.35 174.89 3fw3 s HIS 94 N 0.78 1.26 0.18 5.38 -3.43 -0.79 -0.53 115.29 118.15 3fw3 s HIS 94 Ca -0.13 -1.39 0.03 0.00 -0.80 0.00 0.00 55.06 52.77 3fw3 s HIS 94 Cb -0.15 -0.44 -0.05 0.00 -1.43 0.00 0.00 32.58 30.51 3fw3 s HIS 94 CO 0.02 -0.86 -0.03 -0.51 -2.00 0.00 0.00 174.74 171.37 3fw3 s LEU 95 N -3.23 2.25 0.03 5.38 1.02 -1.23 -1.02 118.68 121.88 3fw3 s LEU 95 Ca 0.36 -1.15 0.06 0.00 0.02 0.00 0.00 54.13 53.43 3fw3 s LEU 95 Cb 0.03 -0.20 -0.02 0.00 0.02 0.00 0.00 46.19 46.02 3fw3 s LEU 95 CO 0.19 -0.49 -0.18 -1.00 0.02 0.00 0.00 176.35 174.89 3fw3 s HIS 96 N -3.50 1.59 0.27 0.29 3.76 -0.05 -4.61 115.29 113.05 3fw3 s HIS 96 Ca 0.23 -0.35 -0.21 0.00 -0.15 0.00 0.00 55.06 54.59 3fw3 s HIS 96 Cb 0.05 -0.96 0.04 0.00 1.11 0.00 0.00 32.58 32.82 3fw3 s HIS 96 CO 0.04 0.05 0.80 1.67 -0.85 0.00 0.00 174.74 176.45 3fw3 s TRP 97 N -0.71 -0.11 0.00 1.40 -2.14 -1.17 -0.98 118.94 115.22 3fw3 s TRP 97 Ca 0.06 -0.36 0.00 0.00 2.66 0.00 0.00 56.10 58.45 3fw3 s TRP 97 Cb -0.08 0.72 0.00 0.00 -3.10 0.00 0.00 33.47 31.01 3fw3 s TRP 97 CO 0.01 -1.21 0.00 0.45 -2.66 0.00 0.00 176.95 173.54 3fw3 n SER 98 N -0.68 0.84 0.00 -2.66 2.88 -1.19 0.14 113.62 112.95 3fw3 n SER 98 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 3fw3 n SER 98 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 3fw3 n SER 98 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3fw3 n ASP 99 N 0.00 1.71 -4.24 -3.46 5.68 -1.26 -4.76 116.55 110.22 3fw3 n ASP 99 Ca 0.00 -1.78 -0.27 0.00 -0.50 0.00 0.00 54.79 52.24 3fw3 n ASP 99 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 3fw3 n ASP 99 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3fw3 s LEU 100 N -0.78 2.11 0.32 -2.12 1.43 -1.26 -5.04 118.68 113.33 3fw3 s LEU 100 Ca 0.00 -0.46 0.23 0.00 -1.03 0.00 0.00 54.13 52.87 3fw3 s LEU 100 Cb 0.00 -1.04 1.16 0.00 0.03 0.00 0.00 46.19 46.34 3fw3 s LEU 100 CO 0.00 0.21 1.71 1.55 0.23 0.00 0.00 176.35 180.06 3fw3 h PRO 101 N 5.21 0.00 -0.25 1.29 0.13 -1.92 -3.13 132.00 133.34 3fw3 h PRO 101 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3fw3 h PRO 101 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3fw3 h PRO 101 CO 0.46 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.71 3fw3 n TYR 102 N -2.31 0.47 -2.29 1.56 0.18 -1.26 -2.39 117.16 111.12 3fw3 n TYR 102 Ca -0.00 -0.61 0.02 0.00 1.88 0.00 0.00 57.90 59.18 3fw3 n TYR 102 Cb 0.11 -0.10 0.00 0.00 -0.38 0.00 0.00 39.34 38.97 3fw3 n TYR 102 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 3fw3 n LYS 103 N 0.00 0.00 -0.00 -3.48 2.85 -1.18 -4.47 118.16 111.89 3fw3 n LYS 103 Ca 0.12 -1.54 0.07 0.00 -1.05 0.00 0.00 58.31 55.91 3fw3 n LYS 103 Cb 0.52 -0.08 -0.09 0.00 -0.65 0.00 0.00 35.03 34.74 3fw3 n LYS 103 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3fw3 n GLY 104 N 0.29 -0.40 3.91 2.58 0.00 -0.22 -4.46 105.19 106.89 3fw3 n GLY 104 Ca 0.01 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 3fw3 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fw3 s SER 105 N -2.46 6.41 -0.15 1.61 1.04 -0.51 -3.06 113.70 116.59 3fw3 s SER 105 Ca 0.05 0.66 -0.18 0.00 0.48 0.00 0.00 55.95 56.96 3fw3 s SER 105 Cb 0.11 -2.12 -0.16 0.00 0.10 0.00 0.00 66.02 63.95 3fw3 s SER 105 CO 0.61 -0.21 0.34 -0.33 0.98 0.00 0.00 173.24 174.62 3fw3 h GLU 106 N 1.52 0.00 -7.11 4.02 5.08 -1.90 -3.46 114.58 112.73 3fw3 h GLU 106 Ca -0.48 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.41 3fw3 h GLU 106 Cb 1.19 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.47 3fw3 h GLU 106 CO 0.65 0.65 0.38 -1.01 -1.00 0.00 0.00 179.01 178.68 3fw3 s HIS 107 N -2.12 3.09 0.11 4.33 3.76 -1.26 -4.59 115.29 118.62 3fw3 s HIS 107 Ca -0.17 1.56 0.09 0.00 -0.15 0.00 0.00 55.06 56.39 3fw3 s HIS 107 Cb 0.01 -2.99 -0.04 0.00 1.11 0.00 0.00 32.58 30.67 3fw3 s HIS 107 CO 0.45 -0.73 -0.23 -1.54 -0.85 0.00 0.00 174.74 171.85 3fw3 s SER 108 N -2.30 2.81 -0.24 1.40 1.04 -1.13 -4.69 113.70 110.57 3fw3 s SER 108 Ca 0.65 -0.70 -0.04 0.00 0.48 0.00 0.00 55.95 56.33 3fw3 s SER 108 Cb -0.14 -0.17 0.00 0.00 0.10 0.00 0.00 66.02 65.81 3fw3 s SER 108 CO 0.24 0.10 -0.01 -0.76 0.98 0.00 0.00 173.24 173.79 3fw3 s LEU 109 N -1.93 3.20 -1.54 2.42 1.43 -0.71 -0.81 118.68 120.74 3fw3 s LEU 109 Ca 0.09 -0.54 -0.14 0.00 -1.03 0.00 0.00 54.13 52.50 3fw3 s LEU 109 Cb -0.10 -1.77 0.11 0.00 0.03 0.00 0.00 46.19 44.46 3fw3 s LEU 109 CO 0.05 -0.08 0.80 0.47 0.23 0.00 0.00 176.35 177.82 3fw3 n ASP 110 N 4.80 -4.11 0.00 2.29 8.00 0.16 -0.64 116.55 127.05 3fw3 n ASP 110 Ca -0.17 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.57 3fw3 n ASP 110 Cb 0.49 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 3fw3 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fw3 n GLY 111 N -1.46 1.71 3.67 0.44 0.00 -1.26 -5.02 105.19 103.27 3fw3 n GLY 111 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3fw3 n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fw3 s GLU 112 N -0.14 4.25 0.26 1.61 8.01 0.19 -5.02 118.70 127.86 3fw3 s GLU 112 Ca 0.00 0.58 0.06 0.00 0.01 0.00 0.00 54.97 55.62 3fw3 s GLU 112 Cb 0.00 -3.54 -0.03 0.00 -4.31 0.00 0.00 34.13 26.25 3fw3 s GLU 112 CO 0.00 -0.14 0.36 -1.01 0.01 0.00 0.00 175.26 174.48 3fw3 s HIS 113 N 1.57 3.32 0.39 1.61 3.76 -1.26 -1.73 115.29 122.94 3fw3 s HIS 113 Ca 0.28 -0.08 0.04 0.00 -0.15 0.00 0.00 55.06 55.15 3fw3 s HIS 113 Cb -0.16 -1.64 -0.05 0.00 1.11 0.00 0.00 32.58 31.84 3fw3 s HIS 113 CO 0.11 0.35 0.06 -0.06 -0.85 0.00 0.00 174.74 174.35 3fw3 s PHE 114 N -2.05 1.97 0.23 1.40 0.40 -1.26 -4.69 117.98 113.98 3fw3 s PHE 114 Ca 0.36 -1.01 0.09 0.00 -0.60 0.00 0.00 56.93 55.77 3fw3 s PHE 114 Cb -0.09 -1.37 0.21 0.00 0.51 0.00 0.00 43.02 42.29 3fw3 s PHE 114 CO 0.29 0.02 1.53 0.00 0.70 0.00 0.00 175.22 177.75 3fw3 h ALA 115 N 1.84 0.82 -2.75 5.36 0.00 -0.80 -0.25 119.26 123.49 3fw3 h ALA 115 Ca -0.40 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 53.76 3fw3 h ALA 115 Cb 1.26 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 3fw3 h ALA 115 CO 0.68 0.88 -0.25 -1.64 0.00 0.00 0.00 179.25 178.92 3fw3 s MET 116 N -3.40 1.39 -0.02 0.00 -1.94 -1.07 -3.17 119.30 111.09 3fw3 s MET 116 Ca -0.01 -1.29 -0.00 0.00 -1.71 0.00 0.00 55.69 52.68 3fw3 s MET 116 Cb 0.12 0.41 0.03 0.00 2.01 0.00 0.00 34.83 37.40 3fw3 s MET 116 CO 0.78 -0.54 0.02 -2.00 -0.01 0.00 0.00 175.02 173.27 3fw3 s GLU 117 N -4.03 0.05 -0.18 2.03 2.12 -0.15 -1.28 118.70 117.26 3fw3 s GLU 117 Ca 0.24 0.17 -0.06 0.00 0.36 0.00 0.00 54.97 55.68 3fw3 s GLU 117 Cb 0.02 -0.34 -0.04 0.00 0.26 0.00 0.00 34.13 34.03 3fw3 s GLU 117 CO 0.07 -0.17 0.03 1.41 -0.54 0.00 0.00 175.26 176.06 3fw3 s MET 118 N 1.16 3.85 -0.22 4.30 -2.45 0.51 -0.87 119.30 125.58 3fw3 s MET 118 Ca -0.08 -0.41 -0.02 0.00 -1.25 0.00 0.00 55.69 53.93 3fw3 s MET 118 Cb -0.13 -3.12 0.01 0.00 1.25 0.00 0.00 34.83 32.83 3fw3 s MET 118 CO -0.03 0.23 -0.07 -1.01 1.05 0.00 0.00 175.02 175.19 3fw3 s HIS 119 N 0.45 2.96 -0.33 4.11 3.76 -0.18 -1.14 115.29 124.92 3fw3 s HIS 119 Ca 0.01 -1.24 -0.11 0.00 -0.15 0.00 0.00 55.06 53.56 3fw3 s HIS 119 Cb -0.13 -2.06 -0.01 0.00 1.11 0.00 0.00 32.58 31.49 3fw3 s HIS 119 CO 0.01 -0.65 0.20 0.42 -0.85 0.00 0.00 174.74 173.87 3fw3 s ILE 120 N 1.40 4.87 -0.21 0.60 1.01 -0.27 -1.88 121.20 126.73 3fw3 s ILE 120 Ca 0.04 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.17 3fw3 s ILE 120 Cb -0.15 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 3fw3 s ILE 120 CO -0.05 -0.01 0.15 -0.69 0.00 0.00 0.00 174.94 174.34 3fw3 s VAL 121 N 1.65 5.39 0.08 2.92 1.01 0.14 -1.09 120.40 130.49 3fw3 s VAL 121 Ca 0.05 0.22 0.06 0.00 0.00 0.00 0.00 61.98 62.31 3fw3 s VAL 121 Cb -0.18 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 3fw3 s VAL 121 CO 0.08 0.41 -0.16 -1.00 0.00 0.00 0.00 175.10 174.43 3fw3 s HIS 122 N 0.54 1.36 0.00 5.22 3.76 -0.26 -0.56 115.29 125.34 3fw3 s HIS 122 Ca 0.09 -0.45 0.08 0.00 -0.15 0.00 0.00 55.06 54.63 3fw3 s HIS 122 Cb -0.12 -0.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.79 3fw3 s HIS 122 CO -0.00 0.09 -0.24 -2.00 -0.85 0.00 0.00 174.74 171.74 3fw3 s GLU 123 N -1.78 1.87 0.22 1.40 2.12 0.11 -1.14 118.70 121.50 3fw3 s GLU 123 Ca 0.00 -0.93 -0.31 0.00 0.36 0.00 0.00 54.97 54.09 3fw3 s GLU 123 Cb -0.10 -1.88 -0.10 0.00 0.26 0.00 0.00 34.13 32.31 3fw3 s GLU 123 CO 0.03 0.51 1.50 0.21 -0.54 0.00 0.00 175.26 176.96 3fw3 s LYS 124 N -0.79 4.24 -1.16 4.30 2.20 -0.51 -0.73 119.74 127.28 3fw3 s LYS 124 Ca 0.10 2.34 -0.17 0.00 -0.36 0.00 0.00 55.97 57.87 3fw3 s LYS 124 Cb -0.09 -3.12 -0.05 0.00 -1.51 0.00 0.00 37.83 33.05 3fw3 s LYS 124 CO 0.00 -0.50 2.12 0.39 -0.36 0.00 0.00 175.35 177.00 3fw3 n GLU 125 N 2.95 2.30 -0.01 4.03 1.02 -0.57 -4.84 120.64 125.51 3fw3 n GLU 125 Ca 0.10 -2.24 0.06 0.00 -0.02 0.00 0.00 57.16 55.06 3fw3 n GLU 125 Cb 0.39 -3.10 -0.11 0.00 -0.02 0.00 0.00 31.44 28.61 3fw3 n GLU 125 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3fw3 n GLU 133 N 6.34 0.51 -2.78 3.49 4.71 -1.26 -4.89 120.64 126.77 3fw3 n GLU 133 Ca 0.52 -0.12 -0.43 0.00 -0.01 0.00 0.00 57.16 57.11 3fw3 n GLU 133 Cb 0.38 -1.34 -0.01 0.00 -1.01 0.00 0.00 31.44 29.46 3fw3 n GLU 133 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3fw3 s ALA 134 N -2.95 3.45 0.74 0.62 0.00 -1.26 -5.02 121.76 117.35 3fw3 s ALA 134 Ca -0.05 -2.92 -0.12 0.00 0.00 0.00 0.00 51.96 48.86 3fw3 s ALA 134 Cb 0.09 -4.32 0.04 0.00 0.00 0.00 0.00 23.12 18.93 3fw3 s ALA 134 CO 0.59 -3.11 1.11 1.14 0.00 0.00 0.00 175.76 175.49 3fw3 s GLN 135 N 3.13 2.31 -0.03 0.00 -2.07 -1.26 -4.94 119.66 116.80 3fw3 s GLN 135 Ca 0.44 1.33 -0.30 0.00 -1.82 0.00 0.00 55.36 55.02 3fw3 s GLN 135 Cb -0.01 -1.89 -0.08 0.00 -1.09 0.00 0.00 33.01 29.94 3fw3 s GLN 135 CO -0.02 -1.62 1.98 0.34 -1.32 0.00 0.00 175.29 174.64 3fw3 s ASP 136 N -2.92 6.26 0.49 12.60 3.68 -1.26 -4.88 116.67 130.64 3fw3 s ASP 136 Ca 0.65 2.43 0.18 0.00 2.13 0.00 0.00 52.55 57.94 3fw3 s ASP 136 Cb -0.20 -2.53 1.21 0.00 -1.45 0.00 0.00 42.92 39.96 3fw3 s ASP 136 CO 0.50 -1.24 2.07 1.55 0.13 0.00 0.00 175.17 178.18 3fw3 h PRO 137 N 11.42 0.00 0.00 4.34 0.13 -1.95 -3.29 132.00 142.65 3fw3 h PRO 137 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3fw3 h PRO 137 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3fw3 h PRO 137 CO 0.95 0.11 -0.49 0.39 -0.23 0.00 0.00 178.00 178.73 3fw3 n GLU 138 N -4.22 0.04 -1.97 0.86 1.02 -1.26 -4.15 120.64 110.96 3fw3 n GLU 138 Ca -0.03 0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.14 3fw3 n GLU 138 Cb 0.19 -1.52 0.03 0.00 -0.02 0.00 0.00 31.44 30.12 3fw3 n GLU 138 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3fw3 n ASP 139 N -1.58 0.97 -0.23 1.62 5.75 -1.22 -3.07 116.55 118.79 3fw3 n ASP 139 Ca 0.05 -2.02 -0.01 0.00 -0.01 0.00 0.00 54.79 52.80 3fw3 n ASP 139 Cb 0.35 -0.28 0.20 0.00 -1.03 0.00 0.00 41.12 40.35 3fw3 n ASP 139 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3fw3 h GLU 140 N 1.48 1.02 -6.12 0.11 5.08 -1.41 -3.43 114.58 111.32 3fw3 h GLU 140 Ca -0.23 -0.10 -0.69 0.00 -1.00 0.00 0.00 59.36 57.34 3fw3 h GLU 140 Cb 1.63 -0.21 -0.27 0.00 0.50 0.00 0.00 28.75 30.40 3fw3 h GLU 140 CO 0.09 0.74 -0.83 0.42 -1.00 0.00 0.00 179.01 178.44 3fw3 s ILE 141 N -5.72 2.57 -0.21 3.13 1.01 -0.71 -1.42 121.20 119.86 3fw3 s ILE 141 Ca -0.11 -0.89 -0.02 0.00 0.00 0.00 0.00 60.65 59.63 3fw3 s ILE 141 Cb 0.17 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.66 3fw3 s ILE 141 CO 0.80 0.57 -0.09 0.00 0.00 0.00 0.00 174.94 176.22 3fw3 s ALA 142 N -0.37 2.65 -0.20 9.38 0.00 -0.29 -0.73 121.76 132.20 3fw3 s ALA 142 Ca 0.03 -1.19 -0.07 0.00 0.00 0.00 0.00 51.96 50.73 3fw3 s ALA 142 Cb -0.12 -1.53 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 3fw3 s ALA 142 CO 0.02 -0.41 0.06 0.08 0.00 0.00 0.00 175.76 175.51 3fw3 s VAL 143 N 1.42 4.65 -0.24 0.00 1.01 -0.94 -1.11 120.40 125.18 3fw3 s VAL 143 Ca 0.05 -0.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.80 3fw3 s VAL 143 Cb -0.14 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 3fw3 s VAL 143 CO -0.07 0.43 0.40 -0.76 0.00 0.00 0.00 175.10 175.11 3fw3 s LEU 144 N 0.64 4.08 -0.17 3.92 1.43 -0.25 -1.92 118.68 126.41 3fw3 s LEU 144 Ca 0.03 0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 53.50 3fw3 s LEU 144 Cb -0.13 -2.48 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 3fw3 s LEU 144 CO 0.02 -0.16 -0.08 0.00 0.23 0.00 0.00 176.35 176.36 3fw3 s ALA 145 N 1.83 2.77 -0.11 4.21 0.00 0.78 -1.11 121.76 130.12 3fw3 s ALA 145 Ca 0.17 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.16 3fw3 s ALA 145 Cb -0.15 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 3fw3 s ALA 145 CO 0.09 -0.04 -0.19 -0.06 0.00 0.00 0.00 175.76 175.57 3fw3 s PHE 146 N 0.81 2.68 0.13 0.00 0.40 -0.29 -1.51 117.98 120.19 3fw3 s PHE 146 Ca -0.03 -0.80 -0.18 0.00 -0.60 0.00 0.00 56.93 55.32 3fw3 s PHE 146 Cb -0.15 -1.76 -0.07 0.00 0.51 0.00 0.00 43.02 41.55 3fw3 s PHE 146 CO 0.01 -0.28 0.60 -0.51 0.70 0.00 0.00 175.22 175.74 3fw3 s LEU 147 N 0.26 4.45 -0.03 -0.37 1.43 -1.26 -0.36 118.68 122.80 3fw3 s LEU 147 Ca -0.13 1.27 0.07 0.00 -1.03 0.00 0.00 54.13 54.31 3fw3 s LEU 147 Cb -0.16 -3.14 -0.02 0.00 0.03 0.00 0.00 46.19 42.90 3fw3 s LEU 147 CO 0.07 0.18 -0.24 -0.69 0.23 0.00 0.00 176.35 175.90 3fw3 s VAL 148 N -1.28 1.92 0.18 -1.59 1.01 -0.40 -0.80 120.40 119.44 3fw3 s VAL 148 Ca 0.34 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3fw3 s VAL 148 Cb -0.18 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 3fw3 s VAL 148 CO 0.20 0.54 0.07 -1.83 0.00 0.00 0.00 175.10 174.08 3fw3 s GLU 149 N -0.41 1.11 0.07 2.72 -1.05 -0.26 -1.23 118.70 119.65 3fw3 s GLU 149 Ca 0.05 -1.56 -0.30 0.00 -0.15 0.00 0.00 54.97 53.01 3fw3 s GLU 149 Cb -0.11 0.03 -0.05 0.00 -0.44 0.00 0.00 34.13 33.57 3fw3 s GLU 149 CO 0.01 -0.26 1.02 0.00 0.95 0.00 0.00 175.26 176.97 3fw3 s ALA 150 N -3.92 3.25 0.16 -0.84 0.00 -1.26 -1.48 121.76 117.67 3fw3 s ALA 150 Ca 0.30 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.89 3fw3 s ALA 150 Cb 0.07 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.86 3fw3 s ALA 150 CO 0.07 -0.18 0.06 0.41 0.00 0.00 0.00 175.76 176.11 3fw3 n GLY 151 N 2.60 3.50 0.86 0.00 0.00 0.20 -4.84 105.19 107.50 3fw3 n GLY 151 Ca 0.05 -2.23 0.07 0.00 0.00 0.00 0.00 46.02 43.91 3fw3 n GLY 151 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fw3 n THR 151 N -0.62 1.02 -4.81 2.61 -2.24 -1.26 -4.19 114.28 104.79 3fw3 n THR 151 Ca -0.03 -1.01 -0.30 0.00 -2.27 0.00 0.00 64.05 60.43 3fw3 n THR 151 Cb 0.19 0.49 -0.14 0.00 -2.10 0.00 0.00 70.33 68.77 3fw3 n THR 151 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3fw3 s GLN 152 N -1.02 1.80 0.20 -0.78 1.11 -1.26 -5.03 119.66 114.67 3fw3 s GLN 152 Ca 0.31 -1.12 -0.32 0.00 0.01 0.00 0.00 55.36 54.25 3fw3 s GLN 152 Cb 0.16 -2.01 -0.12 0.00 -1.01 0.00 0.00 33.01 30.04 3fw3 s GLN 152 CO 0.21 0.51 1.72 0.08 0.01 0.00 0.00 175.29 177.82 3fw3 s VAL 153 N -0.86 2.12 -0.69 1.09 1.01 -1.26 -3.13 120.40 118.68 3fw3 s VAL 153 Ca 0.12 0.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.93 3fw3 s VAL 153 Cb -0.10 -3.04 0.06 0.00 0.00 0.00 0.00 36.38 33.30 3fw3 s VAL 153 CO 0.03 0.00 1.07 0.21 0.00 0.00 0.00 175.10 176.41 3fw3 s ASN 154 N 1.29 6.18 0.47 3.32 3.84 -1.26 -4.90 114.94 123.89 3fw3 s ASN 154 Ca 0.75 -0.86 0.17 0.00 0.21 0.00 0.00 52.86 53.13 3fw3 s ASN 154 Cb -0.49 -2.46 1.11 0.00 -0.55 0.00 0.00 41.25 38.86 3fw3 s ASN 154 CO 0.32 -1.55 2.02 -0.33 -2.79 0.00 0.00 177.10 174.77 3fw3 h GLU 155 N 9.69 0.00 -0.50 0.43 4.39 -1.94 -2.26 114.58 124.39 3fw3 h GLU 155 Ca -0.27 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.48 3fw3 h GLU 155 Cb 1.06 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 3fw3 h GLU 155 CO 1.21 0.15 0.34 0.78 -1.16 0.00 0.00 179.01 180.33 3fw3 h GLY 156 N 0.52 0.57 1.30 -3.84 0.00 -1.91 -2.42 103.07 97.29 3fw3 h GLY 156 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3fw3 h GLY 156 CO 0.02 0.15 -0.21 0.69 0.00 0.00 0.00 176.54 177.18 3fw3 n PHE 157 N -4.47 0.00 -0.23 5.60 3.01 -0.85 -4.40 117.46 116.12 3fw3 n PHE 157 Ca 0.07 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.46 3fw3 n PHE 157 Cb 0.23 -0.32 0.04 0.00 -0.01 0.00 0.00 39.48 39.42 3fw3 n PHE 157 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 3fw3 h GLN 158 N 0.18 0.90 -0.90 -1.08 1.08 -1.47 -1.32 115.11 112.50 3fw3 h GLN 158 Ca 0.00 -0.12 0.10 0.00 -1.45 0.00 0.00 58.65 57.18 3fw3 h GLN 158 Cb 0.46 -0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 27.65 3fw3 h GLN 158 CO 0.00 0.69 0.54 -1.35 -0.95 0.00 0.00 178.83 177.77 3fw3 h PRO 159 N 0.87 0.88 -0.12 1.46 0.11 -1.79 0.23 132.00 133.64 3fw3 h PRO 159 Ca 0.22 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 3fw3 h PRO 159 Cb 0.07 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 30.98 3fw3 h PRO 159 CO -0.03 0.58 0.03 1.25 -0.21 0.00 0.00 178.00 179.62 3fw3 h LEU 160 N 0.91 0.18 -0.69 2.35 5.85 -1.74 -2.08 115.31 120.10 3fw3 h LEU 160 Ca 0.43 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 3fw3 h LEU 160 Cb 0.36 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 3fw3 h LEU 160 CO -0.24 0.36 0.21 0.58 -0.34 0.00 0.00 178.44 179.02 3fw3 h VAL 161 N -0.01 1.25 -0.39 1.05 2.07 -0.92 -2.39 116.25 116.91 3fw3 h VAL 161 Ca 0.04 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.60 3fw3 h VAL 161 Cb 0.25 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3fw3 h VAL 161 CO 0.00 0.34 -0.08 -0.33 0.02 0.00 0.00 177.57 177.52 3fw3 h GLU 162 N 1.01 0.67 0.00 1.57 5.08 -0.98 -2.57 114.58 119.36 3fw3 h GLU 162 Ca 0.22 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3fw3 h GLU 162 Cb 0.30 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 3fw3 h GLU 162 CO -0.01 0.74 -0.12 0.00 -1.00 0.00 0.00 179.01 178.63 3fw3 h ALA 163 N 1.29 1.17 0.00 3.43 0.00 -0.88 -2.72 119.26 121.55 3fw3 h ALA 163 Ca 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3fw3 h ALA 163 Cb 0.51 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3fw3 h ALA 163 CO 0.03 0.15 -0.04 -0.07 0.00 0.00 0.00 179.25 179.32 3fw3 h LEU 164 N 0.00 0.00 -2.37 0.00 3.38 -1.09 -1.78 115.31 113.45 3fw3 h LEU 164 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3fw3 h LEU 164 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 3fw3 h LEU 164 CO 0.02 0.04 0.02 0.28 0.09 0.00 0.00 178.44 178.89 3fw3 h SER 165 N 0.00 0.00 -0.22 -0.43 0.02 -1.64 -2.45 113.55 108.83 3fw3 h SER 165 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fw3 h SER 165 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 3fw3 h SER 165 CO 0.01 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.29 3fw3 n ASN 166 N -3.95 2.99 -2.70 3.07 3.02 -0.67 -4.55 115.26 112.46 3fw3 n ASN 166 Ca -0.02 -1.94 -0.16 0.00 -0.03 0.00 0.00 54.58 52.43 3fw3 n ASN 166 Cb 0.11 -0.13 0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3fw3 n ASN 166 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3fw3 n ILE 167 N 1.24 1.29 -0.14 2.41 -5.35 -0.92 -4.71 119.36 113.17 3fw3 n ILE 167 Ca 0.17 -3.86 -0.01 0.00 -0.27 0.00 0.00 62.75 58.78 3fw3 n ILE 167 Cb 0.56 -0.04 0.23 0.00 -1.74 0.00 0.00 39.64 38.64 3fw3 n ILE 167 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 3fw3 h PRO 168 N 2.90 0.84 -6.27 6.28 0.13 -1.75 -3.42 132.00 130.70 3fw3 h PRO 168 Ca 0.04 -0.13 -0.58 0.00 -0.87 0.00 0.00 66.00 64.46 3fw3 h PRO 168 Cb 1.05 -0.15 -0.10 0.00 0.13 0.00 0.00 31.00 31.93 3fw3 h PRO 168 CO 0.60 0.69 -0.64 -1.59 -0.23 0.00 0.00 178.00 176.83 3fw3 s LYS 169 N -5.39 2.42 0.43 0.86 -2.85 -1.26 -1.24 119.74 112.71 3fw3 s LYS 169 Ca -0.10 -1.22 -0.23 0.00 -1.00 0.00 0.00 55.97 53.42 3fw3 s LYS 169 Cb 0.16 -2.31 -0.11 0.00 -2.06 0.00 0.00 37.83 33.52 3fw3 s LYS 169 CO 0.79 0.42 0.88 -0.35 0.10 0.00 0.00 175.35 177.18 3fw3 n PRO 170 N -0.53 1.09 -0.98 1.78 -0.04 -1.26 -2.30 135.00 132.76 3fw3 n PRO 170 Ca -0.08 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 3fw3 n PRO 170 Cb 0.57 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 3fw3 n PRO 170 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3fw3 n GLU 171 N 0.18 -0.10 -3.49 0.54 -0.58 0.08 -4.88 120.64 112.39 3fw3 n GLU 171 Ca 0.10 0.03 -0.35 0.00 -0.42 0.00 0.00 57.16 56.52 3fw3 n GLU 171 Cb 0.40 -2.98 -0.06 0.00 -0.57 0.00 0.00 31.44 28.24 3fw3 n GLU 171 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 3fw3 s MET 172 N -0.14 3.84 0.12 3.49 -1.94 -0.97 -4.97 119.30 118.74 3fw3 s MET 172 Ca 0.00 0.29 0.04 0.00 -1.71 0.00 0.00 55.69 54.31 3fw3 s MET 172 Cb 0.00 -2.95 -0.04 0.00 2.01 0.00 0.00 34.83 33.85 3fw3 s MET 172 CO 0.00 0.52 -0.10 -1.12 -0.01 0.00 0.00 175.02 174.31 3fw3 s SER 173 N -1.79 1.61 0.20 3.03 0.01 -1.26 -1.17 113.70 114.33 3fw3 s SER 173 Ca 0.36 -0.94 -0.13 0.00 1.31 0.00 0.00 55.95 56.55 3fw3 s SER 173 Cb -0.14 0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.10 3fw3 s SER 173 CO 0.19 -0.32 0.44 0.28 0.41 0.00 0.00 173.24 174.24 3fw3 s THR 174 N -3.02 0.03 -0.24 1.44 -1.32 -0.21 -4.91 115.64 107.42 3fw3 s THR 174 Ca 0.12 -1.17 -0.10 0.00 -1.21 0.00 0.00 61.69 59.33 3fw3 s THR 174 Cb 0.01 -1.86 -0.05 0.00 -1.51 0.00 0.00 72.50 69.09 3fw3 s THR 174 CO -0.00 -0.14 0.15 -0.89 -2.21 0.00 0.00 174.62 171.53 3fw3 s THR 175 N -3.95 5.26 0.46 5.08 2.01 -1.26 -1.12 115.64 122.12 3fw3 s THR 175 Ca 0.16 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 62.09 3fw3 s THR 175 Cb 0.00 -3.45 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 3fw3 s THR 175 CO 0.02 0.35 1.05 -0.04 -0.69 0.00 0.00 174.62 175.31 3fw3 s MET 176 N 1.08 3.89 0.84 4.92 -1.94 0.31 -4.96 119.30 123.45 3fw3 s MET 176 Ca 0.07 1.43 -0.13 0.00 -1.71 0.00 0.00 55.69 55.36 3fw3 s MET 176 Cb -0.14 -2.23 0.08 0.00 2.01 0.00 0.00 34.83 34.55 3fw3 s MET 176 CO 0.05 -0.37 1.04 0.00 -0.01 0.00 0.00 175.02 175.72 3fw3 n ALA 177 N -0.70 -0.62 -1.61 3.03 0.00 -1.26 -3.94 120.51 115.41 3fw3 n ALA 177 Ca 0.08 -0.40 -0.50 0.00 0.00 0.00 0.00 53.44 52.61 3fw3 n ALA 177 Cb 0.51 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.76 3fw3 n ALA 177 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3fw3 n GLU 178 N -3.05 1.38 -3.51 0.00 2.13 -1.26 -4.70 120.64 111.63 3fw3 n GLU 178 Ca 0.12 0.50 -0.11 0.00 0.66 0.00 0.00 57.16 58.33 3fw3 n GLU 178 Cb 0.51 -2.16 -0.03 0.00 0.27 0.00 0.00 31.44 30.03 3fw3 n GLU 178 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3fw3 s SER 179 N 0.56 -0.44 0.44 4.31 1.04 -0.57 -4.90 113.70 114.14 3fw3 s SER 179 Ca 0.83 0.17 0.07 0.00 0.48 0.00 0.00 55.95 57.49 3fw3 s SER 179 Cb -0.89 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 65.62 3fw3 s SER 179 CO 0.45 -0.62 0.21 -0.94 0.98 0.00 0.00 173.24 173.32 3fw3 s SER 180 N -2.08 4.47 0.18 7.02 1.04 -1.26 -1.17 113.70 121.90 3fw3 s SER 180 Ca 0.01 -1.13 -0.03 0.00 0.48 0.00 0.00 55.95 55.28 3fw3 s SER 180 Cb -0.01 -0.26 0.07 0.00 0.10 0.00 0.00 66.02 65.92 3fw3 s SER 180 CO -0.05 -0.66 1.46 -0.07 0.98 0.00 0.00 173.24 174.90 3fw3 h LEU 181 N 1.29 0.59 -2.15 2.42 3.38 -1.68 -3.01 115.31 116.15 3fw3 h LEU 181 Ca -0.42 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.19 3fw3 h LEU 181 Cb 1.27 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 3fw3 h LEU 181 CO 0.68 1.08 -0.04 -0.07 0.09 0.00 0.00 178.44 180.17 3fw3 h LEU 182 N 0.38 0.00 -2.11 1.67 3.38 -1.43 0.38 115.31 117.57 3fw3 h LEU 182 Ca -0.01 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.04 3fw3 h LEU 182 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3fw3 h LEU 182 CO 0.12 0.04 0.29 0.44 0.09 0.00 0.00 178.44 179.42 3fw3 h ASP 183 N 0.00 0.00 0.13 -0.43 3.32 -1.79 -1.98 116.42 115.68 3fw3 h ASP 183 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3fw3 h ASP 183 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3fw3 h ASP 183 CO 0.01 0.00 -0.42 0.18 -1.72 0.00 0.00 179.24 177.28 3fw3 n LEU 184 N -3.86 1.39 -4.78 1.55 4.77 0.12 -4.18 117.00 112.01 3fw3 n LEU 184 Ca 0.04 -0.46 -0.23 0.00 -0.03 0.00 0.00 56.01 55.33 3fw3 n LEU 184 Cb 0.44 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 3fw3 n LEU 184 CO 0.29 0.27 -0.22 -0.76 -1.33 0.00 0.00 177.39 175.64 3fw3 s LEU 185 N -2.57 3.68 1.10 2.23 1.43 -0.74 -5.01 118.68 118.80 3fw3 s LEU 185 Ca 0.20 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 52.87 3fw3 s LEU 185 Cb 0.18 -2.23 0.25 0.00 0.03 0.00 0.00 46.19 44.42 3fw3 s LEU 185 CO 0.58 -0.00 1.06 -2.84 0.23 0.00 0.00 176.35 175.38 3fw3 s PRO 186 N -3.60 -0.45 0.00 1.29 0.02 -1.26 -5.01 135.00 125.98 3fw3 s PRO 186 Ca 0.32 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.32 3fw3 s PRO 186 Cb -0.08 -1.60 0.00 0.00 0.02 0.00 0.00 34.50 32.84 3fw3 s PRO 186 CO 0.23 -3.45 0.00 1.63 -0.33 0.00 0.00 177.00 175.08 3fw3 n LYS 187 N -4.75 2.99 0.00 5.54 5.02 -1.26 -4.90 118.16 120.81 3fw3 n LYS 187 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 3fw3 n LYS 187 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 3fw3 n LYS 187 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3fw3 n GLU 187 N 0.00 0.00 -0.05 1.97 -0.58 -1.26 -3.55 120.64 117.17 3fw3 n GLU 187 Ca 0.00 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.81 3fw3 n GLU 187 Cb 0.00 -0.28 0.33 0.00 -0.57 0.00 0.00 31.44 30.92 3fw3 n GLU 187 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3fw3 n LYS 188 N 0.00 1.34 -0.29 3.49 4.01 -1.26 -3.91 118.16 121.53 3fw3 n LYS 188 Ca 0.00 -0.51 0.10 0.00 -0.51 0.00 0.00 58.31 57.39 3fw3 n LYS 188 Cb 0.00 -1.26 0.27 0.00 -0.51 0.00 0.00 35.03 33.53 3fw3 n LYS 188 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3fw3 n LEU 189 N -0.21 3.22 0.10 -0.35 4.77 -1.23 -4.38 117.00 118.92 3fw3 n LEU 189 Ca 0.11 -1.58 -0.05 0.00 -0.03 0.00 0.00 56.01 54.46 3fw3 n LEU 189 Cb 0.16 -0.38 0.06 0.00 -2.33 0.00 0.00 43.42 40.93 3fw3 n LEU 189 CO 0.09 0.79 0.36 0.03 -1.33 0.00 0.00 177.39 177.33 3fw3 h ARG 189 N 3.59 0.11 -5.05 3.23 2.47 -1.93 -3.43 114.38 113.37 3fw3 h ARG 189 Ca 0.00 -0.10 -0.65 0.00 -1.26 0.00 0.00 59.98 57.97 3fw3 h ARG 189 Cb 0.82 0.02 -0.16 0.00 -1.65 0.00 0.00 29.97 29.00 3fw3 h ARG 189 CO 0.00 0.81 -0.24 -1.01 0.56 0.00 0.00 179.97 180.09 3fw3 s HIS 190 N -3.37 3.21 0.11 3.04 3.76 -1.26 -4.76 115.29 116.02 3fw3 s HIS 190 Ca -0.02 0.12 -0.11 0.00 -0.15 0.00 0.00 55.06 54.90 3fw3 s HIS 190 Cb 0.11 -2.68 0.01 0.00 1.11 0.00 0.00 32.58 31.13 3fw3 s HIS 190 CO 0.80 -0.39 0.27 1.52 -0.85 0.00 0.00 174.74 176.08 3fw3 s TYR 191 N 2.09 0.05 0.06 1.40 -0.85 -1.26 -1.78 117.35 117.06 3fw3 s TYR 191 Ca 0.14 -0.44 0.02 0.00 -0.52 0.00 0.00 57.07 56.26 3fw3 s TYR 191 Cb -0.16 0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.19 3fw3 s TYR 191 CO 0.11 -0.61 0.11 -0.06 -1.52 0.00 0.00 175.55 173.58 3fw3 s PHE 192 N -3.85 3.27 -0.02 -3.49 0.08 -0.20 -1.65 117.98 112.12 3fw3 s PHE 192 Ca 0.05 0.13 -0.00 0.00 0.12 0.00 0.00 56.93 57.23 3fw3 s PHE 192 Cb 0.04 -1.67 0.03 0.00 -0.57 0.00 0.00 43.02 40.85 3fw3 s PHE 192 CO -0.10 0.54 0.03 0.50 -0.10 0.00 0.00 175.22 176.09 3fw3 s ARG 193 N -2.32 -0.03 0.20 0.44 6.06 -0.08 -0.87 118.95 122.35 3fw3 s ARG 193 Ca 0.29 0.18 -0.19 0.00 -2.50 0.00 0.00 55.73 53.52 3fw3 s ARG 193 Cb -0.12 -0.23 0.03 0.00 0.06 0.00 0.00 34.95 34.69 3fw3 s ARG 193 CO 0.22 -0.16 0.56 1.52 -2.50 0.00 0.00 175.30 174.94 3fw3 s TYR 194 N 1.01 -0.20 -0.18 5.12 1.13 -1.09 -1.19 117.35 121.95 3fw3 s TYR 194 Ca -0.08 -0.14 -0.09 0.00 -1.41 0.00 0.00 57.07 55.35 3fw3 s TYR 194 Cb -0.12 0.46 -0.05 0.00 -1.10 0.00 0.00 41.96 41.15 3fw3 s TYR 194 CO -0.03 -0.94 0.12 -0.51 -2.51 0.00 0.00 175.55 171.68 3fw3 s LEU 195 N -2.86 4.20 0.00 -3.49 1.43 -1.26 -0.87 118.68 115.83 3fw3 s LEU 195 Ca 0.08 0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.45 3fw3 s LEU 195 Cb -0.02 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.14 3fw3 s LEU 195 CO -0.03 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.39 3fw3 n GLY 196 N 3.13 3.62 3.36 -3.19 0.00 -0.27 -4.91 105.19 106.92 3fw3 n GLY 196 Ca -0.17 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.54 3fw3 n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fw3 s SER 197 N 2.00 1.82 0.62 1.61 1.04 -1.20 -2.03 113.70 117.57 3fw3 s SER 197 Ca 0.00 -1.30 -0.18 0.00 0.48 0.00 0.00 55.95 54.95 3fw3 s SER 197 Cb 0.00 0.02 -0.02 0.00 0.10 0.00 0.00 66.02 66.12 3fw3 s SER 197 CO 0.00 -0.59 1.25 -0.76 0.98 0.00 0.00 173.24 174.12 3fw3 s LEU 198 N -3.36 3.61 -0.06 2.42 1.43 -0.65 -4.41 118.68 117.67 3fw3 s LEU 198 Ca 0.33 2.51 0.20 0.00 -1.03 0.00 0.00 54.13 56.13 3fw3 s LEU 198 Cb 0.07 -4.61 0.66 0.00 0.03 0.00 0.00 46.19 42.34 3fw3 s LEU 198 CO 0.12 -1.82 1.57 0.35 0.23 0.00 0.00 176.35 176.80 3fw3 n THR 199 N -1.78 1.44 -4.30 5.49 -2.24 -1.26 -4.43 114.28 107.20 3fw3 n THR 199 Ca 0.15 -1.12 -0.16 0.00 -2.27 0.00 0.00 64.05 60.65 3fw3 n THR 199 Cb 0.49 0.30 -0.10 0.00 -2.10 0.00 0.00 70.33 68.92 3fw3 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3fw3 s THR 200 N -1.46 1.07 0.33 4.28 -4.23 -1.26 -4.71 115.64 109.66 3fw3 s THR 200 Ca 0.48 -2.04 -0.28 0.00 -1.18 0.00 0.00 61.69 58.67 3fw3 s THR 200 Cb 0.29 -2.20 -0.13 0.00 1.34 0.00 0.00 72.50 71.80 3fw3 s THR 200 CO 0.28 -0.45 1.20 -2.65 -0.54 0.00 0.00 174.62 172.46 3fw3 n PRO 201 N -0.35 1.88 -0.26 3.99 -0.02 -1.26 -0.38 135.00 138.60 3fw3 n PRO 201 Ca -0.07 0.66 0.05 0.00 -2.02 0.00 0.00 63.50 62.12 3fw3 n PRO 201 Cb 0.63 -2.18 0.16 0.00 -0.02 0.00 0.00 33.50 32.09 3fw3 n PRO 201 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3fw3 n THR 202 N 0.27 0.74 -2.88 3.45 -2.24 -1.26 -4.98 114.28 107.38 3fw3 n THR 202 Ca 0.06 -0.52 -0.22 0.00 -2.27 0.00 0.00 64.05 61.10 3fw3 n THR 202 Cb 0.35 0.02 0.03 0.00 -2.10 0.00 0.00 70.33 68.62 3fw3 n THR 202 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fw3 n ASP 204 N -2.35 3.05 -3.70 0.00 8.00 -1.26 -4.33 116.55 115.95 3fw3 n ASP 204 Ca -0.14 1.14 -0.42 0.00 0.71 0.00 0.00 54.79 56.09 3fw3 n ASP 204 Cb 0.63 -1.47 -0.00 0.00 -0.02 0.00 0.00 41.12 40.26 3fw3 n ASP 204 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3fw3 n GLU 205 N 2.10 3.66 -0.36 -1.24 1.02 -1.26 -1.63 120.64 122.93 3fw3 n GLU 205 Ca 0.11 -3.17 0.03 0.00 -0.02 0.00 0.00 57.16 54.11 3fw3 n GLU 205 Cb 0.33 -2.93 0.04 0.00 -0.02 0.00 0.00 31.44 28.86 3fw3 n GLU 205 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3fw3 n LYS 206 N 3.88 0.42 -4.30 3.49 2.85 -1.11 -4.43 118.16 118.96 3fw3 n LYS 206 Ca 0.51 -1.49 -0.34 0.00 -1.05 0.00 0.00 58.31 55.94 3fw3 n LYS 206 Cb 0.33 -0.82 -0.12 0.00 -0.65 0.00 0.00 35.03 33.77 3fw3 n LYS 206 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3fw3 s VAL 207 N -0.91 3.95 -0.27 0.58 1.01 -0.86 -1.58 120.40 122.33 3fw3 s VAL 207 Ca 0.10 -0.33 -0.18 0.00 0.00 0.00 0.00 61.98 61.57 3fw3 s VAL 207 Cb 0.09 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 3fw3 s VAL 207 CO 0.01 0.48 0.52 0.54 0.00 0.00 0.00 175.10 176.65 3fw3 s VAL 208 N 0.52 5.06 -0.04 2.92 0.11 0.09 -1.12 120.40 127.94 3fw3 s VAL 208 Ca -0.02 0.87 -0.09 0.00 -2.93 0.00 0.00 61.98 59.81 3fw3 s VAL 208 Cb -0.14 -3.84 -0.05 0.00 -1.53 0.00 0.00 36.38 30.82 3fw3 s VAL 208 CO 0.02 0.06 0.26 0.26 -3.33 0.00 0.00 175.10 172.38 3fw3 s TRP 209 N 2.33 3.62 -0.09 1.54 0.52 -0.05 -2.21 118.94 124.61 3fw3 s TRP 209 Ca 0.21 0.67 0.00 0.00 0.02 0.00 0.00 56.10 57.01 3fw3 s TRP 209 Cb -0.16 -2.05 0.02 0.00 -1.15 0.00 0.00 33.47 30.13 3fw3 s TRP 209 CO 0.09 0.66 -0.07 0.99 0.02 0.00 0.00 176.95 178.65 3fw3 s THR 210 N -1.16 0.88 -0.25 2.01 2.01 -0.81 -2.68 115.64 115.66 3fw3 s THR 210 Ca 0.22 -0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.00 3fw3 s THR 210 Cb -0.14 -0.90 0.05 0.00 0.01 0.00 0.00 72.50 71.52 3fw3 s THR 210 CO 0.11 0.33 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.57 3fw3 s VAL 211 N 1.43 2.24 0.29 3.82 1.01 -0.05 -0.16 120.40 128.99 3fw3 s VAL 211 Ca -0.01 -1.44 -0.29 0.00 0.00 0.00 0.00 61.98 60.23 3fw3 s VAL 211 Cb -0.13 -2.23 -0.10 0.00 0.00 0.00 0.00 36.38 33.91 3fw3 s VAL 211 CO -0.04 0.09 1.18 -0.36 0.00 0.00 0.00 175.10 175.97 3fw3 s PHE 212 N 1.16 3.38 0.18 5.22 0.40 -0.57 -1.03 117.98 126.72 3fw3 s PHE 212 Ca -0.05 1.57 -0.01 0.00 -0.60 0.00 0.00 56.93 57.84 3fw3 s PHE 212 Cb -0.18 -3.44 0.06 0.00 0.51 0.00 0.00 43.02 39.97 3fw3 s PHE 212 CO -0.06 -1.07 1.43 -0.09 0.70 0.00 0.00 175.22 176.13 3fw3 h ARG 213 N 3.82 0.40 -6.18 0.44 2.43 -1.68 -3.42 114.38 110.19 3fw3 h ARG 213 Ca -0.47 -0.33 -0.57 0.00 -0.81 0.00 0.00 59.98 57.80 3fw3 h ARG 213 Cb 1.22 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.78 3fw3 h ARG 213 CO 0.67 0.97 0.87 -2.00 -1.51 0.00 0.00 179.97 178.96 3fw3 s GLU 214 N -3.61 4.17 0.43 0.20 2.56 -1.26 -5.02 118.70 116.17 3fw3 s GLU 214 Ca -0.06 1.40 -0.22 0.00 0.00 0.00 0.00 54.97 56.10 3fw3 s GLU 214 Cb 0.10 -3.73 -0.10 0.00 2.00 0.00 0.00 34.13 32.40 3fw3 s GLU 214 CO 0.84 -0.77 0.98 -1.25 -0.56 0.00 0.00 175.26 174.50 3fw3 s PRO 215 N 3.51 4.16 0.36 4.30 0.05 -1.26 -4.67 135.00 141.45 3fw3 s PRO 215 Ca 0.49 1.25 -0.27 0.00 0.05 0.00 0.00 61.00 62.52 3fw3 s PRO 215 Cb -0.17 -2.27 -0.09 0.00 0.05 0.00 0.00 34.50 32.02 3fw3 s PRO 215 CO 0.13 -0.10 1.22 0.42 0.05 0.00 0.00 177.00 178.71 3fw3 s ILE 216 N -2.01 2.98 -0.21 0.56 1.01 0.02 -4.92 121.20 118.64 3fw3 s ILE 216 Ca 0.61 0.90 -0.04 0.00 0.00 0.00 0.00 60.65 62.13 3fw3 s ILE 216 Cb -0.13 -3.54 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 3fw3 s ILE 216 CO 0.17 0.15 -0.02 -1.10 0.00 0.00 0.00 174.94 174.14 3fw3 s GLN 217 N -2.03 3.50 0.14 2.79 -0.21 -1.26 -1.11 119.66 121.49 3fw3 s GLN 217 Ca 0.53 -0.57 0.10 0.00 0.02 0.00 0.00 55.36 55.44 3fw3 s GLN 217 Cb -0.35 -3.03 -0.04 0.00 1.00 0.00 0.00 33.01 30.59 3fw3 s GLN 217 CO 0.45 -0.07 -0.20 -0.51 -2.12 0.00 0.00 175.29 172.83 3fw3 s LEU 218 N 1.19 2.59 0.52 2.90 1.02 -0.55 -4.56 118.68 121.78 3fw3 s LEU 218 Ca 0.03 -0.67 -0.21 0.00 0.02 0.00 0.00 54.13 53.29 3fw3 s LEU 218 Cb -0.14 -1.40 -0.06 0.00 0.02 0.00 0.00 46.19 44.61 3fw3 s LEU 218 CO 0.00 0.16 1.22 -2.28 0.02 0.00 0.00 176.35 175.47 3fw3 s HIS 219 N -1.30 2.60 0.24 0.29 5.65 -1.18 -0.63 115.29 120.96 3fw3 s HIS 219 Ca 0.18 1.49 -0.07 0.00 0.25 0.00 0.00 55.06 56.91 3fw3 s HIS 219 Cb -0.10 -3.50 0.40 0.00 -1.18 0.00 0.00 32.58 28.21 3fw3 s HIS 219 CO 0.10 -2.01 1.66 -0.09 -0.65 0.00 0.00 174.74 173.74 3fw3 h ARG 220 N 1.57 0.15 0.00 2.88 2.43 -1.92 -0.85 114.38 118.64 3fw3 h ARG 220 Ca -0.50 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.61 3fw3 h ARG 220 Cb 1.27 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3fw3 h ARG 220 CO 0.58 0.10 -0.26 1.05 -1.51 0.00 0.00 179.97 179.93 3fw3 h GLU 221 N 0.16 0.00 -0.70 0.20 9.09 -1.96 -1.04 114.58 120.33 3fw3 h GLU 221 Ca 0.39 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.77 3fw3 h GLU 221 Cb 0.66 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.73 3fw3 h GLU 221 CO -0.58 0.26 0.33 1.96 0.05 0.00 0.00 179.01 181.03 3fw3 h GLN 222 N 0.00 1.00 -0.22 1.06 4.20 -1.53 -1.41 115.11 118.22 3fw3 h GLN 222 Ca -0.00 -0.15 -0.11 0.00 0.06 0.00 0.00 58.65 58.45 3fw3 h GLN 222 Cb 0.47 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3fw3 h GLN 222 CO 0.03 0.79 -0.30 0.82 -0.67 0.00 0.00 178.83 179.51 3fw3 h ILE 223 N 0.97 1.33 0.00 2.54 2.04 -1.07 -3.07 117.51 120.24 3fw3 h ILE 223 Ca 0.24 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.56 3fw3 h ILE 223 Cb 0.12 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3fw3 h ILE 223 CO -0.03 0.46 -0.21 -0.07 0.00 0.00 0.00 178.15 178.31 3fw3 h LEU 224 N 0.27 0.00 -1.75 1.44 3.38 -1.21 -2.40 115.31 115.04 3fw3 h LEU 224 Ca 0.02 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.15 3fw3 h LEU 224 Cb 0.88 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 3fw3 h LEU 224 CO 0.07 0.21 0.46 0.00 0.09 0.00 0.00 178.44 179.27 3fw3 h ALA 225 N 1.79 2.27 -0.05 1.53 0.00 -1.15 -1.49 119.26 122.17 3fw3 h ALA 225 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3fw3 h ALA 225 Cb 0.47 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3fw3 h ALA 225 CO 0.03 -0.46 0.01 0.74 0.00 0.00 0.00 179.25 179.57 3fw3 h PHE 226 N 0.25 0.09 0.00 0.00 -1.00 -1.56 -1.24 116.94 113.48 3fw3 h PHE 226 Ca 0.33 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 61.02 3fw3 h PHE 226 Cb 0.92 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.45 3fw3 h PHE 226 CO -0.00 0.27 -0.36 0.66 -1.61 0.00 0.00 178.31 177.27 3fw3 h SER 227 N -0.12 0.00 0.80 2.17 4.64 -1.61 -2.66 113.55 116.76 3fw3 h SER 227 Ca 0.02 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.16 3fw3 h SER 227 Cb 0.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 3fw3 h SER 227 CO -0.00 0.36 -0.84 1.56 -0.87 0.00 0.00 176.83 177.04 3fw3 h GLN 227 N 0.00 0.03 0.00 4.77 4.20 -1.17 -3.38 115.11 119.55 3fw3 h GLN 227 Ca -0.00 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 3fw3 h GLN 227 Cb 1.13 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.89 3fw3 h GLN 227 CO 0.05 0.85 -1.97 1.63 -0.67 0.00 0.00 178.83 178.71 3fw3 n LYS 228 N -3.57 0.90 -4.15 1.46 5.02 -0.48 -5.01 118.16 112.32 3fw3 n LYS 228 Ca -0.01 -0.09 -0.29 0.00 -2.02 0.00 0.00 58.31 55.90 3fw3 n LYS 228 Cb 0.80 -1.43 -0.08 0.00 -0.02 0.00 0.00 35.03 34.30 3fw3 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3fw3 s LEU 229 N -4.71 3.42 0.09 -0.35 1.43 -1.01 -4.32 118.68 113.23 3fw3 s LEU 229 Ca -0.07 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 3fw3 s LEU 229 Cb 0.08 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 3fw3 s LEU 229 CO 0.71 0.14 -0.16 -0.31 0.23 0.00 0.00 176.35 176.96 3fw3 s TYR 230 N -1.47 1.44 0.13 0.29 1.51 -0.37 -1.18 117.35 117.69 3fw3 s TYR 230 Ca 0.26 -0.46 0.12 0.00 -1.01 0.00 0.00 57.07 55.99 3fw3 s TYR 230 Cb -0.11 -0.79 0.22 0.00 -0.11 0.00 0.00 41.96 41.17 3fw3 s TYR 230 CO 0.19 0.12 1.52 1.88 -1.11 0.00 0.00 175.55 178.14 3fw3 h TYR 231 N 4.12 0.00 -3.97 2.71 0.05 -1.42 -3.38 116.97 115.08 3fw3 h TYR 231 Ca -0.43 0.00 -0.69 0.00 0.05 0.00 0.00 58.73 57.67 3fw3 h TYR 231 Cb 1.19 0.00 -0.22 0.00 1.01 0.00 0.00 36.73 38.71 3fw3 h TYR 231 CO 0.63 0.65 -0.82 0.16 -1.05 0.00 0.00 178.16 177.72 3fw3 s ASP 232 N -6.64 3.66 0.53 3.88 -4.77 -1.26 -4.67 116.67 107.40 3fw3 s ASP 232 Ca 0.01 -0.52 0.30 0.00 -3.30 0.00 0.00 52.55 49.04 3fw3 s ASP 232 Cb 0.11 -0.50 1.45 0.00 -1.09 0.00 0.00 42.92 42.88 3fw3 s ASP 232 CO 0.76 0.23 1.90 0.50 0.70 0.00 0.00 175.17 179.26 3fw3 h LYS 233 N 4.35 0.03 -0.00 2.11 3.11 -1.90 -1.75 116.57 122.51 3fw3 h LYS 233 Ca -0.48 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.36 3fw3 h LYS 233 Cb 1.16 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.38 3fw3 h LYS 233 CO 0.46 0.02 -0.05 0.39 -2.81 0.00 0.00 179.45 177.45 3fw3 n GLU 236 N -4.30 0.26 -3.57 1.90 4.71 -1.26 -4.93 120.64 113.45 3fw3 n GLU 236 Ca 0.18 -0.03 -0.20 0.00 -0.01 0.00 0.00 57.16 57.10 3fw3 n GLU 236 Cb 0.90 -1.50 0.05 0.00 -1.01 0.00 0.00 31.44 29.89 3fw3 n GLU 236 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 3fw3 n GLN 237 N -1.35 -4.85 -0.00 3.49 6.02 -0.66 -4.93 117.38 115.10 3fw3 n GLN 237 Ca 0.11 0.70 0.01 0.00 -0.01 0.00 0.00 57.00 57.82 3fw3 n GLN 237 Cb 0.29 -5.38 -0.02 0.00 1.02 0.00 0.00 30.24 26.15 3fw3 n GLN 237 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3fw3 n THR 238 N -4.10 0.00 -3.97 5.09 -2.24 -1.26 -4.98 114.28 102.82 3fw3 n THR 238 Ca -0.26 -0.30 -0.31 0.00 -2.27 0.00 0.00 64.05 60.92 3fw3 n THR 238 Cb 0.66 0.79 -0.15 0.00 -2.10 0.00 0.00 70.33 69.53 3fw3 n THR 238 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3fw3 s VAL 239 N -1.62 1.66 0.33 2.28 1.01 -1.26 -5.09 120.40 117.72 3fw3 s VAL 239 Ca 0.00 -1.30 -0.29 0.00 0.00 0.00 0.00 61.98 60.39 3fw3 s VAL 239 Cb 0.02 -1.89 -0.12 0.00 0.00 0.00 0.00 36.38 34.39 3fw3 s VAL 239 CO 0.13 -0.08 1.45 -1.20 0.00 0.00 0.00 175.10 175.39 3fw3 n SER 240 N 4.62 3.40 -4.60 3.32 7.64 -1.26 -1.23 113.62 125.50 3fw3 n SER 240 Ca -0.12 1.20 -0.43 0.00 1.01 0.00 0.00 58.87 60.52 3fw3 n SER 240 Cb 0.44 -1.56 -0.02 0.00 -1.01 0.00 0.00 64.21 62.06 3fw3 n SER 240 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 3fw3 s MET 241 N -1.52 3.75 0.11 1.43 0.00 -0.32 -4.59 119.30 118.15 3fw3 s MET 241 Ca 0.58 0.61 -0.25 0.00 0.00 0.00 0.00 55.69 56.63 3fw3 s MET 241 Cb -0.52 -3.90 0.08 0.00 0.00 0.00 0.00 34.83 30.48 3fw3 s MET 241 CO 0.59 -1.35 0.80 -1.59 0.00 0.00 0.00 175.02 173.46 3fw3 s LYS 242 N 4.41 1.14 -1.50 4.11 -2.85 -1.26 -4.04 119.74 119.74 3fw3 s LYS 242 Ca 0.48 -0.50 -0.12 0.00 -1.00 0.00 0.00 55.97 54.83 3fw3 s LYS 242 Cb -0.08 0.47 0.07 0.00 -2.06 0.00 0.00 37.83 36.24 3fw3 s LYS 242 CO 0.31 -0.51 0.97 -0.25 0.10 0.00 0.00 175.35 175.97 3fw3 n ASP 243 N -0.35 -4.59 -3.64 0.03 8.00 0.12 -4.88 116.55 111.23 3fw3 n ASP 243 Ca -0.10 -0.77 -0.41 0.00 0.71 0.00 0.00 54.79 54.22 3fw3 n ASP 243 Cb 0.62 -3.98 -0.00 0.00 -0.02 0.00 0.00 41.12 37.74 3fw3 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3fw3 n ASN 244 N -2.87 6.74 -3.97 -2.24 6.94 -1.21 -4.68 115.26 113.97 3fw3 n ASN 244 Ca 0.01 -3.11 -0.24 0.00 -0.02 0.00 0.00 54.58 51.22 3fw3 n ASN 244 Cb 0.54 -1.42 -0.17 0.00 -2.36 0.00 0.00 39.78 36.37 3fw3 n ASN 244 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3fw3 s VAL 245 N -0.34 1.00 0.24 3.53 1.01 -1.26 -4.51 120.40 120.06 3fw3 s VAL 245 Ca 0.48 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.80 3fw3 s VAL 245 Cb 0.14 -0.96 -0.09 0.00 0.00 0.00 0.00 36.38 35.48 3fw3 s VAL 245 CO -0.05 0.34 0.98 -0.60 0.00 0.00 0.00 175.10 175.77 3fw3 s ARG 246 N 1.00 4.80 0.75 2.72 3.52 -1.26 -4.84 118.95 125.63 3fw3 s ARG 246 Ca -0.09 1.56 -0.15 0.00 -0.13 0.00 0.00 55.73 56.92 3fw3 s ARG 246 Cb -0.15 -3.27 0.05 0.00 -1.56 0.00 0.00 34.95 30.02 3fw3 s ARG 246 CO -0.00 0.42 1.22 -2.14 -0.81 0.00 0.00 175.30 173.99 3fw3 s PRO 247 N -1.12 1.98 0.45 5.12 0.02 -1.26 -4.78 135.00 135.42 3fw3 s PRO 247 Ca 0.42 1.80 -0.25 0.00 0.02 0.00 0.00 61.00 62.99 3fw3 s PRO 247 Cb -0.27 -1.81 -0.08 0.00 0.02 0.00 0.00 34.50 32.36 3fw3 s PRO 247 CO 0.34 -1.96 1.43 -0.51 -0.33 0.00 0.00 177.00 175.96 3fw3 s LEU 248 N -5.27 4.11 0.26 -5.54 1.43 -1.26 -4.48 118.68 107.92 3fw3 s LEU 248 Ca 0.75 2.93 0.09 0.00 -1.03 0.00 0.00 54.13 56.87 3fw3 s LEU 248 Cb -0.30 -3.94 -0.04 0.00 0.03 0.00 0.00 46.19 41.94 3fw3 s LEU 248 CO 0.47 -1.19 0.03 -1.10 0.23 0.00 0.00 176.35 174.79 3fw3 s GLN 249 N -2.46 2.42 0.12 1.70 -1.52 0.37 -4.99 119.66 115.30 3fw3 s GLN 249 Ca 0.61 -1.33 -0.30 0.00 -1.95 0.00 0.00 55.36 52.39 3fw3 s GLN 249 Cb -0.44 -2.25 -0.06 0.00 -0.22 0.00 0.00 33.01 30.04 3fw3 s GLN 249 CO 0.56 0.38 0.98 -0.65 -0.25 0.00 0.00 175.29 176.31 3fw3 s GLN 250 N -3.65 4.69 0.18 2.91 -1.52 -1.26 -4.56 119.66 116.45 3fw3 s GLN 250 Ca 0.31 1.49 -0.09 0.00 -1.95 0.00 0.00 55.36 55.12 3fw3 s GLN 250 Cb -0.07 -3.36 0.07 0.00 -0.22 0.00 0.00 33.01 29.43 3fw3 s GLN 250 CO 0.21 0.20 1.65 1.25 -0.25 0.00 0.00 175.29 178.35 3fw3 h LEU 251 N 5.49 1.07 0.00 2.90 5.85 -1.92 -3.43 115.31 125.27 3fw3 h LEU 251 Ca -0.43 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 57.99 3fw3 h LEU 251 Cb 1.21 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.95 3fw3 h LEU 251 CO 0.72 1.10 0.00 0.61 -0.34 0.00 0.00 178.44 180.53 3fw3 n GLY 252 N -0.45 2.45 0.00 3.75 0.00 -1.26 -3.02 105.19 106.65 3fw3 n GLY 252 Ca 0.03 -0.35 0.14 0.00 0.00 0.00 0.00 46.02 45.84 3fw3 n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fw3 n GLN 253 N 13.35 0.21 -1.83 1.61 1.13 -1.26 -4.91 117.38 125.68 3fw3 n GLN 253 Ca 0.00 0.01 -0.32 0.00 -1.94 0.00 0.00 57.00 54.75 3fw3 n GLN 253 Cb 0.00 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 28.88 3fw3 n GLN 253 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3fw3 s ARG 254 N -2.79 3.20 0.08 -1.09 0.52 -1.17 -5.06 118.95 112.64 3fw3 s ARG 254 Ca 0.21 1.03 0.09 0.00 -0.52 0.00 0.00 55.73 56.53 3fw3 s ARG 254 Cb 0.19 -2.02 -0.03 0.00 0.52 0.00 0.00 34.95 33.61 3fw3 s ARG 254 CO 0.49 -0.89 -0.21 0.95 0.02 0.00 0.00 175.30 175.66 3fw3 s THR 255 N -2.81 2.62 -0.15 0.02 -4.23 -1.26 -5.04 115.64 104.80 3fw3 s THR 255 Ca 0.60 -1.39 -0.07 0.00 -1.18 0.00 0.00 61.69 59.64 3fw3 s THR 255 Cb -0.14 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 3fw3 s THR 255 CO 0.46 0.24 0.11 -0.69 -0.54 0.00 0.00 174.62 174.20 3fw3 s VAL 256 N -0.99 5.24 0.34 2.29 1.01 -1.26 -4.70 120.40 122.34 3fw3 s VAL 256 Ca 0.15 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.34 3fw3 s VAL 256 Cb -0.10 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 32.90 3fw3 s VAL 256 CO 0.06 0.55 0.01 0.27 0.00 0.00 0.00 175.10 175.98 3fw3 s ILE 257 N -0.42 2.56 0.04 2.22 -4.36 -0.33 -2.37 121.20 118.53 3fw3 s ILE 257 Ca 0.11 -1.99 -0.04 0.00 -0.26 0.00 0.00 60.65 58.48 3fw3 s ILE 257 Cb -0.12 -2.79 -0.02 0.00 1.25 0.00 0.00 42.46 40.78 3fw3 s ILE 257 CO 0.02 -0.19 0.05 -1.59 0.24 0.00 0.00 174.94 173.47 3fw3 s LYS 258 N -3.71 0.55 0.00 0.37 -2.85 -0.37 -0.90 119.74 112.83 3fw3 s LYS 258 Ca 0.35 -0.83 0.30 0.00 -1.00 0.00 0.00 55.97 54.78 3fw3 s LYS 258 Cb 0.01 0.21 1.41 0.00 -2.06 0.00 0.00 37.83 37.39 3fw3 s LYS 258 CO 0.19 -0.12 1.95 -1.13 0.10 0.00 0.00 175.35 176.33