#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g3b n PRO 3 N 3.05 1.77 -0.21 0.00 -0.02 -1.26 -4.93 135.00 133.41 3g3b n PRO 3 Ca -0.11 0.64 -0.02 0.00 -2.02 0.00 0.00 63.50 61.99 3g3b n PRO 3 Cb 0.52 -2.42 0.18 0.00 -0.02 0.00 0.00 33.50 31.76 3g3b n PRO 3 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3g3b h SER 4 N 1.76 0.90 0.25 2.55 0.02 -1.98 0.26 113.55 117.31 3g3b h SER 4 Ca -0.49 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 3g3b h SER 4 Cb 1.30 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.61 3g3b h SER 4 CO 0.58 0.76 0.00 0.00 -1.14 0.00 0.00 176.83 177.04 3g3b n GLN 5 N -4.33 0.68 -4.97 3.45 3.00 -1.26 -4.87 117.38 109.08 3g3b n GLN 5 Ca 0.07 0.01 -0.27 0.00 -0.01 0.00 0.00 57.00 56.80 3g3b n GLN 5 Cb 0.14 -1.50 -0.15 0.00 0.00 0.00 0.00 30.24 28.72 3g3b n GLN 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3g3b s SER 7 N -0.57 7.13 -0.20 0.00 0.01 -1.16 -4.59 113.70 114.32 3g3b s SER 7 Ca 0.08 1.52 -0.04 0.00 1.31 0.00 0.00 55.95 58.81 3g3b s SER 7 Cb -0.08 -2.46 0.08 0.00 0.21 0.00 0.00 66.02 63.78 3g3b s SER 7 CO -0.00 0.02 0.17 0.00 0.41 0.00 0.00 173.24 173.84 3g3b s SER 9 N 2.24 5.14 1.87 0.00 0.15 -0.68 -4.98 113.70 117.44 3g3b s SER 9 Ca 0.05 -1.18 0.00 0.00 0.70 0.00 0.00 55.95 55.52 3g3b s SER 9 Cb -0.16 -1.81 0.00 0.00 -1.71 0.00 0.00 66.02 62.34 3g3b s SER 9 CO -0.13 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.62 3g3b n GLY 10 N 4.74 4.09 1.15 9.45 0.00 -1.26 -1.78 105.19 121.57 3g3b n GLY 10 Ca -0.13 0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.10 3g3b n GLY 10 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g3b n THR 11 N 0.00 0.79 -3.51 2.61 -2.24 -1.26 -4.87 114.28 105.80 3g3b n THR 11 Ca 0.00 -0.82 -0.37 0.00 -2.27 0.00 0.00 64.05 60.59 3g3b n THR 11 Cb 0.00 0.48 -0.07 0.00 -2.10 0.00 0.00 70.33 68.64 3g3b n THR 11 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3g3b s THR 12 N -1.21 5.29 -0.14 4.28 2.01 -0.74 -0.82 115.64 124.31 3g3b s THR 12 Ca 0.42 0.60 0.02 0.00 0.31 0.00 0.00 61.69 63.04 3g3b s THR 12 Cb 0.22 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 69.08 3g3b s THR 12 CO 0.29 0.38 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.71 3g3b s VAL 13 N 0.46 2.20 -0.34 3.82 1.01 -0.35 -1.69 120.40 125.51 3g3b s VAL 13 Ca 0.18 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.25 3g3b s VAL 13 Cb -0.13 -1.89 0.09 0.00 0.00 0.00 0.00 36.38 34.45 3g3b s VAL 13 CO 0.05 0.54 0.06 -0.62 0.00 0.00 0.00 175.10 175.13 3g3b s ASP 14 N 0.83 4.84 -0.17 3.32 -1.08 -0.21 -1.80 116.67 122.40 3g3b s ASP 14 Ca -0.06 -1.98 0.16 0.00 -0.52 0.00 0.00 52.55 50.15 3g3b s ASP 14 Cb -0.15 -1.67 0.57 0.00 -1.46 0.00 0.00 42.92 40.20 3g3b s ASP 14 CO -0.02 -0.38 1.47 0.00 0.52 0.00 0.00 175.17 176.76 3g3b s SER 16 N -1.68 5.82 -1.52 0.00 1.04 -1.16 -4.07 113.70 112.14 3g3b s SER 16 Ca 0.43 2.06 -0.05 0.00 0.48 0.00 0.00 55.95 58.87 3g3b s SER 16 Cb 0.34 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.90 3g3b s SER 16 CO 0.11 -1.14 0.61 0.61 0.98 0.00 0.00 173.24 174.40 3g3b n GLY 17 N -0.13 -0.49 0.82 7.32 0.00 -0.56 -4.89 105.19 107.26 3g3b n GLY 17 Ca 0.11 0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.29 3g3b n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g3b n LYS 18 N -3.96 1.15 -0.74 1.61 5.02 -1.25 -4.98 118.16 115.00 3g3b n LYS 18 Ca -0.11 -2.92 -0.03 0.00 -2.02 0.00 0.00 58.31 53.23 3g3b n LYS 18 Cb 0.62 -1.18 -0.01 0.00 -0.02 0.00 0.00 35.03 34.43 3g3b n LYS 18 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3g3b n SER 19 N -0.70 -3.27 -4.58 4.39 7.64 -1.26 -4.90 113.62 110.94 3g3b n SER 19 Ca 0.15 0.07 -0.42 0.00 1.01 0.00 0.00 58.87 59.69 3g3b n SER 19 Cb 0.81 -2.35 0.01 0.00 -1.01 0.00 0.00 64.21 61.67 3g3b n SER 19 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3g3b n LEU 20 N -0.42 2.10 -0.00 -3.43 4.77 -1.26 -4.59 117.00 114.16 3g3b n LEU 20 Ca -0.03 1.01 0.04 0.00 -0.03 0.00 0.00 56.01 57.01 3g3b n LEU 20 Cb 0.30 -1.30 -0.06 0.00 -2.33 0.00 0.00 43.42 40.02 3g3b n LEU 20 CO 0.04 -1.76 -0.58 0.00 -1.33 0.00 0.00 177.39 173.77 3g3b n ALA 21 N -0.56 2.34 -2.50 -1.18 0.00 -1.26 0.32 120.51 117.68 3g3b n ALA 21 Ca 0.10 -0.20 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 3g3b n ALA 21 Cb 0.39 -0.29 -0.08 0.00 0.00 0.00 0.00 19.45 19.47 3g3b n ALA 21 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3g3b s SER 22 N -2.92 0.12 -0.09 0.00 1.04 -1.26 -3.95 113.70 106.64 3g3b s SER 22 Ca -0.03 -1.09 -0.30 0.00 0.48 0.00 0.00 55.95 55.02 3g3b s SER 22 Cb 0.05 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 3g3b s SER 22 CO 0.35 -0.87 1.21 -0.69 0.98 0.00 0.00 173.24 174.23 3g3b s VAL 23 N -4.04 4.27 0.44 5.02 1.01 -1.26 -4.95 120.40 120.89 3g3b s VAL 23 Ca 0.25 1.58 -0.22 0.00 0.00 0.00 0.00 61.98 63.58 3g3b s VAL 23 Cb 0.05 -4.02 -0.12 0.00 0.00 0.00 0.00 36.38 32.30 3g3b s VAL 23 CO 0.04 -0.04 0.66 -2.65 0.00 0.00 0.00 175.10 173.11 3g3b n PRO 24 N 5.60 0.74 -2.28 2.72 -0.02 -1.26 -4.97 135.00 135.53 3g3b n PRO 24 Ca 0.12 0.27 -0.31 0.00 -2.02 0.00 0.00 63.50 61.56 3g3b n PRO 24 Cb 0.46 -1.65 -0.01 0.00 -0.02 0.00 0.00 33.50 32.27 3g3b n PRO 24 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3g3b s THR 25 N -1.44 4.69 0.00 3.45 -1.32 -1.26 -4.48 115.64 115.28 3g3b s THR 25 Ca 0.64 0.85 0.00 0.00 -1.21 0.00 0.00 61.69 61.97 3g3b s THR 25 Cb -0.58 -3.80 0.00 0.00 -1.51 0.00 0.00 72.50 66.61 3g3b s THR 25 CO 0.57 -0.88 0.00 0.61 -2.21 0.00 0.00 174.62 172.71 3g3b n GLY 26 N -2.11 0.42 3.67 6.08 0.00 -1.26 -4.68 105.19 107.30 3g3b n GLY 26 Ca 0.05 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 3g3b n GLY 26 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3g3b n ILE 27 N -2.98 0.64 -1.75 -0.61 2.08 -1.26 -4.34 119.36 111.13 3g3b n ILE 27 Ca 0.00 -0.11 -0.38 0.00 0.56 0.00 0.00 62.75 62.82 3g3b n ILE 27 Cb 0.00 -2.24 0.05 0.00 -0.75 0.00 0.00 39.64 36.70 3g3b n ILE 27 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 3g3b s PRO 28 N 3.89 2.89 0.00 0.38 0.02 -1.26 -4.87 135.00 136.06 3g3b s PRO 28 Ca 0.87 2.19 0.22 0.00 0.02 0.00 0.00 61.00 64.30 3g3b s PRO 28 Cb -0.46 -2.10 1.25 0.00 0.02 0.00 0.00 34.50 33.22 3g3b s PRO 28 CO 0.41 -1.37 1.71 0.25 -0.33 0.00 0.00 177.00 177.67 3g3b n THR 29 N -1.38 0.12 0.45 0.99 -2.24 -1.26 -2.34 114.28 108.61 3g3b n THR 29 Ca 0.13 0.03 0.05 0.00 -2.27 0.00 0.00 64.05 61.99 3g3b n THR 29 Cb 0.46 -0.68 0.03 0.00 -2.10 0.00 0.00 70.33 68.05 3g3b n THR 29 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3g3b n THR 30 N -1.10 0.00 -1.51 4.28 -2.24 -1.26 -4.39 114.28 108.06 3g3b n THR 30 Ca 0.15 -0.47 -0.46 0.00 -2.27 0.00 0.00 64.05 60.99 3g3b n THR 30 Cb 0.11 1.20 -0.02 0.00 -2.10 0.00 0.00 70.33 69.51 3g3b n THR 30 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3g3b n THR 31 N 0.37 1.99 -0.00 4.28 -1.04 -0.99 -4.88 114.28 114.01 3g3b n THR 31 Ca 0.06 -0.50 -0.00 0.00 -2.04 0.00 0.00 64.05 61.56 3g3b n THR 31 Cb 0.25 -0.56 -0.00 0.00 -1.82 0.00 0.00 70.33 68.20 3g3b n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3g3b n GLN 32 N 0.84 3.22 -5.19 -2.82 6.02 0.00 -3.08 117.38 116.37 3g3b n GLN 32 Ca 0.13 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.80 3g3b n GLN 32 Cb 0.29 -1.02 -0.16 0.00 1.02 0.00 0.00 30.24 30.37 3g3b n GLN 32 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3g3b s VAL 33 N -2.02 2.17 -0.17 5.09 1.01 -1.11 -0.12 120.40 125.26 3g3b s VAL 33 Ca -0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 3g3b s VAL 33 Cb 0.00 -1.82 0.06 0.00 0.00 0.00 0.00 36.38 34.62 3g3b s VAL 33 CO 0.02 0.56 0.06 -0.22 0.00 0.00 0.00 175.10 175.53 3g3b s LEU 34 N 0.09 0.68 -0.27 3.92 2.96 -0.48 -1.21 118.68 124.36 3g3b s LEU 34 Ca -0.11 -0.62 -0.11 0.00 -0.22 0.00 0.00 54.13 53.07 3g3b s LEU 34 Cb -0.16 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.09 3g3b s LEU 34 CO 0.06 -0.32 0.18 -0.31 -1.32 0.00 0.00 176.35 174.65 3g3b s TYR 35 N 2.02 3.23 -0.02 5.38 2.02 -0.75 -1.21 117.35 128.02 3g3b s TYR 35 Ca 0.01 0.13 0.03 0.00 -0.37 0.00 0.00 57.07 56.87 3g3b s TYR 35 Cb -0.16 -2.36 0.05 0.00 -0.40 0.00 0.00 41.96 39.08 3g3b s TYR 35 CO -0.08 -0.13 0.85 1.28 -1.57 0.00 0.00 175.55 175.91 3g3b n LEU 36 N 4.94 0.67 -4.84 -1.29 4.77 -0.38 -0.21 117.00 120.65 3g3b n LEU 36 Ca -0.14 -1.14 -0.31 0.00 -0.03 0.00 0.00 56.01 54.39 3g3b n LEU 36 Cb 0.52 -0.07 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 3g3b n LEU 36 CO 0.33 0.27 0.71 -0.72 -1.33 0.00 0.00 177.39 176.66 3g3b s TYR 37 N -0.60 3.37 -1.02 -1.77 -0.85 -1.16 -4.29 117.35 111.03 3g3b s TYR 37 Ca 0.05 1.39 -0.06 0.00 -0.52 0.00 0.00 57.07 57.93 3g3b s TYR 37 Cb 0.04 -2.81 -0.07 0.00 0.38 0.00 0.00 41.96 39.50 3g3b s TYR 37 CO 0.00 -0.82 0.89 -3.47 -1.52 0.00 0.00 175.55 170.63 3g3b n ASP 38 N -2.52 -6.38 -0.16 -0.18 2.03 -0.72 -2.27 116.55 106.35 3g3b n ASP 38 Ca 0.07 -0.68 0.00 0.00 0.52 0.00 0.00 54.79 54.70 3g3b n ASP 38 Cb 0.54 -5.05 0.00 0.00 -0.72 0.00 0.00 41.12 35.88 3g3b n ASP 38 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3g3b n ASN 39 N -3.17 0.12 -2.45 1.67 5.03 -0.95 -1.49 115.26 114.03 3g3b n ASN 39 Ca -0.07 -0.15 -0.16 0.00 0.87 0.00 0.00 54.58 55.07 3g3b n ASN 39 Cb 0.62 0.00 0.02 0.00 -1.02 0.00 0.00 39.78 39.40 3g3b n ASN 39 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3g3b n ARG 40 N 0.00 2.66 -2.52 3.52 1.74 0.15 -4.38 116.66 117.83 3g3b n ARG 40 Ca 0.00 -3.92 -0.42 0.00 -0.77 0.00 0.00 57.85 52.74 3g3b n ARG 40 Cb 0.00 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 29.49 3g3b n ARG 40 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g3b s ILE 41 N -4.36 4.31 -0.09 0.55 1.01 -1.18 -4.24 121.20 117.20 3g3b s ILE 41 Ca 0.40 1.66 0.06 0.00 0.00 0.00 0.00 60.65 62.77 3g3b s ILE 41 Cb 0.39 -4.06 -0.09 0.00 0.01 0.00 0.00 42.46 38.71 3g3b s ILE 41 CO -0.03 0.13 0.17 0.35 0.00 0.00 0.00 174.94 175.56 3g3b n THR 42 N 3.89 0.00 -3.76 2.92 -2.24 -1.25 0.30 114.28 114.13 3g3b n THR 42 Ca 0.08 -0.20 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 3g3b n THR 42 Cb 0.48 0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 69.19 3g3b n THR 42 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3g3b s LYS 43 N -2.20 1.14 -0.03 -0.78 -2.85 -1.26 -4.02 119.74 109.74 3g3b s LYS 43 Ca -0.01 -0.88 0.05 0.00 -1.00 0.00 0.00 55.97 54.13 3g3b s LYS 43 Cb 0.04 0.45 -0.01 0.00 -2.06 0.00 0.00 37.83 36.25 3g3b s LYS 43 CO 0.26 -0.45 -0.17 -0.51 0.10 0.00 0.00 175.35 174.58 3g3b s LEU 44 N -2.86 1.95 0.25 2.77 1.43 -1.26 -4.76 118.68 116.20 3g3b s LEU 44 Ca 0.08 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 3g3b s LEU 44 Cb 0.02 -0.95 -0.09 0.00 0.03 0.00 0.00 46.19 45.19 3g3b s LEU 44 CO -0.07 0.17 1.27 -1.61 0.23 0.00 0.00 176.35 176.34 3g3b s GLU 45 N -0.10 4.43 0.19 1.70 0.41 -1.26 -4.58 118.70 119.49 3g3b s GLU 45 Ca -0.01 2.05 -0.31 0.00 -0.41 0.00 0.00 54.97 56.29 3g3b s GLU 45 Cb -0.10 -3.16 -0.16 0.00 -1.78 0.00 0.00 34.13 28.93 3g3b s GLU 45 CO 0.01 -0.14 0.93 -2.30 -0.49 0.00 0.00 175.26 173.27 3g3b n PRO 46 N 1.82 0.74 -0.93 0.39 -0.02 -1.26 -1.32 135.00 134.42 3g3b n PRO 46 Ca 0.03 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 3g3b n PRO 46 Cb 0.43 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 3g3b n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g3b n GLY 47 N 1.77 0.69 0.42 -1.23 0.00 -1.26 -4.89 105.19 100.69 3g3b n GLY 47 Ca 0.15 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.40 3g3b n GLY 47 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3g3b h VAL 48 N 0.00 0.59 -0.01 1.61 3.04 -1.54 -2.31 116.25 117.63 3g3b h VAL 48 Ca 0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 3g3b h VAL 48 Cb 0.06 0.26 0.00 0.00 -2.01 0.00 0.00 31.29 29.59 3g3b h VAL 48 CO 0.00 0.06 -0.47 0.49 -1.01 0.00 0.00 177.57 176.64 3g3b n PHE 49 N -4.48 0.00 -0.17 3.17 3.72 -1.26 -4.69 117.46 113.75 3g3b n PHE 49 Ca 0.21 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.85 3g3b n PHE 49 Cb 0.83 0.00 0.64 0.00 -0.94 0.00 0.00 39.48 40.01 3g3b n PHE 49 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3g3b h ASP 50 N 1.75 0.15 0.16 4.37 5.19 -1.68 0.76 116.42 127.12 3g3b h ASP 50 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3g3b h ASP 50 Cb 0.60 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.10 3g3b h ASP 50 CO 0.00 0.06 -0.41 -2.11 -3.12 0.00 0.00 179.24 173.67 3g3b n ARG 51 N -4.38 0.82 -2.41 3.56 1.85 -1.26 -4.52 116.66 110.32 3g3b n ARG 51 Ca 0.17 -0.58 -0.41 0.00 -1.00 0.00 0.00 57.85 56.03 3g3b n ARG 51 Cb 0.79 -1.49 0.01 0.00 -1.05 0.00 0.00 32.46 30.72 3g3b n ARG 51 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 3g3b n LEU 52 N -0.59 7.50 0.10 2.89 4.77 0.26 -4.76 117.00 127.17 3g3b n LEU 52 Ca 0.10 -5.14 0.13 0.00 -0.03 0.00 0.00 56.01 51.07 3g3b n LEU 52 Cb 0.38 -1.27 0.45 0.00 -2.33 0.00 0.00 43.42 40.65 3g3b n LEU 52 CO 0.29 1.98 0.88 0.35 -1.33 0.00 0.00 177.39 179.56 3g3b n THR 53 N 0.96 0.61 1.40 -5.08 -2.24 -1.26 -3.01 114.28 105.65 3g3b n THR 53 Ca 0.50 -0.09 0.14 0.00 -2.27 0.00 0.00 64.05 62.33 3g3b n THR 53 Cb 0.27 -0.75 0.49 0.00 -2.10 0.00 0.00 70.33 68.23 3g3b n THR 53 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g3b n GLN 54 N -2.14 1.22 -1.67 -0.78 1.13 -1.26 -4.39 117.38 109.48 3g3b n GLN 54 Ca 0.05 -0.68 -0.45 0.00 -1.94 0.00 0.00 57.00 53.98 3g3b n GLN 54 Cb 0.36 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.19 3g3b n GLN 54 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3g3b n LEU 55 N -0.30 3.17 -0.01 1.08 4.77 -1.16 -4.36 117.00 120.18 3g3b n LEU 55 Ca 0.16 1.12 0.00 0.00 -0.03 0.00 0.00 56.01 57.26 3g3b n LEU 55 Cb 0.34 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 39.96 3g3b n LEU 55 CO 0.21 -0.37 -0.58 0.35 -1.33 0.00 0.00 177.39 175.67 3g3b n THR 56 N 2.53 0.13 -3.75 -5.08 -2.24 0.83 -2.38 114.28 104.32 3g3b n THR 56 Ca 0.14 -0.12 -0.15 0.00 -2.27 0.00 0.00 64.05 61.64 3g3b n THR 56 Cb 0.31 -0.26 -0.16 0.00 -2.10 0.00 0.00 70.33 68.12 3g3b n THR 56 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3g3b s ARG 57 N -2.18 -0.02 -0.15 -0.78 3.52 -0.92 -0.09 118.95 118.33 3g3b s ARG 57 Ca -0.02 0.27 -0.02 0.00 -0.13 0.00 0.00 55.73 55.83 3g3b s ARG 57 Cb 0.02 -0.27 0.05 0.00 -1.56 0.00 0.00 34.95 33.18 3g3b s ARG 57 CO 0.15 -0.20 0.02 -1.17 -0.81 0.00 0.00 175.30 173.30 3g3b s LEU 58 N 1.31 0.97 -0.34 -0.88 2.96 -0.63 -1.39 118.68 120.69 3g3b s LEU 58 Ca -0.06 -0.57 -0.11 0.00 -0.22 0.00 0.00 54.13 53.17 3g3b s LEU 58 Cb -0.13 -0.55 -0.00 0.00 0.50 0.00 0.00 46.19 46.02 3g3b s LEU 58 CO -0.04 -0.26 0.20 -1.81 -1.32 0.00 0.00 176.35 173.11 3g3b s ASP 59 N 1.90 5.75 -0.03 3.68 1.11 -0.35 -2.26 116.67 126.47 3g3b s ASP 59 Ca 0.01 -0.62 0.07 0.00 0.18 0.00 0.00 52.55 52.19 3g3b s ASP 59 Cb -0.15 -2.05 0.16 0.00 1.07 0.00 0.00 42.92 41.95 3g3b s ASP 59 CO -0.07 -0.26 1.12 0.18 1.18 0.00 0.00 175.17 177.32 3g3b n LEU 60 N 5.03 2.43 -4.87 1.23 4.77 -0.21 -1.25 117.00 124.12 3g3b n LEU 60 Ca -0.13 -2.24 -0.31 0.00 -0.03 0.00 0.00 56.01 53.30 3g3b n LEU 60 Cb 0.48 -0.16 0.02 0.00 -2.33 0.00 0.00 43.42 41.43 3g3b n LEU 60 CO 0.36 0.60 0.73 1.51 -1.33 0.00 0.00 177.39 179.26 3g3b s ASP 61 N -1.35 5.92 -1.30 -1.43 1.47 -1.19 -4.12 116.67 114.66 3g3b s ASP 61 Ca 0.14 1.33 -0.04 0.00 1.18 0.00 0.00 52.55 55.16 3g3b s ASP 61 Cb 0.10 -2.29 0.01 0.00 -0.34 0.00 0.00 42.92 40.40 3g3b s ASP 61 CO 0.05 -1.06 0.98 0.59 0.68 0.00 0.00 175.17 176.41 3g3b n ASN 62 N -2.86 -3.21 0.00 2.11 3.02 -0.62 -1.82 115.26 111.89 3g3b n ASN 62 Ca 0.06 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.95 3g3b n ASN 62 Cb 0.55 -4.73 0.00 0.00 -0.61 0.00 0.00 39.78 34.99 3g3b n ASN 62 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3g3b n ASN 63 N -3.05 0.00 -2.48 6.41 4.13 -1.17 -1.75 115.26 117.34 3g3b n ASN 63 Ca -0.18 0.00 -0.06 0.00 1.68 0.00 0.00 54.58 56.02 3g3b n ASN 63 Cb 0.63 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 38.91 3g3b n ASN 63 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3g3b n GLN 64 N 0.00 2.10 -2.53 3.52 6.02 0.15 -4.59 117.38 122.04 3g3b n GLN 64 Ca 0.00 -3.58 -0.38 0.00 -0.01 0.00 0.00 57.00 53.03 3g3b n GLN 64 Cb 0.00 -1.68 -0.04 0.00 1.02 0.00 0.00 30.24 29.54 3g3b n GLN 64 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3g3b s LEU 65 N -3.49 4.34 -0.02 1.08 1.43 -1.21 -4.53 118.68 116.28 3g3b s LEU 65 Ca 0.34 2.13 0.09 0.00 -1.03 0.00 0.00 54.13 55.65 3g3b s LEU 65 Cb 0.35 -3.92 -0.13 0.00 0.03 0.00 0.00 46.19 42.52 3g3b s LEU 65 CO -0.03 -0.31 0.17 0.35 0.23 0.00 0.00 176.35 176.77 3g3b n THR 66 N 0.54 0.06 -3.52 5.49 -2.24 -1.26 0.43 114.28 113.78 3g3b n THR 66 Ca 0.02 -0.21 -0.15 0.00 -2.27 0.00 0.00 64.05 61.43 3g3b n THR 66 Cb 0.47 0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.84 3g3b n THR 66 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3g3b s VAL 67 N -2.56 0.01 -0.02 2.28 0.11 -1.26 -3.94 120.40 115.01 3g3b s VAL 67 Ca -0.03 -0.08 0.04 0.00 -2.93 0.00 0.00 61.98 58.98 3g3b s VAL 67 Cb 0.05 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 3g3b s VAL 67 CO 0.36 -0.05 -0.14 -0.76 -3.33 0.00 0.00 175.10 171.19 3g3b s LEU 68 N -1.78 2.79 0.57 2.54 1.43 -1.26 -4.77 118.68 118.19 3g3b s LEU 68 Ca -0.07 -0.24 -0.21 0.00 -1.03 0.00 0.00 54.13 52.59 3g3b s LEU 68 Cb -0.01 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 3g3b s LEU 68 CO 0.01 0.31 1.32 -2.16 0.23 0.00 0.00 176.35 176.07 3g3b s PRO 69 N -1.03 3.04 0.27 1.29 0.04 -1.26 -4.79 135.00 132.55 3g3b s PRO 69 Ca 0.13 2.15 -0.30 0.00 0.04 0.00 0.00 61.00 63.02 3g3b s PRO 69 Cb -0.11 -2.16 -0.10 0.00 0.04 0.00 0.00 34.50 32.18 3g3b s PRO 69 CO 0.03 -1.24 1.34 0.00 0.04 0.00 0.00 177.00 177.17 3g3b s ALA 70 N -1.35 3.54 0.00 8.56 0.00 -1.26 -3.10 121.76 128.15 3g3b s ALA 70 Ca 0.74 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.92 3g3b s ALA 70 Cb -0.38 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.24 3g3b s ALA 70 CO 0.44 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.99 3g3b n GLY 71 N 1.66 1.30 0.37 0.00 0.00 -1.26 -4.87 105.19 102.39 3g3b n GLY 71 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.21 3g3b n GLY 71 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3g3b h VAL 72 N 0.00 0.81 -0.41 1.61 3.04 -1.89 -0.84 116.25 118.57 3g3b h VAL 72 Ca 0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 3g3b h VAL 72 Cb 0.00 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 3g3b h VAL 72 CO 0.00 0.05 0.00 0.49 -1.01 0.00 0.00 177.57 177.10 3g3b n PHE 73 N -4.44 0.75 0.19 3.17 3.72 -1.26 -4.48 117.46 115.11 3g3b n PHE 73 Ca 0.11 -0.59 0.04 0.00 -0.05 0.00 0.00 57.45 56.96 3g3b n PHE 73 Cb 0.50 -0.11 0.36 0.00 -0.94 0.00 0.00 39.48 39.29 3g3b n PHE 73 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3g3b h ASP 74 N 2.50 0.00 0.75 4.37 5.19 -1.40 -2.62 116.42 125.21 3g3b h ASP 74 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3g3b h ASP 74 Cb 1.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.51 3g3b h ASP 74 CO 0.08 0.38 -0.41 0.29 -3.12 0.00 0.00 179.24 176.46 3g3b n LYS 75 N -3.76 0.09 -1.46 3.56 4.01 -1.26 -4.68 118.16 114.66 3g3b n LYS 75 Ca -0.01 0.04 -0.36 0.00 -0.51 0.00 0.00 58.31 57.47 3g3b n LYS 75 Cb 0.46 -1.57 -0.04 0.00 -0.51 0.00 0.00 35.03 33.38 3g3b n LYS 75 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3g3b n LEU 76 N -1.71 8.10 0.07 -0.35 4.77 -0.99 -4.69 117.00 122.20 3g3b n LEU 76 Ca 0.05 -4.36 0.09 0.00 -0.03 0.00 0.00 56.01 51.76 3g3b n LEU 76 Cb 0.37 -1.48 0.40 0.00 -2.33 0.00 0.00 43.42 40.38 3g3b n LEU 76 CO 0.34 2.02 0.79 0.35 -1.33 0.00 0.00 177.39 179.55 3g3b n THR 77 N 2.84 0.94 0.12 -5.08 -2.24 -1.26 -2.63 114.28 106.98 3g3b n THR 77 Ca 0.69 0.26 0.08 0.00 -2.27 0.00 0.00 64.05 62.82 3g3b n THR 77 Cb 0.32 -1.11 0.17 0.00 -2.10 0.00 0.00 70.33 67.61 3g3b n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g3b n GLN 78 N -1.88 2.22 -2.48 -0.78 6.02 -1.26 -3.64 117.38 115.58 3g3b n GLN 78 Ca 0.03 -2.00 -0.43 0.00 -0.01 0.00 0.00 57.00 54.59 3g3b n GLN 78 Cb 0.19 -1.37 -0.02 0.00 1.02 0.00 0.00 30.24 30.05 3g3b n GLN 78 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3g3b s LEU 79 N -1.16 4.21 -0.16 1.08 2.96 -1.00 -4.22 118.68 120.39 3g3b s LEU 79 Ca 0.29 1.69 0.10 0.00 -0.22 0.00 0.00 54.13 55.99 3g3b s LEU 79 Cb 0.17 -3.55 -0.17 0.00 0.50 0.00 0.00 46.19 43.14 3g3b s LEU 79 CO 0.23 -0.66 -0.00 0.35 -1.32 0.00 0.00 176.35 174.94 3g3b n THR 80 N 5.01 1.05 -5.00 3.68 -2.24 0.87 -2.04 114.28 115.61 3g3b n THR 80 Ca 0.12 -0.58 -0.29 0.00 -2.27 0.00 0.00 64.05 61.03 3g3b n THR 80 Cb 0.46 -0.75 -0.16 0.00 -2.10 0.00 0.00 70.33 67.78 3g3b n THR 80 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3g3b s GLN 81 N -2.37 2.24 -0.14 -0.78 -0.21 -0.34 -0.32 119.66 117.74 3g3b s GLN 81 Ca -0.12 -0.72 -0.04 0.00 0.02 0.00 0.00 55.36 54.50 3g3b s GLN 81 Cb 0.05 -1.85 0.05 0.00 1.00 0.00 0.00 33.01 32.27 3g3b s GLN 81 CO 0.57 0.24 0.09 -1.17 -2.12 0.00 0.00 175.29 172.90 3g3b s LEU 82 N 0.13 0.25 -0.17 2.90 2.96 -0.76 -1.61 118.68 122.37 3g3b s LEU 82 Ca -0.08 -0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 53.35 3g3b s LEU 82 Cb -0.14 -0.16 -0.04 0.00 0.50 0.00 0.00 46.19 46.35 3g3b s LEU 82 CO 0.04 -0.32 0.06 -0.94 -1.32 0.00 0.00 176.35 173.87 3g3b s SER 83 N 2.16 5.67 0.00 3.68 1.04 -0.96 -0.88 113.70 124.41 3g3b s SER 83 Ca 0.03 0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.57 3g3b s SER 83 Cb -0.15 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.02 3g3b s SER 83 CO -0.08 0.20 0.25 0.18 0.98 0.00 0.00 173.24 174.77 3g3b n LEU 84 N 3.39 0.49 -4.68 2.42 4.77 -0.31 -1.04 117.00 122.04 3g3b n LEU 84 Ca -0.17 -0.54 -0.30 0.00 -0.03 0.00 0.00 56.01 54.97 3g3b n LEU 84 Cb 0.52 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.77 3g3b n LEU 84 CO 0.35 0.12 0.65 0.54 -1.33 0.00 0.00 177.39 177.72 3g3b s ASN 85 N -0.09 3.08 -1.21 -1.43 4.22 -1.15 -3.94 114.94 114.42 3g3b s ASN 85 Ca 0.00 1.75 -0.16 0.00 -2.14 0.00 0.00 52.86 52.32 3g3b s ASN 85 Cb 0.00 -2.37 -0.00 0.00 1.28 0.00 0.00 41.25 40.16 3g3b s ASN 85 CO 0.00 -2.93 0.70 0.47 -2.04 0.00 0.00 177.10 173.30 3g3b n ASP 86 N -4.09 -3.88 0.00 3.54 8.00 -0.63 -1.58 116.55 117.90 3g3b n ASP 86 Ca 0.08 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.56 3g3b n ASP 86 Cb 0.54 -3.27 0.00 0.00 -0.02 0.00 0.00 41.12 38.36 3g3b n ASP 86 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3g3b n ASN 87 N -2.75 0.46 -1.85 -2.24 4.13 -1.15 -1.61 115.26 110.26 3g3b n ASN 87 Ca -0.16 0.00 -0.07 0.00 1.68 0.00 0.00 54.58 56.04 3g3b n ASN 87 Cb 0.62 0.00 0.07 0.00 -1.54 0.00 0.00 39.78 38.93 3g3b n ASN 87 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3g3b n GLN 88 N 0.00 2.09 -2.76 3.52 1.13 0.17 -4.54 117.38 116.99 3g3b n GLN 88 Ca 0.00 -3.46 -0.41 0.00 -1.94 0.00 0.00 57.00 51.20 3g3b n GLN 88 Cb 0.00 -1.59 -0.05 0.00 0.11 0.00 0.00 30.24 28.71 3g3b n GLN 88 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3g3b s LEU 89 N -2.99 4.54 -0.23 1.08 1.43 -1.13 -4.27 118.68 117.11 3g3b s LEU 89 Ca 0.39 1.81 0.07 0.00 -1.03 0.00 0.00 54.13 55.38 3g3b s LEU 89 Cb 0.37 -3.56 -0.19 0.00 0.03 0.00 0.00 46.19 42.84 3g3b s LEU 89 CO -0.04 0.01 -0.12 0.29 0.23 0.00 0.00 176.35 176.72 3g3b n LYS 90 N 2.38 0.68 -4.28 1.70 4.76 -1.25 -3.10 118.16 119.05 3g3b n LYS 90 Ca 0.01 0.09 -0.20 0.00 -2.87 0.00 0.00 58.31 55.34 3g3b n LYS 90 Cb 0.49 -1.51 -0.08 0.00 -1.84 0.00 0.00 35.03 32.09 3g3b n LYS 90 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3g3b s SER 91 N -6.11 1.72 -0.09 4.39 1.04 -1.26 -1.68 113.70 111.71 3g3b s SER 91 Ca -0.26 -1.77 0.03 0.00 0.48 0.00 0.00 55.95 54.43 3g3b s SER 91 Cb 0.08 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.78 3g3b s SER 91 CO 0.67 -1.08 -0.17 -0.63 0.98 0.00 0.00 173.24 173.00 3g3b s ILE 92 N -3.39 1.56 0.66 -1.02 -1.09 -1.26 -4.78 121.20 111.88 3g3b s ILE 92 Ca 0.41 -0.72 -0.17 0.00 -2.23 0.00 0.00 60.65 57.93 3g3b s ILE 92 Cb 0.02 -1.39 -0.01 0.00 -1.58 0.00 0.00 42.46 39.50 3g3b s ILE 92 CO 0.28 0.45 1.18 -0.81 -1.23 0.00 0.00 174.94 174.81 3g3b n PRO 93 N 3.80 0.93 -1.54 2.79 -0.04 -1.26 -4.65 135.00 135.04 3g3b n PRO 93 Ca -0.21 0.37 -0.54 0.00 -0.04 0.00 0.00 63.50 63.09 3g3b n PRO 93 Cb 0.52 -2.42 -0.07 0.00 -0.04 0.00 0.00 33.50 31.49 3g3b n PRO 93 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 3g3b n ARG 94 N -1.82 1.09 -0.55 0.54 0.63 -1.26 -1.75 116.66 113.54 3g3b n ARG 94 Ca 0.15 0.35 0.00 0.00 -0.92 0.00 0.00 57.85 57.43 3g3b n ARG 94 Cb 0.48 -2.27 0.00 0.00 0.45 0.00 0.00 32.46 31.13 3g3b n ARG 94 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3g3b n GLY 95 N 5.67 0.73 0.26 5.14 0.00 -1.26 -4.97 105.19 110.77 3g3b n GLY 95 Ca 0.36 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.42 3g3b n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g3b h ALA 96 N 0.00 0.95 -0.47 4.61 0.00 -1.68 -2.47 119.26 120.19 3g3b h ALA 96 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3g3b h ALA 96 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3g3b h ALA 96 CO 0.00 -0.27 0.00 1.19 0.00 0.00 0.00 179.25 180.17 3g3b n PHE 97 N -5.07 0.62 0.10 0.00 3.72 -1.26 -4.57 117.46 110.99 3g3b n PHE 97 Ca 0.13 -0.31 -0.05 0.00 -0.05 0.00 0.00 57.45 57.17 3g3b n PHE 97 Cb 0.40 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 39.05 3g3b n PHE 97 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3g3b h ASP 98 N 3.23 0.20 -0.04 4.37 3.32 -1.84 -2.94 116.42 122.72 3g3b h ASP 98 Ca 0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3g3b h ASP 98 Cb 0.73 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.22 3g3b h ASP 98 CO 0.00 0.81 0.00 0.59 -1.72 0.00 0.00 179.24 178.92 3g3b n ASN 99 N -3.81 1.00 -3.60 6.45 3.02 -1.26 -4.64 115.26 112.42 3g3b n ASN 99 Ca -0.02 -1.42 -0.41 0.00 -0.03 0.00 0.00 54.58 52.70 3g3b n ASN 99 Cb 0.66 -0.02 -0.01 0.00 -0.61 0.00 0.00 39.78 39.80 3g3b n ASN 99 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3g3b n LEU 100 N -0.19 7.60 0.17 3.41 4.77 -1.11 -4.46 117.00 127.20 3g3b n LEU 100 Ca 0.19 -4.58 0.13 0.00 -0.03 0.00 0.00 56.01 51.73 3g3b n LEU 100 Cb 0.26 -1.49 0.48 0.00 -2.33 0.00 0.00 43.42 40.34 3g3b n LEU 100 CO 0.15 1.70 0.89 0.08 -1.33 0.00 0.00 177.39 178.89 3g3b h ARG 101 N 5.26 0.00 -0.41 3.23 0.11 -1.82 -2.76 114.38 117.99 3g3b h ARG 101 Ca 0.63 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.71 3g3b h ARG 101 Cb 0.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.53 3g3b h ARG 101 CO 1.66 0.00 0.00 0.43 0.10 0.00 0.00 179.97 182.16 3g3b n SER 102 N -2.55 3.51 -4.74 0.08 7.64 -1.24 -5.00 113.62 111.32 3g3b n SER 102 Ca 0.03 -2.00 -0.42 0.00 1.01 0.00 0.00 58.87 57.49 3g3b n SER 102 Cb 0.33 -0.26 -0.02 0.00 -1.01 0.00 0.00 64.21 63.24 3g3b n SER 102 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3g3b s LEU 103 N -1.47 4.36 0.00 -3.43 2.96 -0.87 -3.95 118.68 116.28 3g3b s LEU 103 Ca 0.40 2.83 0.00 0.00 -0.22 0.00 0.00 54.13 57.14 3g3b s LEU 103 Cb 0.23 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.30 3g3b s LEU 103 CO 0.32 -0.84 0.00 0.35 -1.32 0.00 0.00 176.35 174.86 3g3b n THR 104 N 2.47 0.00 -3.78 3.68 -2.24 0.57 -4.99 114.28 109.99 3g3b n THR 104 Ca 0.09 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.70 3g3b n THR 104 Cb 0.38 -0.13 -0.16 0.00 -2.10 0.00 0.00 70.33 68.32 3g3b n THR 104 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3g3b s HIS 105 N -1.36 0.09 -0.01 4.78 3.76 -0.68 -4.57 115.29 117.30 3g3b s HIS 105 Ca 0.00 0.13 0.03 0.00 -0.15 0.00 0.00 55.06 55.07 3g3b s HIS 105 Cb 0.00 -0.32 -0.01 0.00 1.11 0.00 0.00 32.58 33.36 3g3b s HIS 105 CO 0.00 -0.12 -0.11 -1.50 -0.85 0.00 0.00 174.74 172.16 3g3b s ILE 106 N 1.29 0.84 -0.16 0.60 2.07 -0.13 -1.83 121.20 123.88 3g3b s ILE 106 Ca -0.06 -0.45 -0.02 0.00 -1.41 0.00 0.00 60.65 58.71 3g3b s ILE 106 Cb -0.13 -0.71 -0.01 0.00 0.13 0.00 0.00 42.46 41.74 3g3b s ILE 106 CO -0.03 0.24 -0.10 0.26 -1.91 0.00 0.00 174.94 173.41 3g3b s TRP 107 N -0.23 2.88 0.00 3.50 0.51 -0.06 -1.25 118.94 124.29 3g3b s TRP 107 Ca 0.04 -0.67 0.00 0.00 -2.12 0.00 0.00 56.10 53.35 3g3b s TRP 107 Cb -0.04 -1.92 0.00 0.00 -0.81 0.00 0.00 33.47 30.69 3g3b s TRP 107 CO -0.00 -0.27 0.00 1.28 -0.51 0.00 0.00 176.95 177.45 3g3b n LEU 108 N 3.83 0.00 -4.55 2.99 4.77 -1.26 -1.16 117.00 121.62 3g3b n LEU 108 Ca -0.18 -0.15 -0.28 0.00 -0.03 0.00 0.00 56.01 55.37 3g3b n LEU 108 Cb 0.52 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.84 3g3b n LEU 108 CO 0.31 0.00 0.56 -1.48 -1.33 0.00 0.00 177.39 175.44 3g3b s LEU 109 N -1.83 0.90 -1.47 2.23 2.34 -1.26 -3.94 118.68 115.64 3g3b s LEU 109 Ca 0.00 1.26 -0.11 0.00 0.06 0.00 0.00 54.13 55.34 3g3b s LEU 109 Cb 0.00 -3.21 0.06 0.00 -0.56 0.00 0.00 46.19 42.48 3g3b s LEU 109 CO 0.00 -3.93 0.98 0.59 -1.06 0.00 0.00 176.35 172.93 3g3b n ASN 110 N -4.71 -4.48 -4.34 1.48 3.02 -1.26 -1.60 115.26 103.37 3g3b n ASN 110 Ca 0.05 -0.75 -0.30 0.00 -0.03 0.00 0.00 54.58 53.54 3g3b n ASN 110 Cb 0.56 -4.10 -0.15 0.00 -0.61 0.00 0.00 39.78 35.48 3g3b n ASN 110 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3g3b s ASN 111 N -3.48 3.15 -1.14 6.41 -0.87 -1.25 -1.86 114.94 115.89 3g3b s ASN 111 Ca 0.55 -0.54 -0.08 0.00 -1.57 0.00 0.00 52.86 51.22 3g3b s ASN 111 Cb -0.27 -0.32 -0.10 0.00 -0.02 0.00 0.00 41.25 40.54 3g3b s ASN 111 CO 0.81 0.28 2.70 -0.81 -2.57 0.00 0.00 177.10 177.51 3g3b n PRO 112 N 2.02 2.85 -1.67 -0.60 -0.04 -1.18 -4.70 135.00 131.67 3g3b n PRO 112 Ca -0.17 -1.74 -0.48 0.00 -0.04 0.00 0.00 63.50 61.08 3g3b n PRO 112 Cb 0.52 -2.55 -0.05 0.00 -0.04 0.00 0.00 33.50 31.38 3g3b n PRO 112 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3g3b n TRP 113 N 3.64 2.23 -3.34 0.54 7.02 -1.23 -4.42 117.44 121.88 3g3b n TRP 113 Ca 0.61 0.20 -0.45 0.00 -1.02 0.00 0.00 57.50 56.84 3g3b n TRP 113 Cb 0.28 -2.57 -0.07 0.00 -2.42 0.00 0.00 31.31 26.53 3g3b n TRP 113 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3g3b s ASP 114 N 2.27 6.17 0.01 -0.99 -1.08 -0.68 -0.28 116.67 122.10 3g3b s ASP 114 Ca 0.86 -1.41 0.22 0.00 -0.52 0.00 0.00 52.55 51.70 3g3b s ASP 114 Cb -0.73 -2.20 -0.08 0.00 -1.46 0.00 0.00 42.92 38.45 3g3b s ASP 114 CO 0.45 -0.74 0.93 0.00 0.52 0.00 0.00 175.17 176.33 3g3b h ALA 116 N 2.67 1.03 -3.11 0.00 0.00 -1.91 -3.41 119.26 114.52 3g3b h ALA 116 Ca 0.00 -0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.28 3g3b h ALA 116 Cb 0.66 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.35 3g3b h ALA 116 CO 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 179.25 178.62 3g3b h SER 118 N 3.07 0.08 0.24 0.00 0.02 -1.79 -2.82 113.55 112.35 3g3b h SER 118 Ca -0.47 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.46 3g3b h SER 118 Cb 1.18 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 3g3b h SER 118 CO 0.61 0.09 -0.08 0.44 -1.14 0.00 0.00 176.83 176.75 3g3b h ASP 119 N 0.09 0.00 0.55 3.07 3.32 -1.90 -2.85 116.42 118.71 3g3b h ASP 119 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3g3b h ASP 119 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3g3b h ASP 119 CO -0.00 0.08 0.00 -0.29 -1.72 0.00 0.00 179.24 177.31 3g3b h ILE 120 N 0.00 0.00 -0.67 0.35 6.09 -1.70 -3.35 117.51 118.23 3g3b h ILE 120 Ca -0.00 -0.25 -0.05 0.00 -1.37 0.00 0.00 64.86 63.19 3g3b h ILE 120 Cb 0.22 1.15 -0.03 0.00 0.47 0.00 0.00 36.82 38.63 3g3b h ILE 120 CO 0.01 0.00 0.23 -0.07 -3.07 0.00 0.00 178.15 175.25 3g3b h LEU 121 N 0.00 0.92 -0.01 2.19 3.38 -1.72 -1.54 115.31 118.54 3g3b h LEU 121 Ca 0.00 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.85 3g3b h LEU 121 Cb 0.27 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 3g3b h LEU 121 CO 0.00 0.85 -0.27 0.22 0.09 0.00 0.00 178.44 179.33 3g3b h TYR 122 N 0.97 -0.73 -0.21 1.13 3.20 -1.82 -1.58 116.97 117.93 3g3b h TYR 122 Ca 0.22 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 3g3b h TYR 122 Cb 0.24 0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 3g3b h TYR 122 CO 0.02 -0.36 0.13 1.25 -1.64 0.00 0.00 178.16 177.55 3g3b h LEU 123 N -0.41 0.26 -0.76 2.82 5.85 -1.75 -0.04 115.31 121.28 3g3b h LEU 123 Ca 0.06 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3g3b h LEU 123 Cb 0.50 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 3g3b h LEU 123 CO -0.24 0.24 0.45 0.77 -0.34 0.00 0.00 178.44 179.33 3g3b h SER 124 N 0.26 0.92 0.13 1.25 4.64 -1.23 -0.81 113.55 118.71 3g3b h SER 124 Ca 0.08 -0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 61.19 3g3b h SER 124 Cb 0.03 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 3g3b h SER 124 CO -0.01 0.72 -0.49 -0.09 -0.87 0.00 0.00 176.83 176.08 3g3b h ARG 125 N 1.04 0.42 -0.32 4.77 2.43 -1.22 -2.15 114.38 119.34 3g3b h ARG 125 Ca 0.27 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 3g3b h ARG 125 Cb -0.02 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3g3b h ARG 125 CO -0.05 0.82 0.01 2.35 -1.51 0.00 0.00 179.97 181.59 3g3b h TRP 126 N 0.33 0.61 -0.35 2.20 7.01 -0.50 -1.40 115.95 123.85 3g3b h TRP 126 Ca 0.02 -0.10 -0.07 0.00 2.11 0.00 0.00 58.89 60.85 3g3b h TRP 126 Cb 0.99 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.88 3g3b h TRP 126 CO 0.03 0.68 -0.03 0.82 -2.79 0.00 0.00 178.44 177.15 3g3b h ILE 127 N 0.37 1.27 -0.87 2.65 2.04 -1.20 -1.27 117.51 120.50 3g3b h ILE 127 Ca 0.09 -1.05 0.17 0.00 1.00 0.00 0.00 64.86 65.08 3g3b h ILE 127 Cb 0.43 1.24 -0.11 0.00 -0.74 0.00 0.00 36.82 37.65 3g3b h ILE 127 CO 0.02 0.35 0.42 0.28 0.00 0.00 0.00 178.15 179.21 3g3b h SER 128 N 0.45 0.46 0.79 1.72 0.02 -1.26 -1.66 113.55 114.06 3g3b h SER 128 Ca 0.10 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3g3b h SER 128 Cb 0.51 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.11 3g3b h SER 128 CO 0.02 0.14 -0.04 0.00 -1.14 0.00 0.00 176.83 175.81 3g3b n GLN 129 N -4.93 0.18 -2.94 3.45 6.02 -0.54 -4.30 117.38 114.32 3g3b n GLN 129 Ca 0.19 -0.02 -0.18 0.00 -0.01 0.00 0.00 57.00 56.99 3g3b n GLN 129 Cb 0.52 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.26 3g3b n GLN 129 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3g3b n HIS 130 N -1.39 1.33 0.53 1.08 8.25 -0.50 -4.96 115.22 119.55 3g3b n HIS 130 Ca 0.10 -3.49 0.06 0.00 -0.26 0.00 0.00 57.72 54.13 3g3b n HIS 130 Cb 0.30 -0.39 0.31 0.00 1.12 0.00 0.00 29.99 31.33 3g3b n HIS 130 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3g3b n PRO 131 N 0.04 0.08 0.00 -0.41 -0.04 -1.20 -1.82 135.00 131.65 3g3b n PRO 131 Ca 0.23 0.22 0.14 0.00 -0.04 0.00 0.00 63.50 64.05 3g3b n PRO 131 Cb 0.66 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 33.11 3g3b n PRO 131 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3g3b n TRP 132 N -1.41 0.00 0.03 0.54 2.14 -1.26 -4.55 117.44 112.94 3g3b n TRP 132 Ca 0.05 0.00 0.09 0.00 2.07 0.00 0.00 57.50 59.71 3g3b n TRP 132 Cb 0.13 -0.03 -0.14 0.00 -0.81 0.00 0.00 31.31 30.47 3g3b n TRP 132 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3g3b n LEU 133 N 0.02 0.04 -4.52 5.67 4.77 -0.76 -4.88 117.00 117.34 3g3b n LEU 133 Ca 0.17 -0.02 -0.37 0.00 -0.03 0.00 0.00 56.01 55.76 3g3b n LEU 133 Cb 0.36 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.33 3g3b n LEU 133 CO 0.19 0.01 -0.24 -0.69 -1.33 0.00 0.00 177.39 175.33 3g3b s VAL 134 N -3.22 4.71 0.01 4.08 1.01 -1.26 -0.96 120.40 124.76 3g3b s VAL 134 Ca -0.06 -0.04 0.06 0.00 0.00 0.00 0.00 61.98 61.94 3g3b s VAL 134 Cb 0.12 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 3g3b s VAL 134 CO 0.75 0.33 -0.18 -0.36 0.00 0.00 0.00 175.10 175.64 3g3b s PHE 135 N 1.47 2.57 0.00 5.22 0.40 -0.38 -0.43 117.98 126.82 3g3b s PHE 135 Ca 0.06 -0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 3g3b s PHE 135 Cb -0.15 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.86 3g3b s PHE 135 CO 0.05 0.19 0.00 0.41 0.70 0.00 0.00 175.22 176.58 3g3b n GLY 136 N 1.89 1.65 0.26 4.36 0.00 -1.07 -4.26 105.19 108.03 3g3b n GLY 136 Ca -0.16 -1.66 0.14 0.00 0.00 0.00 0.00 46.02 44.33 3g3b n GLY 136 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3g3b n TYR 137 N 0.00 0.00 0.00 1.61 4.01 -1.26 -4.72 117.16 116.80 3g3b n TYR 137 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3g3b n TYR 137 Cb 0.00 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.93 3g3b n TYR 137 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3g3b n LEU 138 N -0.52 0.00 0.00 7.72 4.77 -1.26 -5.16 117.00 122.55 3g3b n LEU 138 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3g3b n LEU 138 Cb 0.32 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 3g3b n LEU 138 CO 0.22 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 176.87 3g3b n ASN 139 N 0.00 0.06 -4.58 -1.43 3.02 -1.26 -5.04 115.26 106.03 3g3b n ASN 139 Ca 0.00 0.00 -0.53 0.00 -0.03 0.00 0.00 54.58 54.02 3g3b n ASN 139 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 3g3b n ASN 139 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3g3b n LEU 140 N 0.00 1.50 -3.20 3.41 7.94 -1.26 -2.60 117.00 122.78 3g3b n LEU 140 Ca 0.00 1.12 0.01 0.00 -1.11 0.00 0.00 56.01 56.03 3g3b n LEU 140 Cb 0.00 -1.17 -0.01 0.00 0.53 0.00 0.00 43.42 42.77 3g3b n LEU 140 CO 0.00 -1.12 0.08 -0.62 -1.11 0.00 0.00 177.39 174.62 3g3b s ASP 141 N 0.44 -1.44 0.00 1.96 -1.08 0.42 -4.84 116.67 112.14 3g3b s ASP 141 Ca 0.85 -0.52 0.19 0.00 -0.52 0.00 0.00 52.55 52.55 3g3b s ASP 141 Cb -0.98 1.92 1.05 0.00 -1.46 0.00 0.00 42.92 43.45 3g3b s ASP 141 CO 0.48 -0.21 1.58 0.00 0.52 0.00 0.00 175.17 177.54 3g3b n HIS 142 N 4.72 0.00 1.34 -5.34 1.44 -1.24 -1.96 115.22 114.17 3g3b n HIS 142 Ca 0.09 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.93 3g3b n HIS 142 Cb 0.56 -0.17 0.39 0.00 0.12 0.00 0.00 29.99 30.88 3g3b n HIS 142 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3g3b n ASP 143 N -1.17 1.74 0.08 4.39 9.92 -1.26 -4.62 116.55 125.62 3g3b n ASP 143 Ca 0.11 -1.50 -0.08 0.00 -0.53 0.00 0.00 54.79 52.79 3g3b n ASP 143 Cb 0.12 0.05 0.03 0.00 -0.64 0.00 0.00 41.12 40.68 3g3b n ASP 143 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 3g3b h SER 144 N 2.63 0.31 -2.80 -2.24 4.64 -1.76 -3.40 113.55 110.93 3g3b h SER 144 Ca 0.00 -0.22 -0.57 0.00 -0.47 0.00 0.00 61.79 60.53 3g3b h SER 144 Cb 0.61 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 3g3b h SER 144 CO 0.00 0.97 1.20 0.00 -0.87 0.00 0.00 176.83 178.13 3g3b s ALA 145 N -3.42 3.02 0.11 5.18 0.00 -1.26 -4.42 121.76 120.97 3g3b s ALA 145 Ca -0.04 0.26 0.08 0.00 0.00 0.00 0.00 51.96 52.26 3g3b s ALA 145 Cb 0.11 -3.95 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 3g3b s ALA 145 CO 0.82 -2.38 -0.19 1.03 0.00 0.00 0.00 175.76 175.05 3g3b s ARG 146 N 5.24 1.11 0.10 0.00 0.52 -1.26 -1.48 118.95 123.18 3g3b s ARG 146 Ca 0.74 -1.20 -0.30 0.00 -0.52 0.00 0.00 55.73 54.46 3g3b s ARG 146 Cb -0.22 -1.26 -0.06 0.00 0.52 0.00 0.00 34.95 33.93 3g3b s ARG 146 CO 0.32 0.28 1.04 0.00 0.02 0.00 0.00 175.30 176.97 3g3b s SER 148 N 0.30 5.40 0.00 0.00 1.04 0.62 -0.75 113.70 120.31 3g3b s SER 148 Ca 0.50 2.57 0.00 0.00 0.48 0.00 0.00 55.95 59.50 3g3b s SER 148 Cb -0.26 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.24 3g3b s SER 148 CO 0.31 -1.46 0.00 0.61 0.98 0.00 0.00 173.24 173.68 3g3b n GLY 149 N 0.63 2.15 0.13 7.32 0.00 -1.26 -4.48 105.19 109.68 3g3b n GLY 149 Ca 0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 3g3b n GLY 149 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3g3b h THR 150 N 0.00 1.49 -2.24 2.61 1.35 -1.98 -3.47 112.91 110.66 3g3b h THR 150 Ca 0.00 -2.40 -0.38 0.00 -0.55 0.00 0.00 66.41 63.08 3g3b h THR 150 Cb 0.00 2.29 -0.05 0.00 -1.73 0.00 0.00 68.15 68.66 3g3b h THR 150 CO 0.00 0.69 -0.45 -3.20 -0.25 0.00 0.00 175.52 172.31 3g3b n ASN 151 N -3.72 -5.39 -4.94 5.36 4.05 0.07 -4.99 115.26 105.71 3g3b n ASN 151 Ca -0.02 0.10 -0.26 0.00 0.45 0.00 0.00 54.58 54.86 3g3b n ASN 151 Cb 0.71 -4.47 -0.03 0.00 1.23 0.00 0.00 39.78 37.22 3g3b n ASN 151 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 3g3b s THR 152 N -2.88 5.24 0.16 -0.44 -4.23 -1.26 -4.71 115.64 107.52 3g3b s THR 152 Ca 0.00 -0.56 -0.31 0.00 -1.18 0.00 0.00 61.69 59.64 3g3b s THR 152 Cb 0.00 -3.77 -0.10 0.00 1.34 0.00 0.00 72.50 69.98 3g3b s THR 152 CO 0.00 -0.21 1.50 -2.84 -0.54 0.00 0.00 174.62 172.54 3g3b s PRO 153 N -3.48 4.25 0.30 3.99 0.02 -1.26 -0.57 135.00 138.25 3g3b s PRO 153 Ca 0.37 2.28 0.06 0.00 0.02 0.00 0.00 61.00 63.73 3g3b s PRO 153 Cb -0.11 -3.17 0.78 0.00 0.02 0.00 0.00 34.50 32.02 3g3b s PRO 153 CO 0.29 -0.54 1.73 0.28 -0.33 0.00 0.00 177.00 178.44 3g3b h VAL 154 N 4.01 0.58 -0.63 3.83 2.07 -1.56 -2.47 116.25 122.08 3g3b h VAL 154 Ca -0.43 -0.20 0.18 0.00 0.82 0.00 0.00 66.70 67.07 3g3b h VAL 154 Cb 1.21 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3g3b h VAL 154 CO 0.88 0.11 0.48 0.08 0.02 0.00 0.00 177.57 179.13 3g3b h ARG 155 N 0.58 0.00 0.00 1.57 0.11 -1.79 -2.08 114.38 112.77 3g3b h ARG 155 Ca 0.59 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.67 3g3b h ARG 155 Cb 1.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.13 3g3b h ARG 155 CO -0.46 0.00 0.00 0.00 0.10 0.00 0.00 179.97 179.61 3g3b h ALA 156 N 1.64 1.00 -2.50 0.08 0.00 -1.73 -3.43 119.26 114.32 3g3b h ALA 156 Ca 0.30 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.68 3g3b h ALA 156 Cb 1.25 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.06 3g3b h ALA 156 CO -0.00 0.00 0.87 0.08 0.00 0.00 0.00 179.25 180.19 3g3b s VAL 157 N -3.20 3.11 0.30 0.00 1.01 -0.78 -5.04 120.40 115.80 3g3b s VAL 157 Ca 0.08 0.70 0.09 0.00 0.00 0.00 0.00 61.98 62.84 3g3b s VAL 157 Cb 0.08 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 3g3b s VAL 157 CO 0.63 0.03 0.06 0.42 0.00 0.00 0.00 175.10 176.23 3g3b s THR 158 N 1.80 3.21 0.23 3.92 -4.23 -1.26 -4.79 115.64 114.52 3g3b s THR 158 Ca 0.69 -1.82 -0.14 0.00 -1.18 0.00 0.00 61.69 59.23 3g3b s THR 158 Cb -0.39 -2.90 0.28 0.00 1.34 0.00 0.00 72.50 70.83 3g3b s THR 158 CO 0.30 -0.28 1.59 0.50 -0.54 0.00 0.00 174.62 176.19 3g3b h LYS 159 N 1.74 -0.04 -0.79 3.99 3.64 -1.96 -0.96 116.57 122.19 3g3b h LYS 159 Ca -0.44 0.00 0.23 0.00 -1.27 0.00 0.00 60.65 59.17 3g3b h LYS 159 Cb 1.25 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.05 3g3b h LYS 159 CO 0.62 -0.03 1.04 0.00 -2.27 0.00 0.00 179.45 178.81 3g3b h ALA 160 N 1.55 2.68 0.00 5.00 0.00 -2.02 0.41 119.26 126.88 3g3b h ALA 160 Ca 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3g3b h ALA 160 Cb 0.59 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3g3b h ALA 160 CO -0.82 -1.45 -1.20 -1.13 0.00 0.00 0.00 179.25 174.65 3g3b n SER 161 N -3.24 0.59 -4.87 0.00 3.41 -0.36 -4.99 113.62 104.15 3g3b n SER 161 Ca 0.17 -0.35 -0.21 0.00 -0.26 0.00 0.00 58.87 58.23 3g3b n SER 161 Cb 1.29 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 66.26 3g3b n SER 161 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3g3b s THR 162 N -3.21 3.63 -0.07 6.66 -4.23 0.15 -4.75 115.64 113.81 3g3b s THR 162 Ca 0.03 -1.32 -0.07 0.00 -1.18 0.00 0.00 61.69 59.14 3g3b s THR 162 Cb 0.15 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.78 3g3b s THR 162 CO 0.84 -0.18 0.21 -0.55 -0.54 0.00 0.00 174.62 174.40 3g3b s SER 163 N -4.02 -0.21 0.56 3.99 0.15 -1.01 -4.90 113.70 108.27 3g3b s SER 163 Ca 0.41 0.40 0.27 0.00 0.70 0.00 0.00 55.95 57.72 3g3b s SER 163 Cb -0.06 0.42 1.65 0.00 -1.71 0.00 0.00 66.02 66.31 3g3b s SER 163 CO 0.27 -0.09 2.20 -0.65 1.20 0.00 0.00 173.24 176.17 3g3b h PRO 164 N 5.74 0.00 -0.48 5.44 0.11 -1.94 -2.66 132.00 138.21 3g3b h PRO 164 Ca -0.26 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.99 3g3b h PRO 164 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 3g3b h PRO 164 CO 0.38 0.03 0.41 0.66 -0.21 0.00 0.00 178.00 179.27 3g3b h SER 165 N 0.00 0.00 -0.24 -2.05 4.64 -1.95 -1.76 113.55 112.20 3g3b h SER 165 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g3b h SER 165 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3g3b h SER 165 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 3g3b n LYS 166 N -4.06 2.26 -2.59 4.77 4.76 -1.11 -4.93 118.16 117.26 3g3b n LYS 166 Ca 0.09 -1.88 -0.30 0.00 -2.87 0.00 0.00 58.31 53.34 3g3b n LYS 166 Cb 0.61 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.31 3g3b n LYS 166 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g3b s PRO 168 N -4.25 1.67 0.00 0.00 0.02 -1.26 -5.11 135.00 126.07 3g3b s PRO 168 Ca 0.52 1.51 0.00 0.00 0.02 0.00 0.00 61.00 63.05 3g3b s PRO 168 Cb -0.10 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.61 3g3b s PRO 168 CO 0.37 -2.14 0.00 0.41 -0.33 0.00 0.00 177.00 175.31