#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f4t s THR 20 N 0.00 3.82 0.38 7.28 -4.23 -1.26 -5.01 115.64 116.61 3f4t s THR 20 Ca 0.00 -0.66 0.11 0.00 -1.18 0.00 0.00 61.69 59.96 3f4t s THR 20 Cb 0.00 -2.66 0.34 0.00 1.34 0.00 0.00 72.50 71.52 3f4t s THR 20 CO 0.00 0.43 1.87 0.77 -0.54 0.00 0.00 174.62 177.15 3f4t h SER 21 N 4.61 0.57 -0.59 3.99 4.64 -1.99 -1.51 113.55 123.26 3f4t h SER 21 Ca -0.49 0.04 -0.08 0.00 -0.47 0.00 0.00 61.79 60.79 3f4t h SER 21 Cb 1.17 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 3f4t h SER 21 CO 0.54 0.28 0.06 -1.13 -0.87 0.00 0.00 176.83 175.71 3f4t h ASN 22 N 0.59 0.99 1.13 4.97 -1.24 -1.92 -2.19 115.58 117.91 3f4t h ASN 22 Ca 0.44 -0.25 -0.03 0.00 0.71 0.00 0.00 56.30 57.17 3f4t h ASN 22 Cb 0.82 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 39.60 3f4t h ASN 22 CO -0.19 1.01 -0.12 -0.33 -1.29 0.00 0.00 177.43 176.51 3f4t h GLU 23 N 0.95 0.00 0.00 6.67 5.08 -1.72 -2.73 114.58 122.83 3f4t h GLU 23 Ca 0.18 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 3f4t h GLU 23 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3f4t h GLU 23 CO 0.02 0.12 -0.45 1.25 -1.00 0.00 0.00 179.01 178.95 3f4t h LEU 24 N 0.00 0.00 -4.42 1.33 5.85 -0.75 -3.31 115.31 114.01 3f4t h LEU 24 Ca -0.00 0.00 -0.64 0.00 0.84 0.00 0.00 57.88 58.08 3f4t h LEU 24 Cb 0.72 0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.51 3f4t h LEU 24 CO 0.02 0.45 0.80 0.18 -0.34 0.00 0.00 178.44 179.54 3f4t n LEU 25 N -3.65 7.26 -4.10 2.25 4.77 -1.03 -4.85 117.00 117.64 3f4t n LEU 25 Ca -0.01 -4.33 -0.08 0.00 -0.03 0.00 0.00 56.01 51.56 3f4t n LEU 25 Cb 0.53 -1.07 -0.10 0.00 -2.33 0.00 0.00 43.42 40.45 3f4t n LEU 25 CO 0.38 1.60 -0.34 -0.76 -1.33 0.00 0.00 177.39 176.94 3f4t s LEU 26 N -3.36 2.33 0.15 2.23 1.43 -1.25 -5.06 118.68 115.15 3f4t s LEU 26 Ca 0.55 -1.04 -0.32 0.00 -1.03 0.00 0.00 54.13 52.28 3f4t s LEU 26 Cb 0.43 0.23 -0.12 0.00 0.03 0.00 0.00 46.19 46.76 3f4t s LEU 26 CO -0.21 -0.63 1.77 -2.65 0.23 0.00 0.00 176.35 174.86 3f4t n PRO 27 N 0.07 2.68 -4.03 1.29 -0.02 -1.26 -4.98 135.00 128.74 3f4t n PRO 27 Ca -0.12 0.97 -0.22 0.00 -2.02 0.00 0.00 63.50 62.11 3f4t n PRO 27 Cb 0.62 -2.83 -0.03 0.00 -0.02 0.00 0.00 33.50 31.23 3f4t n PRO 27 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3f4t s LEU 28 N 2.02 4.09 0.25 2.45 1.43 -1.26 -5.01 118.68 122.65 3f4t s LEU 28 Ca 0.80 -0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 53.81 3f4t s LEU 28 Cb -0.53 -2.63 0.50 0.00 0.03 0.00 0.00 46.19 43.56 3f4t s LEU 28 CO 0.36 -0.04 1.74 -0.65 0.23 0.00 0.00 176.35 178.00 3f4t h PRO 29 N 1.47 0.49 -0.01 1.29 0.11 -2.02 -1.61 132.00 131.73 3f4t h PRO 29 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3f4t h PRO 29 Cb 1.23 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3f4t h PRO 29 CO 0.62 0.33 -0.29 0.09 -0.21 0.00 0.00 178.00 178.53 3f4t n ASN 30 N -4.96 0.96 -4.67 -2.05 3.02 -1.26 -4.93 115.26 101.38 3f4t n ASN 30 Ca 0.16 -0.81 -0.41 0.00 -0.03 0.00 0.00 54.58 53.49 3f4t n ASN 30 Cb 0.43 0.15 0.02 0.00 -0.61 0.00 0.00 39.78 39.77 3f4t n ASN 30 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3f4t n ASP 31 N -0.76 2.02 -4.64 6.41 8.00 -0.61 -4.97 116.55 121.99 3f4t n ASP 31 Ca 0.11 1.06 -0.39 0.00 0.71 0.00 0.00 54.79 56.28 3f4t n ASP 31 Cb 0.35 -1.45 -0.07 0.00 -0.02 0.00 0.00 41.12 39.92 3f4t n ASP 31 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3f4t s LYS 32 N -2.22 4.12 0.10 -1.24 -0.14 -1.26 -4.92 119.74 114.19 3f4t s LYS 32 Ca 0.63 0.28 0.02 0.00 -1.36 0.00 0.00 55.97 55.54 3f4t s LYS 32 Cb -0.51 -3.60 -0.04 0.00 -1.68 0.00 0.00 37.83 32.00 3f4t s LYS 32 CO 0.56 -0.20 0.19 -0.51 -0.76 0.00 0.00 175.35 174.63 3f4t s LEU 33 N 1.81 4.16 -0.09 3.17 1.43 -1.26 -4.11 118.68 123.79 3f4t s LEU 33 Ca 0.21 0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.42 3f4t s LEU 33 Cb -0.15 -2.77 0.03 0.00 0.03 0.00 0.00 46.19 43.33 3f4t s LEU 33 CO 0.09 0.13 -0.02 -0.22 0.23 0.00 0.00 176.35 176.56 3f4t s LEU 34 N -2.74 0.77 0.00 1.79 2.96 -0.27 -4.74 118.68 116.44 3f4t s LEU 34 Ca 0.33 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 3f4t s LEU 34 Cb -0.12 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 46.02 3f4t s LEU 34 CO 0.26 -0.18 0.00 0.61 -1.32 0.00 0.00 176.35 175.72 3f4t n GLY 35 N 5.09 -1.91 3.67 7.98 0.00 -1.26 -0.76 105.19 118.00 3f4t n GLY 35 Ca -0.08 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.38 3f4t n GLY 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f4t s ASP 36 N -2.63 6.91 0.50 1.61 -1.08 -1.26 -4.90 116.67 115.83 3f4t s ASP 36 Ca 0.00 1.86 0.34 0.00 -0.52 0.00 0.00 52.55 54.23 3f4t s ASP 36 Cb 0.00 -2.54 1.79 0.00 -1.46 0.00 0.00 42.92 40.71 3f4t s ASP 36 CO 0.00 -0.75 2.03 -0.65 0.52 0.00 0.00 175.17 176.33 3f4t h PRO 37 N 8.21 0.00 -0.37 4.34 0.11 -1.96 -0.84 132.00 141.49 3f4t h PRO 37 Ca -0.32 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 3f4t h PRO 37 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3f4t h PRO 37 CO 0.94 0.00 0.01 1.63 -0.21 0.00 0.00 178.00 180.37 3f4t n LYS 38 N -2.72 3.42 -1.70 1.05 5.02 -1.26 -5.01 118.16 116.97 3f4t n LYS 38 Ca -0.02 -2.96 -0.37 0.00 -2.02 0.00 0.00 58.31 52.94 3f4t n LYS 38 Cb 0.08 -1.98 0.06 0.00 -0.02 0.00 0.00 35.03 33.18 3f4t n LYS 38 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3f4t n ALA 39 N -0.24 0.99 0.18 7.82 0.00 -0.32 -4.93 120.51 124.02 3f4t n ALA 39 Ca 0.25 0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.74 3f4t n ALA 39 Cb 1.01 -2.28 0.35 0.00 0.00 0.00 0.00 19.45 18.53 3f4t n ALA 39 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3f4t h PRO 40 N 0.69 0.00 -6.45 0.00 0.13 -1.75 -3.42 132.00 121.20 3f4t h PRO 40 Ca -0.50 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.95 3f4t h PRO 40 Cb 1.34 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.28 3f4t h PRO 40 CO 0.53 0.38 -0.75 0.42 -0.23 0.00 0.00 178.00 178.35 3f4t s ILE 41 N -4.13 3.23 -0.09 -3.56 -1.09 -0.76 -1.10 121.20 113.69 3f4t s ILE 41 Ca -0.03 -1.03 0.04 0.00 -2.23 0.00 0.00 60.65 57.41 3f4t s ILE 41 Cb 0.14 -2.40 -0.00 0.00 -1.58 0.00 0.00 42.46 38.62 3f4t s ILE 41 CO 0.72 0.33 -0.24 -0.22 -1.23 0.00 0.00 174.94 174.31 3f4t s LEU 42 N -1.54 2.13 -0.14 2.97 2.96 0.69 -0.21 118.68 125.54 3f4t s LEU 42 Ca 0.17 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.57 3f4t s LEU 42 Cb -0.11 -1.41 0.01 0.00 0.50 0.00 0.00 46.19 45.18 3f4t s LEU 42 CO 0.07 0.19 -0.21 -0.32 -1.32 0.00 0.00 176.35 174.76 3f4t s MET 43 N 0.18 3.04 -0.16 1.98 -2.45 0.25 -1.38 119.30 120.77 3f4t s MET 43 Ca -0.14 -0.85 -0.02 0.00 -1.25 0.00 0.00 55.69 53.44 3f4t s MET 43 Cb -0.17 -2.45 -0.02 0.00 1.25 0.00 0.00 34.83 33.45 3f4t s MET 43 CO 0.07 -0.00 -0.08 0.42 1.05 0.00 0.00 175.02 176.48 3f4t s ILE 44 N 0.79 3.38 -0.07 10.11 1.01 0.06 -0.12 121.20 136.36 3f4t s ILE 44 Ca -0.07 -0.53 0.05 0.00 0.00 0.00 0.00 60.65 60.10 3f4t s ILE 44 Cb -0.16 -2.47 -0.01 0.00 0.01 0.00 0.00 42.46 39.84 3f4t s ILE 44 CO -0.01 0.49 -0.24 -0.70 0.00 0.00 0.00 174.94 174.48 3f4t s GLU 45 N 0.61 2.71 -0.17 2.79 2.12 -0.17 -0.21 118.70 126.38 3f4t s GLU 45 Ca -0.05 -0.88 -0.05 0.00 0.36 0.00 0.00 54.97 54.35 3f4t s GLU 45 Cb -0.15 -2.19 -0.03 0.00 0.26 0.00 0.00 34.13 32.02 3f4t s GLU 45 CO 0.03 0.30 -0.00 0.71 -0.54 0.00 0.00 175.26 175.76 3f4t s TYR 46 N 0.04 3.09 -0.03 5.30 2.02 -0.17 -0.30 117.35 127.30 3f4t s TYR 46 Ca -0.09 -0.22 -0.24 0.00 -0.37 0.00 0.00 57.07 56.14 3f4t s TYR 46 Cb -0.15 -2.02 0.05 0.00 -0.40 0.00 0.00 41.96 39.44 3f4t s TYR 46 CO 0.06 -0.02 0.53 0.00 -1.57 0.00 0.00 175.55 174.55 3f4t s ALA 47 N 0.48 -1.38 0.07 3.71 0.00 -1.15 -1.71 121.76 121.78 3f4t s ALA 47 Ca -0.01 0.91 -0.25 0.00 0.00 0.00 0.00 51.96 52.61 3f4t s ALA 47 Cb -0.14 0.05 -0.06 0.00 0.00 0.00 0.00 23.12 22.97 3f4t s ALA 47 CO 0.02 -0.34 0.75 0.45 0.00 0.00 0.00 175.76 176.64 3f4t s SER 48 N -1.29 7.23 0.29 0.00 0.15 -1.22 -2.39 113.70 116.47 3f4t s SER 48 Ca -0.12 1.47 0.25 0.00 0.70 0.00 0.00 55.95 58.25 3f4t s SER 48 Cb -0.02 -2.46 1.03 0.00 -1.71 0.00 0.00 66.02 62.86 3f4t s SER 48 CO 0.07 0.07 1.74 -0.07 1.20 0.00 0.00 173.24 176.25 3f4t h LEU 49 N 5.32 0.00 -2.61 3.45 3.38 -1.86 -2.45 115.31 120.55 3f4t h LEU 49 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3f4t h LEU 49 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3f4t h LEU 49 CO 0.69 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.57 3f4t n THR 50 N -2.32 0.81 -2.33 0.22 -2.24 -1.26 -4.40 114.28 102.76 3f4t n THR 50 Ca 0.02 -0.91 -0.42 0.00 -2.27 0.00 0.00 64.05 60.47 3f4t n THR 50 Cb 0.23 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 3f4t n THR 50 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f4t h TYR 52 N 7.30 -0.18 -0.14 0.00 3.20 -1.92 -1.70 116.97 123.53 3f4t h TYR 52 Ca -0.39 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.46 3f4t h TYR 52 Cb 1.19 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.51 3f4t h TYR 52 CO 0.71 0.18 -0.01 0.45 -1.64 0.00 0.00 178.16 177.85 3f4t h HIS 53 N -0.57 0.20 -0.47 -3.82 3.86 -1.93 -1.57 115.15 110.85 3f4t h HIS 53 Ca -0.02 -0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.09 3f4t h HIS 53 Cb 0.44 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.83 3f4t h HIS 53 CO 0.04 0.22 -0.09 0.00 0.86 0.00 0.00 177.93 178.96 3f4t h SER 55 N 0.76 0.69 -0.41 0.00 4.64 -0.39 -1.60 113.55 117.24 3f4t h SER 55 Ca 0.13 -0.31 -0.13 0.00 -0.47 0.00 0.00 61.79 61.00 3f4t h SER 55 Cb 0.59 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 3f4t h SER 55 CO 0.04 1.02 -0.26 -0.07 -0.87 0.00 0.00 176.83 176.69 3f4t h LEU 56 N 0.53 0.94 -0.62 5.97 3.38 -1.19 -1.38 115.31 122.94 3f4t h LEU 56 Ca 0.04 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 3f4t h LEU 56 Cb 0.94 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3f4t h LEU 56 CO 0.08 1.16 0.37 0.15 0.09 0.00 0.00 178.44 180.30 3f4t h PHE 57 N 0.72 0.81 0.00 1.13 3.57 -1.12 -0.70 116.94 121.34 3f4t h PHE 57 Ca 0.08 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3f4t h PHE 57 Cb 0.83 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 3f4t h PHE 57 CO 0.06 0.55 -0.29 0.45 -2.23 0.00 0.00 178.31 176.85 3f4t h HIS 58 N 0.83 0.00 0.17 0.41 3.86 -1.18 0.30 115.15 119.54 3f4t h HIS 58 Ca 0.22 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.17 3f4t h HIS 58 Cb -0.03 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.47 3f4t h HIS 58 CO -0.02 0.29 -1.11 -0.09 0.86 0.00 0.00 177.93 177.86 3f4t h ARG 59 N 0.00 0.46 0.00 2.45 2.43 -0.94 -3.38 114.38 115.40 3f4t h ARG 59 Ca -0.00 -0.71 0.00 0.00 -0.81 0.00 0.00 59.98 58.45 3f4t h ARG 59 Cb 0.82 0.26 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3f4t h ARG 59 CO 0.04 1.33 -1.28 0.09 -1.51 0.00 0.00 179.97 178.64 3f4t n ASN 60 N -3.93 2.18 0.00 -3.80 3.02 -0.30 -4.72 115.26 107.71 3f4t n ASN 60 Ca -0.15 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 3f4t n ASN 60 Cb 0.94 1.38 0.00 0.00 -0.61 0.00 0.00 39.78 41.50 3f4t n ASN 60 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3f4t n VAL 61 N -1.74 0.00 -0.24 2.41 0.31 -0.13 -4.82 118.33 114.11 3f4t n VAL 61 Ca -0.01 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.35 3f4t n VAL 61 Cb 0.25 -1.11 0.27 0.00 -0.91 0.00 0.00 33.84 32.34 3f4t n VAL 61 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 3f4t h PHE 62 N 0.00 0.95 -0.99 3.52 3.57 -1.20 -2.38 116.94 120.41 3f4t h PHE 62 Ca 0.00 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.64 3f4t h PHE 62 Cb 0.94 -0.31 -0.08 0.00 2.79 0.00 0.00 35.95 39.28 3f4t h PHE 62 CO 0.00 0.54 0.61 -1.35 -2.23 0.00 0.00 178.31 175.88 3f4t h PRO 63 N 0.97 0.94 -0.16 6.41 0.11 -1.84 0.12 132.00 138.54 3f4t h PRO 63 Ca 0.33 -0.06 -0.16 0.00 0.11 0.00 0.00 66.00 66.22 3f4t h PRO 63 Cb 0.09 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 3f4t h PRO 63 CO -0.10 0.62 -0.58 0.87 -0.21 0.00 0.00 178.00 178.60 3f4t h LYS 64 N 0.97 0.51 -0.39 1.05 1.57 -1.76 -1.35 116.57 117.16 3f4t h LYS 64 Ca 0.49 -0.33 0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3f4t h LYS 64 Cb 0.49 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 3f4t h LYS 64 CO -0.27 0.94 0.26 0.82 -0.57 0.00 0.00 179.45 180.63 3f4t h ILE 65 N 0.39 1.09 -0.27 1.86 2.04 -1.06 0.71 117.51 122.27 3f4t h ILE 65 Ca 0.00 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 3f4t h ILE 65 Cb 1.12 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 3f4t h ILE 65 CO 0.11 0.10 0.14 0.50 0.00 0.00 0.00 178.15 178.99 3f4t h LYS 66 N 0.52 0.38 -0.61 2.37 3.64 -0.64 0.11 116.57 122.34 3f4t h LYS 66 Ca 0.15 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.38 3f4t h LYS 66 Cb -0.05 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3f4t h LYS 66 CO -0.04 0.35 -0.00 1.49 -2.27 0.00 0.00 179.45 178.98 3f4t h GLU 67 N 0.32 1.08 0.00 1.90 4.81 -1.14 0.15 114.58 121.70 3f4t h GLU 67 Ca 0.09 -0.35 -0.23 0.00 -0.13 0.00 0.00 59.36 58.75 3f4t h GLU 67 Cb 0.08 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.37 3f4t h GLU 67 CO -0.01 1.05 -0.96 -0.22 -0.73 0.00 0.00 179.01 178.14 3f4t h LYS 68 N 0.98 0.45 0.00 1.92 3.64 -0.68 -3.39 116.57 119.49 3f4t h LYS 68 Ca 0.17 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3f4t h LYS 68 Cb 0.57 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 3f4t h LYS 68 CO 0.03 1.14 -0.86 0.66 -2.27 0.00 0.00 179.45 178.15 3f4t n TYR 69 N -3.76 0.00 -0.06 1.91 4.01 0.37 -4.60 117.16 115.02 3f4t n TYR 69 Ca -0.07 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.45 3f4t n TYR 69 Cb 0.85 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.75 3f4t n TYR 69 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3f4t n ILE 70 N -1.81 1.63 0.30 -0.72 5.41 -0.61 -0.81 119.36 122.75 3f4t n ILE 70 Ca 0.00 -0.30 0.19 0.00 1.00 0.00 0.00 62.75 63.64 3f4t n ILE 70 Cb 0.43 -1.90 0.87 0.00 -0.71 0.00 0.00 39.64 38.32 3f4t n ILE 70 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3f4t h ASP 71 N -0.56 0.00 -0.19 4.38 3.32 -0.94 -2.63 116.42 119.80 3f4t h ASP 71 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 3f4t h ASP 71 Cb 1.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.17 3f4t h ASP 71 CO -0.10 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 177.77 3f4t n THR 72 N -3.02 0.23 -0.99 0.35 -2.24 -1.26 -4.96 114.28 102.39 3f4t n THR 72 Ca -0.01 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3f4t n THR 72 Cb 0.21 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 3f4t n THR 72 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f4t n GLY 73 N 1.40 0.49 0.07 3.38 0.00 -0.99 -4.91 105.19 104.64 3f4t n GLY 73 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 3f4t n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f4t h LYS 74 N 1.09 0.00 -3.51 1.61 1.57 -1.45 -3.39 116.57 112.49 3f4t h LYS 74 Ca 0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 3f4t h LYS 74 Cb 0.10 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.09 3f4t h LYS 74 CO 0.00 0.87 -0.70 1.41 -0.57 0.00 0.00 179.45 180.46 3f4t s MET 75 N -2.73 0.00 -0.05 3.15 0.00 0.01 -1.83 119.30 117.85 3f4t s MET 75 Ca 0.01 0.18 -0.20 0.00 0.00 0.00 0.00 55.69 55.68 3f4t s MET 75 Cb 0.09 -0.17 -0.05 0.00 0.00 0.00 0.00 34.83 34.70 3f4t s MET 75 CO 0.81 -0.13 0.57 -1.17 0.00 0.00 0.00 175.02 175.10 3f4t s LEU 76 N 0.84 4.36 -0.17 4.11 2.96 0.70 -4.32 118.68 127.16 3f4t s LEU 76 Ca -0.07 1.05 -0.01 0.00 -0.22 0.00 0.00 54.13 54.88 3f4t s LEU 76 Cb -0.10 -2.86 -0.01 0.00 0.50 0.00 0.00 46.19 43.72 3f4t s LEU 76 CO -0.03 0.04 -0.12 -0.47 -1.32 0.00 0.00 176.35 174.45 3f4t s TYR 77 N 0.20 2.84 -0.25 5.38 5.04 0.06 -0.58 117.35 130.04 3f4t s TYR 77 Ca 0.30 -0.96 0.02 0.00 -2.44 0.00 0.00 57.07 54.00 3f4t s TYR 77 Cb -0.17 -1.94 0.06 0.00 0.35 0.00 0.00 41.96 40.26 3f4t s TYR 77 CO 0.15 -0.45 -0.09 0.42 -1.34 0.00 0.00 175.55 174.23 3f4t s ILE 78 N 0.91 1.95 -0.11 3.14 1.01 0.83 -1.12 121.20 127.81 3f4t s ILE 78 Ca -0.03 -1.47 -0.18 0.00 0.00 0.00 0.00 60.65 58.97 3f4t s ILE 78 Cb -0.15 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 3f4t s ILE 78 CO -0.01 -0.03 0.48 0.12 0.00 0.00 0.00 174.94 175.51 3f4t s PHE 79 N 1.20 3.52 -0.05 3.97 5.36 -1.26 -1.00 117.98 129.73 3f4t s PHE 79 Ca -0.07 0.91 0.06 0.00 -0.96 0.00 0.00 56.93 56.87 3f4t s PHE 79 Cb -0.19 -2.56 -0.01 0.00 -0.34 0.00 0.00 43.02 39.92 3f4t s PHE 79 CO -0.06 0.18 -0.24 1.03 -1.46 0.00 0.00 175.22 174.67 3f4t s ARG 80 N 0.59 2.39 0.50 10.12 0.52 0.59 -4.67 118.95 128.98 3f4t s ARG 80 Ca 0.26 -0.88 -0.20 0.00 -0.52 0.00 0.00 55.73 54.40 3f4t s ARG 80 Cb -0.15 -2.07 -0.08 0.00 0.52 0.00 0.00 34.95 33.17 3f4t s ARG 80 CO 0.11 0.40 1.05 -1.01 0.02 0.00 0.00 175.30 175.87 3f4t s HIS 81 N -0.23 2.95 -0.42 -0.53 3.76 -1.26 -2.95 115.29 116.61 3f4t s HIS 81 Ca -0.01 1.57 0.07 0.00 -0.15 0.00 0.00 55.06 56.54 3f4t s HIS 81 Cb -0.13 -3.09 0.24 0.00 1.11 0.00 0.00 32.58 30.72 3f4t s HIS 81 CO 0.03 -0.95 0.63 0.34 -0.85 0.00 0.00 174.74 173.94 3f4t n PHE 82 N -1.12 -1.32 -2.36 1.40 7.35 -1.01 -4.61 117.46 115.80 3f4t n PHE 82 Ca 0.09 -2.99 -0.36 0.00 -0.76 0.00 0.00 57.45 53.43 3f4t n PHE 82 Cb 0.52 0.26 -0.02 0.00 0.35 0.00 0.00 39.48 40.60 3f4t n PHE 82 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 3f4t s PRO 83 N -0.56 3.85 0.00 -7.13 0.02 -1.26 -3.38 135.00 126.53 3f4t s PRO 83 Ca 0.34 1.66 0.00 0.00 0.02 0.00 0.00 61.00 63.02 3f4t s PRO 83 Cb 0.18 -2.39 0.00 0.00 0.02 0.00 0.00 34.50 32.31 3f4t s PRO 83 CO -0.15 -0.44 0.12 1.28 -0.33 0.00 0.00 177.00 177.47 3f4t n LEU 84 N -0.46 0.24 -3.99 -5.54 4.77 -1.26 -4.92 117.00 105.83 3f4t n LEU 84 Ca 0.07 -0.58 -0.13 0.00 -0.03 0.00 0.00 56.01 55.35 3f4t n LEU 84 Cb 0.49 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.56 3f4t n LEU 84 CO 0.46 0.06 0.27 1.51 -1.33 0.00 0.00 177.39 178.36 3f4t s ASP 85 N -0.68 0.58 0.10 -1.43 1.47 -1.26 -5.05 116.67 110.40 3f4t s ASP 85 Ca 0.00 -1.35 -0.26 0.00 1.18 0.00 0.00 52.55 52.13 3f4t s ASP 85 Cb 0.00 0.72 -0.11 0.00 -0.34 0.00 0.00 42.92 43.19 3f4t s ASP 85 CO 0.00 -1.42 1.68 0.22 0.68 0.00 0.00 175.17 176.33 3f4t h TYR 86 N 2.08 -0.42 -0.44 2.11 3.20 -1.99 -1.48 116.97 120.04 3f4t h TYR 86 Ca -0.29 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.66 3f4t h TYR 86 Cb 1.24 0.17 -0.07 0.00 1.54 0.00 0.00 36.73 39.61 3f4t h TYR 86 CO 1.40 -0.24 0.03 0.00 -1.64 0.00 0.00 178.16 177.71 3f4t h ARG 87 N -0.34 0.15 -0.28 1.82 3.08 -1.96 -0.78 114.38 116.07 3f4t h ARG 87 Ca 0.01 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 3f4t h ARG 87 Cb 0.33 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 3f4t h ARG 87 CO -0.06 0.10 -0.48 0.78 -1.07 0.00 0.00 179.97 179.23 3f4t h GLY 88 N 0.15 0.82 0.78 0.04 0.00 -1.93 0.36 103.07 103.30 3f4t h GLY 88 Ca 0.22 -0.91 -0.02 0.00 0.00 0.00 0.00 47.33 46.62 3f4t h GLY 88 CO -0.33 0.81 -0.00 -2.00 0.00 0.00 0.00 176.54 175.02 3f4t h LEU 89 N 0.60 0.26 -1.02 3.11 5.85 -1.10 0.36 115.31 123.36 3f4t h LEU 89 Ca 0.03 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.44 3f4t h LEU 89 Cb 1.05 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.97 3f4t h LEU 89 CO 0.10 0.51 0.63 0.11 -0.34 0.00 0.00 178.44 179.45 3f4t h LYS 90 N 0.00 1.29 -0.45 1.25 1.79 -1.10 0.45 116.57 119.80 3f4t h LYS 90 Ca 0.04 -0.09 -0.04 0.00 -2.18 0.00 0.00 60.65 58.38 3f4t h LYS 90 Cb 0.38 -0.28 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 3f4t h LYS 90 CO 0.01 0.86 0.11 0.00 -1.08 0.00 0.00 179.45 179.35 3f4t h ALA 91 N 1.37 0.60 -0.77 3.86 0.00 -0.82 -0.52 119.26 122.98 3f4t h ALA 91 Ca 0.35 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3f4t h ALA 91 Cb -0.13 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 3f4t h ALA 91 CO -0.07 0.28 0.50 0.00 0.00 0.00 0.00 179.25 179.96 3f4t h ALA 92 N 0.97 1.01 -0.40 0.00 0.00 -0.47 -1.68 119.26 118.69 3f4t h ALA 92 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3f4t h ALA 92 Cb 0.33 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3f4t h ALA 92 CO 0.00 0.31 0.19 0.52 0.00 0.00 0.00 179.25 180.27 3f4t h MET 93 N 0.97 0.58 -0.08 0.00 2.07 -0.71 -2.80 114.93 114.96 3f4t h MET 93 Ca 0.31 -0.09 -0.01 0.00 -2.07 0.00 0.00 59.70 57.84 3f4t h MET 93 Cb -0.01 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 29.62 3f4t h MET 93 CO -0.10 0.52 0.00 1.25 1.07 0.00 0.00 176.91 179.64 3f4t h LEU 94 N 0.51 0.10 -2.50 1.22 5.85 -0.58 -2.21 115.31 117.69 3f4t h LEU 94 Ca 0.14 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.86 3f4t h LEU 94 Cb 0.13 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 3f4t h LEU 94 CO -0.02 0.12 0.05 0.77 -0.34 0.00 0.00 178.44 179.02 3f4t h SER 95 N 0.11 0.00 0.67 1.25 4.64 -1.04 -0.70 113.55 118.48 3f4t h SER 95 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3f4t h SER 95 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3f4t h SER 95 CO 0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 3f4t n HIS 96 N -3.68 0.10 0.64 4.77 8.25 -0.83 -1.66 115.22 122.81 3f4t n HIS 96 Ca -0.02 0.04 0.10 0.00 -0.26 0.00 0.00 57.72 57.58 3f4t n HIS 96 Cb 0.13 -0.56 0.43 0.00 1.12 0.00 0.00 29.99 31.11 3f4t n HIS 96 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3f4t n ALA 97 N -1.53 1.90 -3.38 -1.41 0.00 -0.27 -4.61 120.51 111.21 3f4t n ALA 97 Ca 0.04 -0.04 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 3f4t n ALA 97 Cb 0.22 -1.34 -0.11 0.00 0.00 0.00 0.00 19.45 18.23 3f4t n ALA 97 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3f4t s TYR 98 N -3.05 3.36 -0.11 0.00 2.02 -0.66 -4.99 117.35 113.93 3f4t s TYR 98 Ca 0.09 -1.68 -0.20 0.00 -0.37 0.00 0.00 57.07 54.91 3f4t s TYR 98 Cb 0.12 -2.86 -0.27 0.00 -0.40 0.00 0.00 41.96 38.55 3f4t s TYR 98 CO 0.38 -0.85 0.63 0.93 -1.57 0.00 0.00 175.55 175.07 3f4t h GLU 99 N 8.30 0.19 -6.91 -0.62 5.08 -1.85 -3.36 114.58 115.42 3f4t h GLU 99 Ca -0.21 -0.33 -0.53 0.00 -1.00 0.00 0.00 59.36 57.29 3f4t h GLU 99 Cb 1.08 0.12 0.08 0.00 0.50 0.00 0.00 28.75 30.53 3f4t h GLU 99 CO 0.71 1.16 0.67 0.15 -1.00 0.00 0.00 179.01 180.70 3f4t s LYS 100 N -2.41 4.23 0.22 2.33 1.02 -1.26 -4.81 119.74 119.05 3f4t s LYS 100 Ca -0.19 2.30 -0.07 0.00 0.02 0.00 0.00 55.97 58.02 3f4t s LYS 100 Cb 0.03 -2.99 0.34 0.00 -0.52 0.00 0.00 37.83 34.68 3f4t s LYS 100 CO 0.75 -0.33 1.75 -0.56 -0.92 0.00 0.00 175.35 176.04 3f4t h GLN 101 N 3.16 0.46 -0.08 1.68 3.07 -1.89 0.63 115.11 122.15 3f4t h GLN 101 Ca -0.50 -0.03 -0.11 0.00 0.09 0.00 0.00 58.65 58.11 3f4t h GLN 101 Cb 1.23 -0.10 -0.01 0.00 0.08 0.00 0.00 27.48 28.68 3f4t h GLN 101 CO 0.65 0.30 -0.46 0.93 0.09 0.00 0.00 178.83 180.34 3f4t h GLU 102 N 0.47 0.19 -0.33 0.06 4.39 -1.91 -2.09 114.58 115.36 3f4t h GLU 102 Ca 0.34 -0.10 -0.13 0.00 0.34 0.00 0.00 59.36 59.82 3f4t h GLU 102 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 3f4t h GLU 102 CO -0.32 0.61 -0.31 -0.44 -1.16 0.00 0.00 179.01 177.39 3f4t h ASP 103 N 0.15 0.85 0.11 1.42 3.32 -1.50 -0.44 116.42 120.34 3f4t h ASP 103 Ca 0.01 -0.46 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 3f4t h ASP 103 Cb 0.87 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.18 3f4t h ASP 103 CO 0.07 1.13 -0.05 0.22 -1.72 0.00 0.00 179.24 178.89 3f4t h TYR 104 N 0.57 -0.14 -0.62 4.55 3.20 -0.85 -0.85 116.97 122.83 3f4t h TYR 104 Ca 0.06 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.94 3f4t h TYR 104 Cb 0.89 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 3f4t h TYR 104 CO 0.07 -0.08 0.40 0.35 -1.64 0.00 0.00 178.16 177.25 3f4t h PHE 105 N -0.15 0.75 0.00 -3.82 3.57 -1.37 -2.42 116.94 113.49 3f4t h PHE 105 Ca -0.02 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 3f4t h PHE 105 Cb 0.12 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3f4t h PHE 105 CO -0.07 0.45 -0.33 -0.91 -2.23 0.00 0.00 178.31 175.22 3f4t h ASN 106 N 0.80 0.00 0.06 0.41 2.35 -0.91 -0.59 115.58 117.69 3f4t h ASN 106 Ca 0.24 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3f4t h ASN 106 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3f4t h ASN 106 CO -0.07 0.33 -0.03 0.15 -1.65 0.00 0.00 177.43 176.16 3f4t h PHE 107 N 0.00 -0.07 -0.79 1.19 3.57 -0.79 -1.38 116.94 118.67 3f4t h PHE 107 Ca -0.00 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3f4t h PHE 107 Cb 0.59 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 3f4t h PHE 107 CO 0.00 0.23 0.47 -0.91 -2.23 0.00 0.00 178.31 175.87 3f4t h ASN 108 N -0.38 0.94 -0.74 0.41 2.35 -1.21 -1.65 115.58 115.31 3f4t h ASN 108 Ca -0.01 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 3f4t h ASN 108 Cb 0.33 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.43 3f4t h ASN 108 CO 0.01 0.72 0.48 0.50 -1.65 0.00 0.00 177.43 177.50 3f4t h LYS 109 N 1.08 0.98 -0.67 0.81 3.64 -1.06 -1.09 116.57 120.27 3f4t h LYS 109 Ca 0.28 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 3f4t h LYS 109 Cb -0.04 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.53 3f4t h LYS 109 CO -0.05 0.66 0.12 0.00 -2.27 0.00 0.00 179.45 177.91 3f4t h ALA 110 N 1.26 0.95 -0.21 5.00 0.00 -0.54 0.19 119.26 125.91 3f4t h ALA 110 Ca 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3f4t h ALA 110 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3f4t h ALA 110 CO -0.06 0.66 0.03 0.28 0.00 0.00 0.00 179.25 180.16 3f4t h VAL 111 N 1.03 1.23 -0.23 0.00 2.07 -0.94 -1.90 116.25 117.51 3f4t h VAL 111 Ca 0.21 -0.76 0.05 0.00 0.82 0.00 0.00 66.70 67.01 3f4t h VAL 111 Cb 0.42 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3f4t h VAL 111 CO 0.01 0.24 -0.05 -0.26 0.02 0.00 0.00 177.57 177.52 3f4t h PHE 112 N 0.13 -0.12 -0.08 1.57 0.04 -1.08 -2.64 116.94 114.77 3f4t h PHE 112 Ca 0.06 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.87 3f4t h PHE 112 Cb 0.33 0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.56 3f4t h PHE 112 CO 0.02 -0.09 0.06 -0.91 -0.60 0.00 0.00 178.31 176.79 3f4t h ASN 113 N 0.00 0.00 -0.54 2.17 2.35 -0.74 -2.75 115.58 116.08 3f4t h ASN 113 Ca 0.11 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.67 3f4t h ASN 113 Cb 0.16 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.42 3f4t h ASN 113 CO -0.23 0.00 0.15 -1.54 -1.65 0.00 0.00 177.43 174.16 3f4t n SER 114 N -4.42 3.82 -0.24 5.81 3.41 -0.73 -4.67 113.62 116.59 3f4t n SER 114 Ca -0.01 -3.37 0.18 0.00 -0.26 0.00 0.00 58.87 55.40 3f4t n SER 114 Cb 0.17 -0.68 0.49 0.00 -0.26 0.00 0.00 64.21 63.93 3f4t n SER 114 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3f4t h ILE 115 N 1.80 0.71 0.00 -1.33 2.10 -1.38 0.11 117.51 119.51 3f4t h ILE 115 Ca 0.23 -0.15 0.00 0.00 1.08 0.00 0.00 64.86 66.02 3f4t h ILE 115 Cb 1.99 0.22 0.00 0.00 -1.09 0.00 0.00 36.82 37.94 3f4t h ILE 115 CO 0.55 0.08 0.00 0.47 -1.08 0.00 0.00 178.15 178.18 3f4t n ASP 116 N -4.52 0.46 -0.87 2.19 9.92 -1.26 -3.22 116.55 119.24 3f4t n ASP 116 Ca 0.19 0.66 0.12 0.00 -0.53 0.00 0.00 54.79 55.23 3f4t n ASP 116 Cb 0.65 -0.74 0.12 0.00 -0.64 0.00 0.00 41.12 40.51 3f4t n ASP 116 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 3f4t n SER 117 N -2.06 2.78 -4.64 -2.24 7.64 0.02 -4.93 113.62 110.19 3f4t n SER 117 Ca 0.01 -1.90 -0.30 0.00 1.01 0.00 0.00 58.87 57.68 3f4t n SER 117 Cb 0.11 0.06 0.18 0.00 -1.01 0.00 0.00 64.21 63.54 3f4t n SER 117 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3f4t s TRP 118 N -2.06 1.82 -0.47 1.43 0.52 -1.20 -4.70 118.94 114.28 3f4t s TRP 118 Ca 0.28 1.45 -0.21 0.00 0.02 0.00 0.00 56.10 57.64 3f4t s TRP 118 Cb 0.20 -3.20 0.03 0.00 -1.15 0.00 0.00 33.47 29.36 3f4t s TRP 118 CO 0.34 -2.91 0.68 1.21 0.02 0.00 0.00 176.95 176.28 3f4t s ASN 119 N -2.90 6.30 0.00 2.95 3.84 -1.26 -4.92 114.94 118.95 3f4t s ASN 119 Ca 0.66 -0.48 0.30 0.00 0.21 0.00 0.00 52.86 53.55 3f4t s ASN 119 Cb -0.22 -2.33 1.50 0.00 -0.55 0.00 0.00 41.25 39.66 3f4t s ASN 119 CO 0.59 -0.87 2.00 -1.22 -2.79 0.00 0.00 177.10 174.81 3f4t n TYR 120 N 6.41 0.00 -0.13 0.43 4.01 -1.26 -3.87 117.16 122.75 3f4t n TYR 120 Ca -0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.47 3f4t n TYR 120 Cb 0.47 -0.03 -0.08 0.00 -0.31 0.00 0.00 39.34 39.39 3f4t n TYR 120 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3f4t n TYR 121 N -0.56 0.00 -3.25 -0.72 9.36 -1.26 -4.76 117.16 115.97 3f4t n TYR 121 Ca 0.21 0.00 -0.46 0.00 3.32 0.00 0.00 57.90 60.97 3f4t n TYR 121 Cb 0.22 -0.87 -0.04 0.00 -0.63 0.00 0.00 39.34 38.02 3f4t n TYR 121 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3f4t s ASN 122 N -7.13 6.35 0.00 2.98 3.84 -1.25 -4.91 114.94 114.82 3f4t s ASN 122 Ca -0.36 -1.93 0.22 0.00 0.21 0.00 0.00 52.86 51.00 3f4t s ASN 122 Cb 0.12 -2.24 1.20 0.00 -0.55 0.00 0.00 41.25 39.78 3f4t s ASN 122 CO 0.46 -0.87 1.70 0.18 -2.79 0.00 0.00 177.10 175.79 3f4t n LEU 123 N 5.28 0.00 -0.63 3.21 4.77 -1.25 -1.94 117.00 126.43 3f4t n LEU 123 Ca -0.04 0.16 0.12 0.00 -0.03 0.00 0.00 56.01 56.21 3f4t n LEU 123 Cb 0.43 -0.16 0.10 0.00 -2.33 0.00 0.00 43.42 41.46 3f4t n LEU 123 CO 0.50 -0.05 0.48 -1.20 -1.33 0.00 0.00 177.39 175.80 3f4t n SER 124 N -1.16 2.22 -4.62 -1.43 7.64 -1.26 -4.19 113.62 110.82 3f4t n SER 124 Ca 0.13 -1.62 -0.43 0.00 1.01 0.00 0.00 58.87 57.97 3f4t n SER 124 Cb 0.13 0.26 -0.02 0.00 -1.01 0.00 0.00 64.21 63.56 3f4t n SER 124 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3f4t s ASP 125 N -2.29 6.42 -0.21 6.43 -1.08 -0.82 -4.90 116.67 120.22 3f4t s ASP 125 Ca 0.23 1.24 0.15 0.00 -0.52 0.00 0.00 52.55 53.65 3f4t s ASP 125 Cb 0.19 -2.54 0.73 0.00 -1.46 0.00 0.00 42.92 39.84 3f4t s ASP 125 CO 0.46 -1.28 1.64 0.18 0.52 0.00 0.00 175.17 176.69 3f4t n LEU 126 N 8.43 5.12 -0.34 -1.34 4.77 -1.26 -4.55 117.00 127.83 3f4t n LEU 126 Ca 0.17 -2.95 0.19 0.00 -0.03 0.00 0.00 56.01 53.39 3f4t n LEU 126 Cb 0.47 -0.64 0.42 0.00 -2.33 0.00 0.00 43.42 41.34 3f4t n LEU 126 CO 0.66 0.65 1.18 0.74 -1.33 0.00 0.00 177.39 179.29 3f4t h THR 127 N 3.30 0.54 -0.64 -5.08 2.02 -1.96 -0.90 112.91 110.19 3f4t h THR 127 Ca 0.00 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.01 3f4t h THR 127 Cb 1.80 -0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 3f4t h THR 127 CO 0.40 0.10 0.42 0.25 0.37 0.00 0.00 175.52 177.05 3f4t h LEU 128 N 0.54 0.71 -0.98 2.58 5.85 -1.84 0.26 115.31 122.43 3f4t h LEU 128 Ca 0.63 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 59.26 3f4t h LEU 128 Cb 1.29 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 3f4t h LEU 128 CO -0.41 0.51 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.05 3f4t h LEU 129 N 0.84 0.64 -0.83 2.25 3.38 -1.55 -0.51 115.31 119.53 3f4t h LEU 129 Ca 0.24 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3f4t h LEU 129 Cb -0.06 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3f4t h LEU 129 CO -0.07 0.76 0.55 1.56 0.09 0.00 0.00 178.44 181.33 3f4t h GLN 130 N 0.61 1.09 -0.36 1.13 4.20 -0.82 0.13 115.11 121.09 3f4t h GLN 130 Ca 0.11 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 3f4t h GLN 130 Cb 0.49 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3f4t h GLN 130 CO 0.03 0.72 0.01 -0.09 -0.67 0.00 0.00 178.83 178.83 3f4t h ARG 131 N 1.12 0.63 -0.64 1.46 2.43 -0.35 -1.56 114.38 117.47 3f4t h ARG 131 Ca 0.31 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 3f4t h ARG 131 Cb -0.12 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 3f4t h ARG 131 CO -0.07 0.73 0.13 0.82 -1.51 0.00 0.00 179.97 180.07 3f4t h ILE 132 N 0.45 1.26 -0.08 1.20 2.04 -0.87 -1.44 117.51 120.07 3f4t h ILE 132 Ca 0.10 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.99 3f4t h ILE 132 Cb 0.44 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3f4t h ILE 132 CO 0.02 0.36 0.05 0.00 0.00 0.00 0.00 178.15 178.58 3f4t h ALA 133 N 1.05 0.11 -0.44 1.87 0.00 -0.64 -2.34 119.26 118.88 3f4t h ALA 133 Ca 0.20 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.13 3f4t h ALA 133 Cb 0.39 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3f4t h ALA 133 CO 0.01 -0.38 0.18 0.00 0.00 0.00 0.00 179.25 179.05 3f4t h ALA 134 N 1.00 0.53 0.00 0.00 0.00 -1.11 -1.26 119.26 118.42 3f4t h ALA 134 Ca 0.03 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3f4t h ALA 134 Cb 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3f4t h ALA 134 CO -0.01 -0.20 -0.10 -0.07 0.00 0.00 0.00 179.25 178.87 3f4t h LEU 135 N 0.37 0.00 -2.53 0.00 3.38 -1.12 -1.72 115.31 113.69 3f4t h LEU 135 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3f4t h LEU 135 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3f4t h LEU 135 CO -0.18 0.10 0.00 -1.54 0.09 0.00 0.00 178.44 176.91 3f4t n SER 136 N -3.81 3.73 -2.35 -0.43 3.41 -0.87 -4.96 113.62 108.34 3f4t n SER 136 Ca -0.02 -2.00 -0.19 0.00 -0.26 0.00 0.00 58.87 56.40 3f4t n SER 136 Cb 0.20 -0.37 0.01 0.00 -0.26 0.00 0.00 64.21 63.79 3f4t n SER 136 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3f4t n ASN 137 N 1.60 -5.50 -4.67 4.04 3.02 -0.65 -4.96 115.26 108.13 3f4t n ASN 137 Ca 0.22 -0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 54.24 3f4t n ASN 137 Cb 0.62 -4.47 -0.03 0.00 -0.61 0.00 0.00 39.78 35.29 3f4t n ASN 137 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3f4t s LEU 138 N -5.61 4.18 0.71 3.41 2.96 -0.55 -5.02 118.68 118.74 3f4t s LEU 138 Ca 0.10 1.38 -0.16 0.00 -0.22 0.00 0.00 54.13 55.24 3f4t s LEU 138 Cb -0.05 -3.46 0.03 0.00 0.50 0.00 0.00 46.19 43.21 3f4t s LEU 138 CO 0.13 -0.51 1.21 -0.54 -1.32 0.00 0.00 176.35 175.32 3f4t s LYS 139 N 2.45 2.28 0.31 1.98 1.02 -1.26 -4.58 119.74 121.94 3f4t s LYS 139 Ca 0.44 1.78 -0.01 0.00 0.02 0.00 0.00 55.97 58.20 3f4t s LYS 139 Cb -0.17 -1.85 0.47 0.00 -0.52 0.00 0.00 37.83 35.77 3f4t s LYS 139 CO 0.12 -1.73 1.97 0.37 -0.92 0.00 0.00 175.35 175.16 3f4t h GLN 140 N -0.09 1.05 -0.47 1.68 5.75 -1.98 -0.27 115.11 120.78 3f4t h GLN 140 Ca -0.48 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 57.86 3f4t h GLN 140 Cb 1.30 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 29.59 3f4t h GLN 140 CO 0.51 0.70 -0.10 0.38 -2.65 0.00 0.00 178.83 177.67 3f4t h ASP 141 N 1.08 0.84 -0.39 -0.69 3.04 -1.99 0.31 116.42 118.61 3f4t h ASP 141 Ca 0.30 -0.25 -0.14 0.00 -3.24 0.00 0.00 57.03 53.69 3f4t h ASP 141 Cb -0.12 -0.23 -0.01 0.00 -1.04 0.00 0.00 39.33 37.94 3f4t h ASP 141 CO -0.07 0.96 -0.30 0.00 -2.04 0.00 0.00 179.24 177.79 3f4t h ALA 142 N 1.12 0.67 0.25 4.15 0.00 -1.80 -1.22 119.26 122.43 3f4t h ALA 142 Ca 0.13 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3f4t h ALA 142 Cb 0.60 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3f4t h ALA 142 CO 0.04 0.67 -0.16 0.35 0.00 0.00 0.00 179.25 180.15 3f4t h PHE 143 N 0.78 -0.43 -0.49 0.00 3.57 -0.81 -1.87 116.94 117.70 3f4t h PHE 143 Ca 0.08 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3f4t h PHE 143 Cb 0.88 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 3f4t h PHE 143 CO 0.05 -0.26 0.06 -0.91 -2.23 0.00 0.00 178.31 175.02 3f4t h ASN 144 N -0.41 0.73 -0.15 0.41 2.35 -0.88 -1.53 115.58 116.10 3f4t h ASN 144 Ca -0.02 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 3f4t h ASN 144 Cb 0.35 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3f4t h ASN 144 CO 0.02 0.76 0.06 -0.61 -1.65 0.00 0.00 177.43 176.01 3f4t h GLN 145 N 0.73 0.22 -0.46 0.81 4.15 -1.17 -3.01 115.11 116.38 3f4t h GLN 145 Ca 0.15 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.48 3f4t h GLN 145 Cb 0.36 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 3f4t h GLN 145 CO 0.01 0.30 0.08 0.00 -1.93 0.00 0.00 178.83 177.29 3f4t h ALA 146 N 0.90 0.61 0.00 3.38 0.00 -0.96 -2.27 119.26 120.92 3f4t h ALA 146 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3f4t h ALA 146 Cb 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3f4t h ALA 146 CO -0.00 0.34 0.00 1.51 0.00 0.00 0.00 179.25 181.09 3f4t n ILE 147 N -4.46 0.84 -0.28 0.00 0.13 -0.61 -2.58 119.36 112.41 3f4t n ILE 147 Ca 0.01 0.20 0.02 0.00 -1.10 0.00 0.00 62.75 61.87 3f4t n ILE 147 Cb 0.25 -1.06 0.02 0.00 -0.84 0.00 0.00 39.64 38.00 3f4t n ILE 147 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 3f4t n ASN 148 N -2.01 1.86 -4.56 9.51 3.02 -1.12 -4.97 115.26 116.99 3f4t n ASN 148 Ca 0.03 -2.08 -0.41 0.00 -0.03 0.00 0.00 54.58 52.09 3f4t n ASN 148 Cb 0.23 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.30 3f4t n ASN 148 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3f4t s ASP 149 N -1.20 6.08 0.30 6.41 -1.08 -0.87 -4.88 116.67 121.43 3f4t s ASP 149 Ca 0.05 -0.09 -0.01 0.00 -0.52 0.00 0.00 52.55 51.98 3f4t s ASP 149 Cb 0.04 -2.55 0.46 0.00 -1.46 0.00 0.00 42.92 39.41 3f4t s ASP 149 CO 0.00 -1.83 1.91 0.50 0.52 0.00 0.00 175.17 176.27 3f4t h LYS 150 N 10.86 0.91 -0.86 4.34 3.64 -1.91 -0.88 116.57 132.67 3f4t h LYS 150 Ca -0.27 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 3f4t h LYS 150 Cb 1.08 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.68 3f4t h LYS 150 CO 1.23 0.70 0.56 0.87 -2.27 0.00 0.00 179.45 180.54 3f4t h LYS 151 N 0.91 1.14 -0.24 1.90 1.57 -1.99 0.31 116.57 120.17 3f4t h LYS 151 Ca 0.22 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.77 3f4t h LYS 151 Cb 0.08 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.14 3f4t h LYS 151 CO -0.03 0.77 -0.45 0.82 -0.57 0.00 0.00 179.45 179.99 3f4t h ILE 152 N 1.17 1.30 -0.36 1.86 1.08 -1.83 -2.23 117.51 118.50 3f4t h ILE 152 Ca 0.31 -1.66 0.06 0.00 -0.39 0.00 0.00 64.86 63.18 3f4t h ILE 152 Cb -0.11 1.76 -0.05 0.00 -3.07 0.00 0.00 36.82 35.35 3f4t h ILE 152 CO -0.07 0.53 0.06 -0.03 -0.69 0.00 0.00 178.15 177.95 3f4t h MET 153 N 0.46 0.17 -0.75 2.37 4.05 -0.86 -1.35 114.93 119.01 3f4t h MET 153 Ca 0.01 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 3f4t h MET 153 Cb 1.06 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.78 3f4t h MET 153 CO 0.10 0.11 0.49 -0.44 0.23 0.00 0.00 176.91 177.41 3f4t h ASP 154 N 0.18 0.86 -0.19 1.39 3.32 -0.89 -1.31 116.42 119.78 3f4t h ASP 154 Ca 0.17 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.20 3f4t h ASP 154 Cb 0.21 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3f4t h ASP 154 CO -0.24 0.63 0.11 0.50 -1.72 0.00 0.00 179.24 178.52 3f4t h LYS 155 N 1.02 0.23 -0.01 3.56 3.64 -1.06 0.93 116.57 124.88 3f4t h LYS 155 Ca 0.27 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.65 3f4t h LYS 155 Cb -0.11 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 3f4t h LYS 155 CO -0.06 0.15 -0.02 0.82 -2.27 0.00 0.00 179.45 178.07 3f4t h ILE 156 N 0.24 0.94 -0.12 2.00 2.04 -0.92 -0.21 117.51 121.47 3f4t h ILE 156 Ca 0.07 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.81 3f4t h ILE 156 Cb -0.01 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3f4t h ILE 156 CO -0.03 0.00 -0.45 -0.37 0.00 0.00 0.00 178.15 177.30 3f4t h VAL 157 N -0.04 1.33 -0.50 1.67 -1.51 -1.12 -1.43 116.25 114.64 3f4t h VAL 157 Ca 0.01 -1.64 -0.09 0.00 -1.23 0.00 0.00 66.70 63.75 3f4t h VAL 157 Cb 0.06 1.73 -0.02 0.00 -2.13 0.00 0.00 31.29 30.93 3f4t h VAL 157 CO -0.03 0.49 -0.05 0.78 -1.23 0.00 0.00 177.57 177.53 3f4t h ASN 158 N 0.25 0.92 -0.31 4.19 -0.26 -0.62 -0.61 115.58 119.14 3f4t h ASN 158 Ca 0.02 -0.33 -0.06 0.00 -0.56 0.00 0.00 56.30 55.36 3f4t h ASN 158 Cb 0.90 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.89 3f4t h ASN 158 CO 0.07 1.03 -0.01 0.44 -1.06 0.00 0.00 177.43 177.90 3f4t h ASP 159 N 0.79 0.62 -0.12 5.81 3.32 -0.86 -0.57 116.42 125.40 3f4t h ASP 159 Ca 0.14 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3f4t h ASP 159 Cb 0.59 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 3f4t h ASP 159 CO 0.04 0.70 -0.00 0.50 -1.72 0.00 0.00 179.24 178.75 3f4t h LYS 160 N 0.62 0.22 -0.63 3.56 3.64 -1.10 -2.03 116.57 120.85 3f4t h LYS 160 Ca 0.13 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.38 3f4t h LYS 160 Cb 0.40 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 3f4t h LYS 160 CO 0.02 0.47 0.18 0.66 -2.27 0.00 0.00 179.45 178.50 3f4t h SER 161 N -0.05 0.90 -0.62 4.20 4.64 -0.90 -0.71 113.55 121.01 3f4t h SER 161 Ca 0.03 -0.16 0.05 0.00 -0.47 0.00 0.00 61.79 61.24 3f4t h SER 161 Cb 0.37 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 62.17 3f4t h SER 161 CO 0.01 0.85 0.34 0.25 -0.87 0.00 0.00 176.83 177.41 3f4t h LEU 162 N 0.93 0.52 -0.65 5.97 5.85 -1.08 0.13 115.31 126.97 3f4t h LEU 162 Ca 0.20 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 3f4t h LEU 162 Cb 0.29 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 3f4t h LEU 162 CO -0.01 0.35 -0.17 0.00 -0.34 0.00 0.00 178.44 178.27 3f4t h ALA 163 N 1.31 0.85 -0.22 1.25 0.00 -0.88 0.39 119.26 121.96 3f4t h ALA 163 Ca 0.27 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3f4t h ALA 163 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3f4t h ALA 163 CO -0.16 0.64 0.12 0.82 0.00 0.00 0.00 179.25 180.68 3f4t h ILE 164 N 0.77 1.10 -0.09 0.00 2.04 -0.69 -0.04 117.51 120.61 3f4t h ILE 164 Ca 0.12 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 3f4t h ILE 164 Cb 0.70 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3f4t h ILE 164 CO 0.05 0.10 -0.13 0.78 0.00 0.00 0.00 178.15 178.96 3f4t h ASN 165 N 0.25 0.26 0.91 1.72 2.35 -0.57 -2.83 115.58 117.67 3f4t h ASN 165 Ca 0.08 -0.53 -0.05 0.00 -0.55 0.00 0.00 56.30 55.25 3f4t h ASN 165 Cb 0.05 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 3f4t h ASN 165 CO -0.01 0.74 -1.12 0.29 -1.65 0.00 0.00 177.43 175.67 3f4t n LYS 166 N -4.62 0.61 0.00 0.81 4.76 0.14 -4.36 118.16 115.49 3f4t n LYS 166 Ca -0.07 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 3f4t n LYS 166 Cb 0.36 -1.82 0.00 0.00 -1.84 0.00 0.00 35.03 31.72 3f4t n LYS 166 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3f4t n LEU 167 N -2.74 0.62 -3.33 -0.35 4.77 -0.06 -4.47 117.00 111.43 3f4t n LEU 167 Ca -0.03 -0.79 -0.20 0.00 -0.03 0.00 0.00 56.01 54.96 3f4t n LEU 167 Cb 0.64 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.80 3f4t n LEU 167 CO 0.41 0.16 0.19 0.61 -1.33 0.00 0.00 177.39 177.42 3f4t n GLY 168 N 0.34 -0.39 3.75 -0.72 0.00 -1.00 -4.98 105.19 102.20 3f4t n GLY 168 Ca 0.00 0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3f4t n GLY 168 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f4t s ILE 169 N -3.31 4.85 0.12 -0.61 1.01 -1.21 -4.94 121.20 117.11 3f4t s ILE 169 Ca 0.37 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.43 3f4t s ILE 169 Cb -0.16 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.30 3f4t s ILE 169 CO 0.68 0.38 0.00 0.35 0.00 0.00 0.00 174.94 176.35 3f4t n THR 170 N 2.85 0.49 -3.69 2.92 -2.24 -1.26 -4.57 114.28 108.78 3f4t n THR 170 Ca -0.05 0.16 -0.28 0.00 -2.27 0.00 0.00 64.05 61.62 3f4t n THR 170 Cb 0.51 -0.96 -0.03 0.00 -2.10 0.00 0.00 70.33 67.74 3f4t n THR 170 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f4t s ALA 171 N -2.00 3.83 0.23 6.98 0.00 -1.26 -5.12 121.76 124.42 3f4t s ALA 171 Ca 0.00 -0.81 0.10 0.00 0.00 0.00 0.00 51.96 51.25 3f4t s ALA 171 Cb 0.00 -2.01 -0.05 0.00 0.00 0.00 0.00 23.12 21.07 3f4t s ALA 171 CO 0.00 0.45 -0.18 0.95 0.00 0.00 0.00 175.76 176.98 3f4t s THR 172 N -1.85 2.14 0.53 0.00 -4.23 -1.26 -4.45 115.64 106.51 3f4t s THR 172 Ca 0.39 -2.24 -0.16 0.00 -1.18 0.00 0.00 61.69 58.50 3f4t s THR 172 Cb -0.11 -2.14 -0.07 0.00 1.34 0.00 0.00 72.50 71.52 3f4t s THR 172 CO 0.29 -0.42 1.00 -2.16 -0.54 0.00 0.00 174.62 172.79 3f4t s PRO 173 N -3.36 3.84 -0.03 3.99 0.05 -1.26 -4.77 135.00 133.46 3f4t s PRO 173 Ca 0.25 0.97 0.05 0.00 0.05 0.00 0.00 61.00 62.32 3f4t s PRO 173 Cb -0.04 -2.12 -0.01 0.00 0.05 0.00 0.00 34.50 32.38 3f4t s PRO 173 CO 0.11 -0.37 -0.18 0.42 0.05 0.00 0.00 177.00 177.03 3f4t s ILE 174 N -2.65 1.48 -0.03 0.56 -1.09 -0.69 -0.82 121.20 117.96 3f4t s ILE 174 Ca 0.59 -0.78 0.07 0.00 -2.23 0.00 0.00 60.65 58.30 3f4t s ILE 174 Cb -0.11 -1.25 -0.01 0.00 -1.58 0.00 0.00 42.46 39.51 3f4t s ILE 174 CO 0.34 0.42 -0.23 -0.36 -1.23 0.00 0.00 174.94 173.88 3f4t s PHE 175 N -0.25 2.08 -0.17 3.97 0.08 0.11 -1.00 117.98 122.81 3f4t s PHE 175 Ca 0.03 -0.47 -0.01 0.00 0.12 0.00 0.00 56.93 56.60 3f4t s PHE 175 Cb -0.09 -1.35 -0.00 0.00 -0.57 0.00 0.00 43.02 41.00 3f4t s PHE 175 CO 0.01 -0.09 -0.13 -0.06 -0.10 0.00 0.00 175.22 174.85 3f4t s PHE 176 N -0.39 2.83 -0.14 0.36 0.08 0.70 -0.28 117.98 121.14 3f4t s PHE 176 Ca 0.05 -1.00 0.00 0.00 0.12 0.00 0.00 56.93 56.10 3f4t s PHE 176 Cb -0.10 -1.93 0.02 0.00 -0.57 0.00 0.00 43.02 40.44 3f4t s PHE 176 CO 0.00 -0.47 -0.12 0.42 -0.10 0.00 0.00 175.22 174.95 3f4t s ILE 177 N 0.93 1.41 0.26 0.64 1.01 -0.68 -0.76 121.20 124.00 3f4t s ILE 177 Ca -0.03 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 59.92 3f4t s ILE 177 Cb -0.15 -1.37 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 3f4t s ILE 177 CO -0.01 0.40 0.51 -1.59 0.00 0.00 0.00 174.94 174.25 3f4t s LYS 178 N 1.55 1.60 0.21 2.79 -2.85 -0.48 -4.80 119.74 117.76 3f4t s LYS 178 Ca 0.04 -1.24 -0.31 0.00 -1.00 0.00 0.00 55.97 53.46 3f4t s LYS 178 Cb -0.13 0.49 -0.11 0.00 -2.06 0.00 0.00 37.83 36.02 3f4t s LYS 178 CO -0.10 -0.67 1.64 -0.51 0.10 0.00 0.00 175.35 175.80 3f4t s LEU 179 N -3.01 4.37 -1.17 2.77 1.02 -1.26 -0.22 118.68 121.17 3f4t s LEU 179 Ca 0.21 2.80 -0.08 0.00 0.02 0.00 0.00 54.13 57.08 3f4t s LEU 179 Cb -0.01 -3.61 -0.07 0.00 0.02 0.00 0.00 46.19 42.52 3f4t s LEU 179 CO 0.09 -0.90 2.39 -3.20 0.02 0.00 0.00 176.35 174.75 3f4t n ASN 180 N 3.54 6.01 -4.07 2.29 5.15 -0.26 -4.67 115.26 123.26 3f4t n ASN 180 Ca 0.13 -2.45 -0.31 0.00 -0.60 0.00 0.00 54.58 51.35 3f4t n ASN 180 Cb 0.37 -1.27 -0.16 0.00 -0.53 0.00 0.00 39.78 38.18 3f4t n ASN 180 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3f4t s ASP 181 N 3.09 2.87 0.44 1.20 2.15 -1.26 -4.91 116.67 120.26 3f4t s ASP 181 Ca 0.51 -0.56 0.25 0.00 0.43 0.00 0.00 52.55 53.18 3f4t s ASP 181 Cb 0.13 -1.31 0.72 0.00 -0.30 0.00 0.00 42.92 42.16 3f4t s ASP 181 CO -0.04 -0.02 1.74 0.44 -0.17 0.00 0.00 175.17 177.12 3f4t h ASP 182 N 7.93 0.00 -0.03 -0.34 5.19 -1.98 -3.21 116.42 123.97 3f4t h ASP 182 Ca -0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 3f4t h ASP 182 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 3f4t h ASP 182 CO 0.57 0.15 0.00 0.29 -3.12 0.00 0.00 179.24 177.13 3f4t n LYS 183 N -3.20 1.56 -3.85 3.56 5.02 -1.26 -4.91 118.16 115.08 3f4t n LYS 183 Ca 0.02 -0.82 -0.31 0.00 -2.02 0.00 0.00 58.31 55.17 3f4t n LYS 183 Cb 0.48 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.98 3f4t n LYS 183 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3f4t s SER 184 N -1.94 6.40 -0.18 4.39 0.15 -1.22 -5.10 113.70 116.21 3f4t s SER 184 Ca 0.39 0.37 -0.05 0.00 0.70 0.00 0.00 55.95 57.36 3f4t s SER 184 Cb 0.21 -2.00 -0.03 0.00 -1.71 0.00 0.00 66.02 62.49 3f4t s SER 184 CO 0.33 0.15 -0.01 -0.47 1.20 0.00 0.00 173.24 174.44 3f4t s TYR 185 N -1.53 3.05 -0.07 3.44 5.04 -1.26 -5.06 117.35 120.96 3f4t s TYR 185 Ca 0.36 -0.34 -0.04 0.00 -2.44 0.00 0.00 57.07 54.61 3f4t s TYR 185 Cb -0.13 -2.04 0.03 0.00 0.35 0.00 0.00 41.96 40.18 3f4t s TYR 185 CO 0.26 -0.12 0.17 -1.50 -1.34 0.00 0.00 175.55 173.03 3f4t s ILE 186 N 0.69 -0.03 0.11 3.14 -1.16 -1.26 -5.13 121.20 117.56 3f4t s ILE 186 Ca -0.01 0.12 -0.31 0.00 -0.51 0.00 0.00 60.65 59.94 3f4t s ILE 186 Cb -0.14 -0.27 -0.08 0.00 0.61 0.00 0.00 42.46 42.58 3f4t s ILE 186 CO 0.02 0.05 1.40 -0.70 -2.81 0.00 0.00 174.94 172.90 3f4t s GLU 187 N 0.88 4.31 0.31 3.50 -6.30 -1.26 -4.83 118.70 115.31 3f4t s GLU 187 Ca -0.06 2.08 0.01 0.00 -2.50 0.00 0.00 54.97 54.50 3f4t s GLU 187 Cb -0.08 -3.27 0.56 0.00 0.00 0.00 0.00 34.13 31.33 3f4t s GLU 187 CO -0.05 -0.46 1.93 1.12 0.02 0.00 0.00 175.26 177.82 3f4t h HIS 188 N 6.90 0.99 0.00 5.30 2.07 -1.98 -1.15 115.15 127.28 3f4t h HIS 188 Ca -0.42 0.03 -0.03 0.00 -2.85 0.00 0.00 60.37 57.09 3f4t h HIS 188 Cb 1.21 -0.33 -0.00 0.00 2.57 0.00 0.00 27.41 30.86 3f4t h HIS 188 CO 0.67 0.53 -0.16 -0.91 -3.07 0.00 0.00 177.93 174.99 3f4t h ASN 189 N 0.99 0.00 0.71 3.10 2.35 -1.95 -2.35 115.58 118.43 3f4t h ASN 189 Ca 0.36 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.11 3f4t h ASN 189 Cb 0.16 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 3f4t h ASN 189 CO -0.13 0.16 -0.02 0.11 -1.65 0.00 0.00 177.43 175.91 3f4t h LYS 190 N 0.00 0.00 -0.02 0.81 1.57 -1.59 -3.08 116.57 114.26 3f4t h LYS 190 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3f4t h LYS 190 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3f4t h LYS 190 CO 0.02 0.02 -0.01 1.33 -0.57 0.00 0.00 179.45 180.24 3f4t n VAL 191 N -3.13 1.93 -3.96 0.50 0.24 -0.89 -5.04 118.33 107.97 3f4t n VAL 191 Ca -0.01 -2.27 -0.36 0.00 -2.04 0.00 0.00 64.34 59.66 3f4t n VAL 191 Cb 0.24 -0.24 -0.07 0.00 -1.47 0.00 0.00 33.84 32.31 3f4t n VAL 191 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3f4t s LYS 192 N -2.89 3.36 -0.04 7.34 2.20 -1.16 -1.69 119.74 126.87 3f4t s LYS 192 Ca 0.33 -0.19 0.00 0.00 -0.36 0.00 0.00 55.97 55.75 3f4t s LYS 192 Cb 0.29 -3.12 0.03 0.00 -1.51 0.00 0.00 37.83 33.52 3f4t s LYS 192 CO 0.03 0.76 -0.01 -1.01 -0.36 0.00 0.00 175.35 174.76 3f4t s HIS 193 N -1.02 0.44 0.09 4.03 3.76 0.61 -4.98 115.29 118.21 3f4t s HIS 193 Ca 0.15 -0.05 0.10 0.00 -0.15 0.00 0.00 55.06 55.10 3f4t s HIS 193 Cb -0.12 -0.50 -0.03 0.00 1.11 0.00 0.00 32.58 33.04 3f4t s HIS 193 CO 0.04 -0.16 -0.25 0.20 -0.85 0.00 0.00 174.74 173.72 3f4t s GLY 194 N 1.09 1.41 0.00 -2.22 0.00 -1.26 0.04 107.32 106.39 3f4t s GLY 194 Ca -0.09 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.31 3f4t s GLY 194 CO -0.02 -1.27 0.00 0.61 0.00 0.00 0.00 173.10 172.43 3f4t n GLY 195 N 1.33 -2.30 3.70 0.20 0.00 -0.00 -4.84 105.19 103.27 3f4t n GLY 195 Ca -0.18 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 3f4t n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3f4t s TYR 196 N -0.69 2.94 -0.03 1.61 5.04 -1.26 -4.75 117.35 120.21 3f4t s TYR 196 Ca 0.00 0.75 0.04 0.00 -2.44 0.00 0.00 57.07 55.43 3f4t s TYR 196 Cb 0.00 -3.76 -0.01 0.00 0.35 0.00 0.00 41.96 38.55 3f4t s TYR 196 CO 0.00 -2.80 -0.16 0.15 -1.34 0.00 0.00 175.55 171.40 3f4t s LYS 197 N 1.82 1.49 0.83 4.97 -0.14 -1.26 -5.14 119.74 122.30 3f4t s LYS 197 Ca 0.67 -0.56 -0.11 0.00 -1.36 0.00 0.00 55.97 54.60 3f4t s LYS 197 Cb -0.36 -1.36 0.09 0.00 -1.68 0.00 0.00 37.83 34.51 3f4t s LYS 197 CO 0.30 0.27 1.10 -1.83 -0.76 0.00 0.00 175.35 174.42 3f4t s GLU 198 N -0.12 1.84 0.18 1.68 -1.05 -1.26 -4.91 118.70 115.06 3f4t s GLU 198 Ca 0.00 0.70 -0.14 0.00 -0.15 0.00 0.00 54.97 55.38 3f4t s GLU 198 Cb -0.09 -1.89 0.16 0.00 -0.44 0.00 0.00 34.13 31.87 3f4t s GLU 198 CO 0.01 -1.81 1.73 1.25 0.95 0.00 0.00 175.26 177.39 3f4t h LEU 199 N -1.23 0.05 -1.78 1.83 5.85 -1.93 -1.85 115.31 116.24 3f4t h LEU 199 Ca -0.48 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.36 3f4t h LEU 199 Cb 1.27 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 3f4t h LEU 199 CO 0.58 0.06 0.23 0.50 -0.34 0.00 0.00 178.44 179.47 3f4t h LYS 200 N 0.25 0.27 -0.10 1.25 1.63 -1.99 -0.12 116.57 117.76 3f4t h LYS 200 Ca 0.23 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 60.03 3f4t h LYS 200 Cb 0.28 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 3f4t h LYS 200 CO -0.28 0.18 -0.01 -0.92 -3.45 0.00 0.00 179.45 174.97 3f4t h TYR 201 N 0.28 -0.03 -0.18 1.91 3.20 -1.70 -1.43 116.97 119.01 3f4t h TYR 201 Ca 0.15 0.01 -0.20 0.00 3.14 0.00 0.00 58.73 61.83 3f4t h TYR 201 Cb 0.24 0.03 0.01 0.00 1.54 0.00 0.00 36.73 38.55 3f4t h TYR 201 CO -0.00 -0.03 -0.67 0.74 -1.64 0.00 0.00 178.16 176.56 3f4t h PHE 202 N 0.02 1.03 -0.61 -3.82 0.04 -1.16 -2.42 116.94 110.02 3f4t h PHE 202 Ca 0.05 -0.43 -0.04 0.00 2.80 0.00 0.00 57.97 60.35 3f4t h PHE 202 Cb 0.06 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 3f4t h PHE 202 CO -0.14 1.25 0.23 1.79 -0.60 0.00 0.00 178.31 180.85 3f4t h THR 203 N 0.51 1.22 -0.01 -1.55 1.35 -1.09 0.14 112.91 113.48 3f4t h THR 203 Ca -0.03 -0.70 0.01 0.00 -0.55 0.00 0.00 66.41 65.14 3f4t h THR 203 Cb 1.30 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 3f4t h THR 203 CO 0.14 0.28 -0.03 -1.13 -0.25 0.00 0.00 175.52 174.53 3f4t h ASN 204 N 0.88 -0.08 -0.25 5.36 -0.73 -1.20 -0.12 115.58 119.45 3f4t h ASN 204 Ca 0.21 0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.37 3f4t h ASN 204 Cb 0.19 0.04 -0.01 0.00 0.27 0.00 0.00 38.32 38.80 3f4t h ASN 204 CO -0.02 -0.04 0.06 0.58 -0.37 0.00 0.00 177.43 177.64 3f4t h VAL 205 N -0.04 1.21 -0.15 2.57 2.07 -0.95 -2.81 116.25 118.14 3f4t h VAL 205 Ca 0.02 -0.70 -0.14 0.00 0.82 0.00 0.00 66.70 66.69 3f4t h VAL 205 Cb 0.06 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3f4t h VAL 205 CO -0.04 0.22 -0.46 0.40 0.02 0.00 0.00 177.57 177.72 3f4t h ILE 206 N 0.22 1.34 -0.66 4.57 2.04 -0.73 -2.37 117.51 121.92 3f4t h ILE 206 Ca 0.08 -1.72 0.06 0.00 1.00 0.00 0.00 64.86 64.28 3f4t h ILE 206 Cb 0.29 2.01 -0.06 0.00 -0.74 0.00 0.00 36.82 38.32 3f4t h ILE 206 CO 0.00 0.53 0.36 0.44 0.00 0.00 0.00 178.15 179.48 3f4t h ASP 207 N 0.23 0.52 -0.32 1.72 3.32 -1.07 0.17 116.42 120.98 3f4t h ASP 207 Ca -0.01 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 3f4t h ASP 207 Cb 1.08 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 3f4t h ASP 207 CO 0.10 0.33 0.07 0.50 -1.72 0.00 0.00 179.24 178.52 3f4t h LYS 208 N 0.66 0.53 -0.54 3.56 3.64 -1.45 -1.37 116.57 121.60 3f4t h LYS 208 Ca 0.30 -0.13 -0.08 0.00 -1.27 0.00 0.00 60.65 59.47 3f4t h LYS 208 Cb 0.21 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3f4t h LYS 208 CO -0.19 0.60 0.02 1.25 -2.27 0.00 0.00 179.45 178.86 3f4t h LEU 209 N 0.37 0.87 -0.43 5.20 5.85 -1.15 -2.76 115.31 123.26 3f4t h LEU 209 Ca 0.10 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 3f4t h LEU 209 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3f4t h LEU 209 CO 0.00 0.92 -0.00 0.22 -0.34 0.00 0.00 178.44 179.24 3f4t h TYR 210 N 0.84 0.83 -0.82 1.25 3.20 -0.46 0.37 116.97 122.18 3f4t h TYR 210 Ca 0.16 -0.14 0.07 0.00 3.14 0.00 0.00 58.73 61.95 3f4t h TYR 210 Cb 0.47 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.47 3f4t h TYR 210 CO 0.03 0.82 0.50 0.78 -1.64 0.00 0.00 178.16 178.65 3f4t h GLY 211 N 0.60 1.25 0.89 1.82 0.00 -1.14 0.79 103.07 107.27 3f4t h GLY 211 Ca 0.12 -0.35 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 3f4t h GLY 211 CO 0.02 0.22 -0.08 0.50 0.00 0.00 0.00 176.54 177.21 3f4t h LYS 212 N 0.89 0.57 -0.29 4.80 1.57 -1.19 -2.41 116.57 120.51 3f4t h LYS 212 Ca 0.37 -0.22 0.06 0.00 -1.87 0.00 0.00 60.65 58.99 3f4t h LYS 212 Cb 0.21 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 3f4t h LYS 212 CO -0.19 0.77 -0.10 0.00 -0.57 0.00 0.00 179.45 179.36 3f4t h ALA 213 N 0.78 0.15 -0.54 3.86 0.00 -0.30 -0.73 119.26 122.49 3f4t h ALA 213 Ca 0.07 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3f4t h ALA 213 Cb 0.56 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3f4t h ALA 213 CO 0.03 -0.50 0.27 0.82 0.00 0.00 0.00 179.25 179.88 3f4t h ILE 214 N -0.05 1.19 -0.34 0.00 5.03 -0.83 0.85 117.51 123.36 3f4t h ILE 214 Ca 0.15 -0.52 0.00 0.00 -0.12 0.00 0.00 64.86 64.37 3f4t h ILE 214 Cb 0.27 0.55 -0.02 0.00 -3.03 0.00 0.00 36.82 34.59 3f4t h ILE 214 CO -0.33 0.21 0.23 0.58 -0.68 0.00 0.00 178.15 178.16 3f4t h VAL 215 N 0.72 1.09 -0.49 1.67 2.07 -1.16 -2.98 116.25 117.17 3f4t h VAL 215 Ca 0.19 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 3f4t h VAL 215 Cb 0.09 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3f4t h VAL 215 CO -0.03 0.08 0.19 0.50 0.02 0.00 0.00 177.57 178.33 3f4t h LYS 216 N 0.46 0.75 0.00 1.57 3.64 -0.72 -1.55 116.57 120.72 3f4t h LYS 216 Ca 0.13 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3f4t h LYS 216 Cb -0.05 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3f4t h LYS 216 CO -0.03 0.68 0.00 1.28 -2.27 0.00 0.00 179.45 179.11 3f4t n LEU 217 N -4.54 0.00 0.00 5.20 4.77 0.25 -5.10 117.00 117.58 3f4t n LEU 217 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3f4t n LEU 217 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3f4t n LEU 217 CO 0.38 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.82