#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ifv s LYS 3 N 0.00 0.53 0.04 -4.13 2.20 -1.26 -4.37 119.74 112.76 3ifv s LYS 3 Ca 0.00 1.17 -0.01 0.00 -0.36 0.00 0.00 55.97 56.77 3ifv s LYS 3 Cb 0.00 0.36 -0.03 0.00 -1.51 0.00 0.00 37.83 36.65 3ifv s LYS 3 CO 0.00 -0.19 -0.01 0.00 -0.36 0.00 0.00 175.35 174.79 3ifv s ALA 4 N 2.16 0.35 -0.23 3.13 0.00 1.27 -4.40 121.76 124.03 3ifv s ALA 4 Ca -0.07 -0.99 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 3ifv s ALA 4 Cb -0.09 0.25 0.07 0.00 0.00 0.00 0.00 23.12 23.35 3ifv s ALA 4 CO -0.17 -0.32 0.05 0.42 0.00 0.00 0.00 175.76 175.74 3ifv s ILE 5 N -3.24 0.64 0.04 0.00 1.01 -0.60 0.16 121.20 119.21 3ifv s ILE 5 Ca 0.01 -0.83 0.08 0.00 0.00 0.00 0.00 60.65 59.90 3ifv s ILE 5 Cb 0.03 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 3ifv s ILE 5 CO -0.07 -0.36 -0.22 0.54 0.00 0.00 0.00 174.94 174.83 3ifv s VAL 6 N 1.78 1.79 0.04 2.92 0.11 0.96 -2.16 120.40 125.85 3ifv s VAL 6 Ca 0.02 -1.22 -0.35 0.00 -2.93 0.00 0.00 61.98 57.49 3ifv s VAL 6 Cb -0.17 -1.54 -0.15 0.00 -1.53 0.00 0.00 36.38 32.99 3ifv s VAL 6 CO -0.14 0.27 1.58 -0.24 -3.33 0.00 0.00 175.10 173.24 3ifv n SER 7 N 1.89 2.65 -0.20 3.54 2.88 -1.26 0.50 113.62 123.62 3ifv n SER 7 Ca -0.17 1.07 0.01 0.00 -1.33 0.00 0.00 58.87 58.45 3ifv n SER 7 Cb 0.53 -1.32 0.11 0.00 -0.75 0.00 0.00 64.21 62.79 3ifv n SER 7 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ifv h ALA 8 N 6.26 0.77 0.00 -1.46 0.00 -1.93 -1.01 119.26 121.88 3ifv h ALA 8 Ca -0.47 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 3ifv h ALA 8 Cb 1.29 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3ifv h ALA 8 CO 0.87 -0.26 -0.45 0.00 0.00 0.00 0.00 179.25 179.42 3ifv h ALA 9 N 1.46 0.94 0.20 0.00 0.00 -1.95 0.09 119.26 120.01 3ifv h ALA 9 Ca 0.32 -0.41 -0.32 0.00 0.00 0.00 0.00 54.91 54.50 3ifv h ALA 9 Cb 0.45 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.20 3ifv h ALA 9 CO -0.36 0.56 -1.38 1.15 0.00 0.00 0.00 179.25 179.21 3ifv h THR 10 N 0.00 1.31 -0.01 0.00 2.02 -1.89 -2.72 112.91 111.62 3ifv h THR 10 Ca -0.00 -2.67 -0.17 0.00 0.77 0.00 0.00 66.41 64.33 3ifv h THR 10 Cb 1.00 2.92 -0.01 0.00 -1.74 0.00 0.00 68.15 70.32 3ifv h THR 10 CO 0.06 0.80 -0.77 0.25 0.37 0.00 0.00 175.52 176.23 3ifv h LEU 11 N 0.18 0.19 -0.59 2.58 5.85 -0.94 -2.19 115.31 120.38 3ifv h LEU 11 Ca -0.22 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.24 3ifv h LEU 11 Cb 2.07 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 43.03 3ifv h LEU 11 CO 0.26 0.88 -0.20 0.03 -0.34 0.00 0.00 178.44 179.07 3ifv h ARG 12 N 0.09 0.91 -0.29 1.25 3.08 -1.04 -1.42 114.38 116.97 3ifv h ARG 12 Ca -0.02 -0.37 -0.11 0.00 0.07 0.00 0.00 59.98 59.54 3ifv h ARG 12 Cb 1.35 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.35 3ifv h ARG 12 CO 0.11 1.02 -0.30 -0.44 -1.07 0.00 0.00 179.97 179.30 3ifv h ASP 13 N 0.79 0.62 0.70 7.04 3.32 -1.43 -0.95 116.42 126.51 3ifv h ASP 13 Ca 0.11 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 3ifv h ASP 13 Cb 0.75 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.13 3ifv h ASP 13 CO 0.06 0.88 -0.38 0.00 -1.72 0.00 0.00 179.24 178.08 3ifv h ALA 14 N 1.16 -1.01 0.00 3.45 0.00 -1.20 -3.06 119.26 118.59 3ifv h ALA 14 Ca 0.06 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 3ifv h ALA 14 Cb 0.77 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3ifv h ALA 14 CO 0.06 -1.08 -0.41 -0.07 0.00 0.00 0.00 179.25 177.76 3ifv h LEU 15 N -1.00 0.00 -0.11 0.00 3.38 -1.21 -3.17 115.31 113.21 3ifv h LEU 15 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3ifv h LEU 15 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3ifv h LEU 15 CO 0.12 0.41 0.07 -0.78 0.09 0.00 0.00 178.44 178.35 3ifv h ASP 16 N 0.00 0.12 -0.90 -0.43 3.58 -1.18 0.24 116.42 117.85 3ifv h ASP 16 Ca -0.00 -0.00 0.10 0.00 0.42 0.00 0.00 57.03 57.55 3ifv h ASP 16 Cb 0.84 -0.03 -0.07 0.00 1.72 0.00 0.00 39.33 41.79 3ifv h ASP 16 CO 0.05 0.09 0.58 0.77 -2.88 0.00 0.00 179.24 177.85 3ifv h SER 17 N 0.15 0.79 0.25 2.28 4.64 -1.50 -1.54 113.55 118.61 3ifv h SER 17 Ca 0.04 0.03 -0.34 0.00 -0.47 0.00 0.00 61.79 61.05 3ifv h SER 17 Cb -0.01 -0.13 0.03 0.00 -0.31 0.00 0.00 62.40 61.97 3ifv h SER 17 CO -0.01 0.45 -1.55 0.58 -0.87 0.00 0.00 176.83 175.43 3ifv h VAL 18 N 0.86 1.21 -0.95 0.95 2.07 -1.61 -3.37 116.25 115.41 3ifv h VAL 18 Ca 0.42 -2.66 0.07 0.00 0.82 0.00 0.00 66.70 65.35 3ifv h VAL 18 Cb 0.46 2.99 -0.06 0.00 -1.52 0.00 0.00 31.29 33.15 3ifv h VAL 18 CO -0.19 0.82 0.61 -1.28 0.02 0.00 0.00 177.57 177.56 3ifv h SER 19 N 0.14 0.94 -1.16 0.57 0.87 0.17 -0.64 113.55 114.44 3ifv h SER 19 Ca -0.28 0.01 0.34 0.00 -1.23 0.00 0.00 61.79 60.63 3ifv h SER 19 Cb 2.16 -0.19 -0.10 0.00 -0.44 0.00 0.00 62.40 63.83 3ifv h SER 19 CO 0.26 0.59 0.76 0.58 -0.53 0.00 0.00 176.83 178.49 3ifv h VAL 20 N 1.06 0.36 0.00 2.23 2.07 -1.47 -3.14 116.25 117.36 3ifv h VAL 20 Ca 0.41 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.85 3ifv h VAL 20 Cb 0.23 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 3ifv h VAL 20 CO -0.17 0.04 -1.75 0.18 0.02 0.00 0.00 177.57 175.90 3ifv n LEU 21 N -4.62 0.21 -3.53 2.57 4.77 -0.26 -4.89 117.00 111.24 3ifv n LEU 21 Ca 0.30 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 3ifv n LEU 21 Cb 1.12 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 42.16 3ifv n LEU 21 CO 0.25 0.05 0.55 0.68 -1.33 0.00 0.00 177.39 177.59 3ifv s VAL 22 N -3.35 0.00 -0.80 4.08 -7.23 -1.12 -4.41 120.40 107.57 3ifv s VAL 22 Ca -0.04 0.00 0.26 0.00 -1.81 0.00 0.00 61.98 60.39 3ifv s VAL 22 Cb 0.14 -1.00 0.20 0.00 0.56 0.00 0.00 36.38 36.28 3ifv s VAL 22 CO 0.87 0.00 1.69 0.47 -0.31 0.00 0.00 175.10 177.82 3ifv n ASP 23 N 0.80 0.58 -3.89 4.85 8.00 -1.26 -4.31 116.55 121.31 3ifv n ASP 23 Ca -0.16 0.40 -0.09 0.00 0.71 0.00 0.00 54.79 55.65 3ifv n ASP 23 Cb 0.58 -0.45 -0.08 0.00 -0.02 0.00 0.00 41.12 41.15 3ifv n ASP 23 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3ifv s GLU 24 N -3.08 0.74 0.05 -1.24 2.12 -1.26 -2.92 118.70 113.10 3ifv s GLU 24 Ca 0.11 -0.88 -0.28 0.00 0.36 0.00 0.00 54.97 54.28 3ifv s GLU 24 Cb 0.15 0.30 0.09 0.00 0.26 0.00 0.00 34.13 34.92 3ifv s GLU 24 CO 0.61 -0.21 1.01 0.00 -0.54 0.00 0.00 175.26 176.13 3ifv s LYS 26 N -3.03 3.80 -0.09 0.00 1.02 -1.26 0.22 119.74 120.40 3ifv s LYS 26 Ca 0.10 -0.42 -0.09 0.00 0.02 0.00 0.00 55.97 55.58 3ifv s LYS 26 Cb -0.00 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.59 3ifv s LYS 26 CO -0.03 -0.26 0.20 0.42 -0.92 0.00 0.00 175.35 174.77 3ifv s ILE 27 N 1.74 5.39 0.00 2.17 1.01 0.39 -4.33 121.20 127.57 3ifv s ILE 27 Ca 0.07 0.36 0.00 0.00 0.00 0.00 0.00 60.65 61.08 3ifv s ILE 27 Cb -0.16 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.83 3ifv s ILE 27 CO 0.10 0.60 0.00 0.54 0.00 0.00 0.00 174.94 176.19 3ifv n ARG 28 N 2.00 0.00 0.00 2.79 1.74 -0.41 -0.45 116.66 122.33 3ifv n ARG 28 Ca -0.18 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.90 3ifv n ARG 28 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.98 3ifv n ARG 28 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3ifv n GLU 32 N 0.00 0.00 -3.56 5.56 -0.58 -1.26 -3.04 120.64 117.76 3ifv n GLU 32 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 3ifv n GLU 32 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 30.85 3ifv n GLU 32 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3ifv s SER 33 N 0.00 -0.22 -0.06 1.62 1.04 -1.26 -1.26 113.70 113.56 3ifv s SER 33 Ca 0.00 0.00 -0.00 0.00 0.48 0.00 0.00 55.95 56.43 3ifv s SER 33 Cb 0.00 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.32 3ifv s SER 33 CO 0.00 -0.37 -0.02 -0.22 0.98 0.00 0.00 173.24 173.61 3ifv s LEU 34 N -2.29 3.46 0.00 2.42 0.20 0.23 -4.95 118.68 117.75 3ifv s LEU 34 Ca 0.08 0.06 -0.07 0.00 0.69 0.00 0.00 54.13 54.89 3ifv s LEU 34 Cb -0.01 -1.84 0.00 0.00 -0.43 0.00 0.00 46.19 43.91 3ifv s LEU 34 CO -0.06 0.35 0.14 -0.94 -0.29 0.00 0.00 176.35 175.54 3ifv s SER 35 N -1.06 0.03 -0.00 3.68 1.04 -1.17 0.88 113.70 117.09 3ifv s SER 35 Ca 0.15 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.36 3ifv s SER 35 Cb -0.11 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.21 3ifv s SER 35 CO 0.04 -0.38 -0.01 -0.63 0.98 0.00 0.00 173.24 173.25 3ifv s ILE 36 N -1.42 0.05 -0.03 -1.02 -1.09 -1.04 -1.29 121.20 115.36 3ifv s ILE 36 Ca -0.15 -0.02 -0.00 0.00 -2.23 0.00 0.00 60.65 58.25 3ifv s ILE 36 Cb -0.08 -0.06 0.03 0.00 -1.58 0.00 0.00 42.46 40.77 3ifv s ILE 36 CO 0.01 0.02 0.03 -0.13 -1.23 0.00 0.00 174.94 173.64 3ifv s ARG 37 N 0.05 0.08 0.16 2.79 0.52 -1.26 -1.07 118.95 120.22 3ifv s ARG 37 Ca -0.00 0.20 -0.05 0.00 -0.52 0.00 0.00 55.73 55.35 3ifv s ARG 37 Cb -0.01 -0.41 -0.02 0.00 0.52 0.00 0.00 34.95 35.02 3ifv s ARG 37 CO -0.00 -0.20 0.19 0.00 0.02 0.00 0.00 175.30 175.30 3ifv s ALA 38 N 1.35 0.45 0.03 2.13 0.00 -1.17 -4.56 121.76 120.00 3ifv s ALA 38 Ca -0.05 -1.20 0.01 0.00 0.00 0.00 0.00 51.96 50.71 3ifv s ALA 38 Cb -0.13 0.93 -0.03 0.00 0.00 0.00 0.00 23.12 23.89 3ifv s ALA 38 CO -0.03 -0.59 -0.04 0.54 0.00 0.00 0.00 175.76 175.64 3ifv s VAL 39 N -4.02 0.27 0.53 0.00 0.11 -1.26 -1.24 120.40 114.79 3ifv s VAL 39 Ca 0.22 -1.14 -0.14 0.00 -2.93 0.00 0.00 61.98 58.00 3ifv s VAL 39 Cb 0.05 -0.60 -0.06 0.00 -1.53 0.00 0.00 36.38 34.23 3ifv s VAL 39 CO 0.02 -0.56 0.96 1.51 -3.33 0.00 0.00 175.10 173.71 3ifv s ASP 40 N -1.78 6.49 0.40 3.54 1.47 -0.41 -4.89 116.67 121.49 3ifv s ASP 40 Ca -0.10 1.45 0.33 0.00 1.18 0.00 0.00 52.55 55.41 3ifv s ASP 40 Cb -0.07 -2.46 1.30 0.00 -0.34 0.00 0.00 42.92 41.35 3ifv s ASP 40 CO -0.02 -0.64 1.27 -2.65 0.68 0.00 0.00 175.17 173.81 3ifv n PRO 41 N -1.89 -0.02 -0.10 2.11 -0.02 -1.26 0.14 135.00 133.97 3ifv n PRO 41 Ca 0.06 0.96 0.11 0.00 -2.02 0.00 0.00 63.50 62.61 3ifv n PRO 41 Cb 0.54 -2.02 0.32 0.00 -0.02 0.00 0.00 33.50 32.32 3ifv n PRO 41 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ifv n ALA 42 N -2.63 2.49 -3.73 3.55 0.00 -1.26 -4.92 120.51 114.00 3ifv n ALA 42 Ca 0.34 -0.66 -0.26 0.00 0.00 0.00 0.00 53.44 52.87 3ifv n ALA 42 Cb 1.44 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 19.93 3ifv n ALA 42 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ifv n ASN 43 N 0.72 -4.53 -0.02 0.00 3.02 0.38 -4.92 115.26 109.91 3ifv n ASN 43 Ca 0.17 -0.69 -0.02 0.00 -0.03 0.00 0.00 54.58 54.01 3ifv n ASN 43 Cb 0.43 -4.42 -0.02 0.00 -0.61 0.00 0.00 39.78 35.16 3ifv n ASN 43 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3ifv n VAL 44 N -4.68 0.23 -4.79 2.41 0.31 -1.26 -4.93 118.33 105.62 3ifv n VAL 44 Ca -0.05 -0.11 -0.30 0.00 -0.01 0.00 0.00 64.34 63.86 3ifv n VAL 44 Cb 0.57 -0.77 -0.14 0.00 -0.91 0.00 0.00 33.84 32.60 3ifv n VAL 44 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3ifv s GLY 45 N -3.94 1.48 0.05 2.92 0.00 -1.26 -1.20 107.32 105.36 3ifv s GLY 45 Ca -0.04 -1.25 0.02 0.00 0.00 0.00 0.00 44.72 43.45 3ifv s GLY 45 CO 0.11 -1.14 -0.07 1.06 0.00 0.00 0.00 173.10 173.06 3ifv s MET 46 N -1.35 0.55 0.06 2.90 1.00 -0.37 -1.29 119.30 120.80 3ifv s MET 46 Ca 0.13 -0.82 0.05 0.00 0.00 0.00 0.00 55.69 55.05 3ifv s MET 46 Cb -0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 34.83 34.47 3ifv s MET 46 CO 0.03 0.03 -0.14 0.54 0.00 0.00 0.00 175.02 175.48 3ifv s VAL 47 N -1.72 1.11 -0.25 -6.03 0.11 -0.38 -1.64 120.40 111.61 3ifv s VAL 47 Ca -0.08 -1.19 -0.04 0.00 -2.93 0.00 0.00 61.98 57.75 3ifv s VAL 47 Cb -0.08 -1.04 0.08 0.00 -1.53 0.00 0.00 36.38 33.81 3ifv s VAL 47 CO -0.01 -0.14 0.10 -0.62 -3.33 0.00 0.00 175.10 171.10 3ifv s ASP 48 N -1.52 3.19 -0.15 3.54 -1.08 0.97 -3.02 116.67 118.60 3ifv s ASP 48 Ca -0.01 -1.08 -0.14 0.00 -0.52 0.00 0.00 52.55 50.80 3ifv s ASP 48 Cb -0.09 -0.42 -0.05 0.00 -1.46 0.00 0.00 42.92 40.90 3ifv s ASP 48 CO 0.02 -0.39 0.31 -0.22 0.52 0.00 0.00 175.17 175.40 3ifv s LEU 49 N 2.02 4.26 -0.18 -1.34 2.96 -0.24 -0.49 118.68 125.66 3ifv s LEU 49 Ca 0.06 0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 54.51 3ifv s LEU 49 Cb -0.16 -2.40 0.05 0.00 0.50 0.00 0.00 46.19 44.18 3ifv s LEU 49 CO -0.24 0.11 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.97 3ifv s THR 50 N 0.40 1.09 -0.34 3.68 2.01 0.96 -2.50 115.64 120.94 3ifv s THR 50 Ca 0.17 -0.73 -0.16 0.00 0.31 0.00 0.00 61.69 61.29 3ifv s THR 50 Cb -0.13 -1.34 -0.01 0.00 0.01 0.00 0.00 72.50 71.03 3ifv s THR 50 CO 0.05 0.03 0.39 -0.76 -0.69 0.00 0.00 174.62 173.64 3ifv s LEU 51 N 1.62 4.41 0.61 4.42 1.43 0.25 -1.25 118.68 130.18 3ifv s LEU 51 Ca -0.01 -0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 52.76 3ifv s LEU 51 Cb -0.16 -2.39 -0.03 0.00 0.03 0.00 0.00 46.19 43.64 3ifv s LEU 51 CO -0.07 -0.36 1.07 -1.81 0.23 0.00 0.00 176.35 175.40 3ifv s ASP 52 N 1.73 5.66 0.20 2.29 1.01 -0.76 0.74 116.67 127.53 3ifv s ASP 52 Ca 0.13 1.85 -0.10 0.00 0.71 0.00 0.00 52.55 55.13 3ifv s ASP 52 Cb -0.16 -2.54 0.25 0.00 1.01 0.00 0.00 42.92 41.48 3ifv s ASP 52 CO 0.12 -1.25 1.75 0.00 0.21 0.00 0.00 175.17 175.99 3ifv h ALA 53 N 0.35 0.74 0.00 5.23 0.00 -1.52 0.90 119.26 124.96 3ifv h ALA 53 Ca -0.47 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3ifv h ALA 53 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3ifv h ALA 53 CO 0.57 -0.18 0.23 0.00 0.00 0.00 0.00 179.25 179.87 3ifv n ALA 54 N -2.45 0.69 0.60 0.00 0.00 -1.26 -0.22 120.51 117.86 3ifv n ALA 54 Ca 0.08 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.75 3ifv n ALA 54 Cb 0.25 -0.84 0.43 0.00 0.00 0.00 0.00 19.45 19.29 3ifv n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ifv n ALA 55 N -1.55 2.16 -2.82 0.00 0.00 0.31 -4.76 120.51 113.85 3ifv n ALA 55 Ca -0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.07 3ifv n ALA 55 Cb 0.25 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.15 3ifv n ALA 55 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3ifv s PHE 56 N -3.14 3.23 0.27 0.00 0.08 0.69 -4.65 117.98 114.46 3ifv s PHE 56 Ca 0.09 0.02 -0.05 0.00 0.12 0.00 0.00 56.93 57.11 3ifv s PHE 56 Cb 0.12 -2.15 0.52 0.00 -0.57 0.00 0.00 43.02 40.94 3ifv s PHE 56 CO 0.55 0.04 1.60 0.93 -0.10 0.00 0.00 175.22 178.25 3ifv h GLU 57 N 7.16 0.05 -3.12 0.44 4.39 -1.70 -3.42 114.58 118.38 3ifv h GLU 57 Ca -0.37 -0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.17 3ifv h GLU 57 Cb 1.17 -0.01 -0.24 0.00 -0.10 0.00 0.00 28.75 29.57 3ifv h GLU 57 CO 0.67 0.04 -0.39 0.45 -1.16 0.00 0.00 179.01 178.61 3ifv s SER 58 N -5.16 -0.24 0.05 1.42 0.15 -1.12 -4.99 113.70 103.82 3ifv s SER 58 Ca -0.14 0.40 -0.28 0.00 0.70 0.00 0.00 55.95 56.63 3ifv s SER 58 Cb 0.25 0.48 0.09 0.00 -1.71 0.00 0.00 66.02 65.13 3ifv s SER 58 CO 0.76 -0.18 0.93 -0.47 1.20 0.00 0.00 173.24 175.48 3ifv s TYR 59 N -0.24 -0.26 -0.46 3.44 6.14 -1.26 -1.55 117.35 123.16 3ifv s TYR 59 Ca -0.04 0.07 -0.16 0.00 0.64 0.00 0.00 57.07 57.59 3ifv s TYR 59 Cb -0.03 0.57 0.06 0.00 0.42 0.00 0.00 41.96 42.98 3ifv s TYR 59 CO 0.01 -0.63 0.39 0.54 0.64 0.00 0.00 175.55 176.50 3ifv s VAL 65 N -3.15 5.21 0.38 3.14 0.11 -1.26 -4.86 120.40 119.97 3ifv s VAL 65 Ca 0.08 -0.90 0.08 0.00 -2.93 0.00 0.00 61.98 58.31 3ifv s VAL 65 Cb -0.01 -4.09 -0.04 0.00 -1.53 0.00 0.00 36.38 30.71 3ifv s VAL 65 CO -0.05 -0.52 0.21 0.27 -3.33 0.00 0.00 175.10 171.68 3ifv s ILE 66 N 1.74 2.67 -0.29 7.04 -4.36 0.40 -4.73 121.20 123.67 3ifv s ILE 66 Ca 0.05 -1.61 0.01 0.00 -0.26 0.00 0.00 60.65 58.84 3ifv s ILE 66 Cb -0.22 -2.99 0.09 0.00 1.25 0.00 0.00 42.46 40.58 3ifv s ILE 66 CO 0.08 -0.07 0.04 -0.83 0.24 0.00 0.00 174.94 174.40 3ifv s GLY 67 N -3.93 1.35 -0.01 6.27 0.00 -1.26 -0.46 107.32 109.28 3ifv s GLY 67 Ca 0.41 -1.79 -0.10 0.00 0.00 0.00 0.00 44.72 43.25 3ifv s GLY 67 CO 0.24 1.24 0.31 0.14 0.00 0.00 0.00 173.10 175.03 3ifv s VAL 68 N 1.37 5.22 -0.61 1.40 1.01 0.13 -4.27 120.40 124.66 3ifv s VAL 68 Ca 0.06 0.44 -0.27 0.00 0.00 0.00 0.00 61.98 62.21 3ifv s VAL 68 Cb -0.18 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 3ifv s VAL 68 CO -0.15 0.47 1.62 0.21 0.00 0.00 0.00 175.10 177.25 3ifv s ASN 69 N -1.37 5.72 0.27 3.32 2.47 -1.26 -1.90 114.94 122.19 3ifv s ASN 69 Ca 0.25 0.21 0.03 0.00 0.42 0.00 0.00 52.86 53.76 3ifv s ASN 69 Cb -0.14 -2.54 0.39 0.00 -1.45 0.00 0.00 41.25 37.51 3ifv s ASN 69 CO 0.13 -2.05 1.70 0.25 -3.72 0.00 0.00 177.10 173.40 3ifv h LEU 70 N 14.68 0.45 -0.40 3.21 5.85 -1.87 -2.73 115.31 134.51 3ifv h LEU 70 Ca -0.27 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3ifv h LEU 70 Cb 1.12 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3ifv h LEU 70 CO 1.21 0.74 0.00 0.28 -0.34 0.00 0.00 178.44 180.33 3ifv h SER 71 N 0.38 0.00 0.33 1.25 0.02 -1.90 -2.64 113.55 110.98 3ifv h SER 71 Ca 0.05 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.67 3ifv h SER 71 Cb 0.74 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 3ifv h SER 71 CO 0.06 0.00 -1.69 -0.09 -1.14 0.00 0.00 176.83 173.96 3ifv h ARG 72 N 0.00 0.26 -0.42 3.45 9.65 -1.83 -2.58 114.38 122.91 3ifv h ARG 72 Ca 0.00 -0.45 -0.02 0.00 -1.10 0.00 0.00 59.98 58.41 3ifv h ARG 72 Cb 0.73 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.46 3ifv h ARG 72 CO 0.00 1.12 0.16 1.25 2.80 0.00 0.00 179.97 185.31 3ifv h LEU 73 N 0.07 0.54 0.13 3.80 5.85 -1.39 -1.57 115.31 122.73 3ifv h LEU 73 Ca -0.31 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3ifv h LEU 73 Cb 2.04 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.94 3ifv h LEU 73 CO 0.14 0.49 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.35 3ifv h GLU 74 N 0.59 -0.16 -1.00 1.25 5.08 -1.47 -1.20 114.58 117.68 3ifv h GLU 74 Ca 0.15 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.71 3ifv h GLU 74 Cb 0.13 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.31 3ifv h GLU 74 CO -0.01 0.12 0.60 1.49 -1.00 0.00 0.00 179.01 180.21 3ifv h GLU 75 N -0.44 0.72 -0.07 2.33 4.81 -1.16 -1.38 114.58 119.39 3ifv h GLU 75 Ca -0.02 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 3ifv h GLU 75 Cb 0.36 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3ifv h GLU 75 CO 0.03 0.48 -0.27 0.28 -0.73 0.00 0.00 179.01 178.80 3ifv h VAL 76 N 0.75 1.42 -0.03 0.32 2.07 -1.13 -3.09 116.25 116.55 3ifv h VAL 76 Ca 0.58 -1.66 0.01 0.00 0.82 0.00 0.00 66.70 66.45 3ifv h VAL 76 Cb 0.91 2.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 3ifv h VAL 76 CO -0.39 0.47 0.18 0.00 0.02 0.00 0.00 177.57 177.86 3ifv h ALA 77 N 0.44 1.27 0.00 1.67 0.00 -0.66 -0.25 119.26 121.72 3ifv h ALA 77 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ifv h ALA 77 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3ifv h ALA 77 CO 0.06 -0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.52 3ifv n GLY 78 N -1.19 -0.38 1.37 0.00 0.00 -0.57 -3.27 105.19 101.15 3ifv n GLY 78 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.09 3ifv n GLY 78 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3ifv n MET 79 N -0.37 3.43 -0.82 1.61 2.81 -0.11 -5.10 117.12 118.58 3ifv n MET 79 Ca 0.00 -2.75 0.00 0.00 -1.81 0.00 0.00 57.70 53.14 3ifv n MET 79 Cb 0.05 -1.77 0.00 0.00 -0.71 0.00 0.00 33.22 30.79 3ifv n MET 79 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ifv n ALA 80 N 0.96 0.00 -1.36 3.04 0.00 -1.20 -5.03 120.51 116.91 3ifv n ALA 80 Ca 0.23 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 53.15 3ifv n ALA 80 Cb 0.80 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.18 3ifv n ALA 80 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ifv n LEU 85 N 0.00 -0.15 -4.65 0.00 4.77 -1.26 -5.06 117.00 110.65 3ifv n LEU 85 Ca 0.00 1.06 -0.35 0.00 -0.03 0.00 0.00 56.01 56.69 3ifv n LEU 85 Cb 0.00 -0.84 -0.09 0.00 -2.33 0.00 0.00 43.42 40.15 3ifv n LEU 85 CO 0.00 -1.87 -0.24 -0.63 -1.33 0.00 0.00 177.39 173.33 3ifv s ILE 86 N -0.11 4.91 -0.11 -0.08 1.01 0.18 -4.58 121.20 122.41 3ifv s ILE 86 Ca 0.80 0.01 -0.18 0.00 0.00 0.00 0.00 60.65 61.28 3ifv s ILE 86 Cb -1.12 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.08 3ifv s ILE 86 CO 0.52 0.45 0.47 -1.00 0.00 0.00 0.00 174.94 175.38 3ifv s HIS 87 N 0.43 3.53 -0.09 3.97 3.76 0.41 -0.02 115.29 127.28 3ifv s HIS 87 Ca 0.04 0.89 0.04 0.00 -0.15 0.00 0.00 55.06 55.88 3ifv s HIS 87 Cb -0.12 -2.53 0.00 0.00 1.11 0.00 0.00 32.58 31.04 3ifv s HIS 87 CO 0.00 0.21 -0.22 -0.51 -0.85 0.00 0.00 174.74 173.37 3ifv s LEU 88 N 0.49 2.01 0.00 0.89 1.43 0.41 -2.45 118.68 121.46 3ifv s LEU 88 Ca 0.26 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 3ifv s LEU 88 Cb -0.15 -1.30 0.00 0.00 0.03 0.00 0.00 46.19 44.77 3ifv s LEU 88 CO 0.10 0.14 0.00 0.41 0.23 0.00 0.00 176.35 177.24 3ifv n THR 89 N 3.52 0.00 -3.65 5.49 -1.04 -1.26 0.39 114.28 117.73 3ifv n THR 89 Ca -0.20 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.47 3ifv n THR 89 Cb 0.53 -0.96 -0.05 0.00 -1.82 0.00 0.00 70.33 68.02 3ifv n THR 89 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3ifv s LEU 97 N -5.40 4.36 -0.24 -4.42 2.96 2.61 -4.87 118.68 113.68 3ifv s LEU 97 Ca 0.00 0.70 -0.06 0.00 -0.22 0.00 0.00 54.13 54.55 3ifv s LEU 97 Cb 0.00 -2.84 -0.02 0.00 0.50 0.00 0.00 46.19 43.83 3ifv s LEU 97 CO 0.00 0.21 0.03 0.21 -1.32 0.00 0.00 176.35 175.48 3ifv s ASN 98 N -1.71 4.83 -0.00 3.68 2.47 -1.26 0.34 114.94 123.30 3ifv s ASN 98 Ca 0.30 -0.27 0.06 0.00 0.42 0.00 0.00 52.86 53.38 3ifv s ASN 98 Cb -0.14 -1.85 -0.03 0.00 -1.45 0.00 0.00 41.25 37.78 3ifv s ASN 98 CO 0.17 -0.02 -0.18 -0.63 -3.72 0.00 0.00 177.10 172.72 3ifv s ILE 99 N 1.51 2.78 -0.07 -5.21 1.01 0.12 -4.54 121.20 116.80 3ifv s ILE 99 Ca 0.06 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 3ifv s ILE 99 Cb -0.15 -2.11 0.04 0.00 0.01 0.00 0.00 42.46 40.25 3ifv s ILE 99 CO 0.01 0.46 0.16 -0.60 0.00 0.00 0.00 174.94 174.97 3ifv s ARG 100 N -1.06 0.11 -0.35 2.79 3.52 -1.03 -1.70 118.95 121.22 3ifv s ARG 100 Ca 0.13 0.38 -0.00 0.00 -0.13 0.00 0.00 55.73 56.11 3ifv s ARG 100 Cb -0.10 -0.16 0.13 0.00 -1.56 0.00 0.00 34.95 33.25 3ifv s ARG 100 CO 0.03 -0.16 0.20 0.42 -0.81 0.00 0.00 175.30 174.97 3ifv s ILE 101 N 1.15 0.36 0.00 4.11 1.01 -0.91 -0.44 121.20 126.48 3ifv s ILE 101 Ca -0.09 -1.69 0.00 0.00 0.00 0.00 0.00 60.65 58.87 3ifv s ILE 101 Cb -0.11 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.09 3ifv s ILE 101 CO -0.06 -0.92 0.00 0.47 0.00 0.00 0.00 174.94 174.43 3ifv n ASP 102 N 4.18 0.00 -0.38 3.58 9.92 -1.26 -2.74 116.55 129.85 3ifv n ASP 102 Ca 0.08 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.48 3ifv n ASP 102 Cb 0.38 0.00 0.55 0.00 -0.64 0.00 0.00 41.12 41.41 3ifv n ASP 102 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ifv n GLY 103 N 0.00 -0.24 3.58 0.44 0.00 -1.26 -4.86 105.19 102.85 3ifv n GLY 103 Ca 0.00 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 3ifv n GLY 103 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ifv s LEU 104 N -2.09 4.22 -0.26 0.99 2.96 -1.11 -5.03 118.68 118.35 3ifv s LEU 104 Ca 0.37 0.23 -0.04 0.00 -0.22 0.00 0.00 54.13 54.47 3ifv s LEU 104 Cb 0.21 -2.72 0.02 0.00 0.50 0.00 0.00 46.19 44.20 3ifv s LEU 104 CO 0.37 -0.48 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.46 3ifv s SER 105 N 1.70 4.56 -0.07 3.68 0.01 -1.26 -2.13 113.70 120.19 3ifv s SER 105 Ca 0.22 -0.76 0.04 0.00 1.31 0.00 0.00 55.95 56.76 3ifv s SER 105 Cb -0.15 -1.74 0.00 0.00 0.21 0.00 0.00 66.02 64.34 3ifv s SER 105 CO 0.13 -0.13 -0.19 -0.47 0.41 0.00 0.00 173.24 172.99 3ifv s TYR 106 N 1.40 2.01 -0.19 2.43 5.04 -0.69 -5.01 117.35 122.34 3ifv s TYR 106 Ca 0.02 -0.75 -0.01 0.00 -2.44 0.00 0.00 57.07 53.89 3ifv s TYR 106 Cb -0.16 -1.38 0.00 0.00 0.35 0.00 0.00 41.96 40.77 3ifv s TYR 106 CO -0.02 -0.31 -0.13 0.99 -1.34 0.00 0.00 175.55 174.74 3ifv s THR 107 N 0.37 2.72 0.00 4.34 2.01 -1.26 0.16 115.64 123.99 3ifv s THR 107 Ca -0.14 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.14 3ifv s THR 107 Cb -0.16 -2.19 0.00 0.00 0.01 0.00 0.00 72.50 70.17 3ifv s THR 107 CO 0.06 0.49 0.00 -0.11 -0.69 0.00 0.00 174.62 174.37 3ifv n LEU 108 N 4.52 0.00 -4.19 4.42 7.94 1.06 -4.81 117.00 125.94 3ifv n LEU 108 Ca -0.19 0.00 -0.35 0.00 -1.11 0.00 0.00 56.01 54.36 3ifv n LEU 108 Cb 0.51 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.32 3ifv n LEU 108 CO 0.28 0.00 -0.39 -0.62 -1.11 0.00 0.00 177.39 175.55 3ifv s ASP 112 N 0.05 4.50 0.00 1.96 -1.08 -1.26 0.61 116.67 121.44 3ifv s ASP 112 Ca 0.00 -0.98 0.00 0.00 -0.52 0.00 0.00 52.55 51.05 3ifv s ASP 112 Cb 0.00 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 39.78 3ifv s ASP 112 CO 0.00 -0.17 0.78 -0.81 0.52 0.00 0.00 175.17 175.49 3ifv n PRO 113 N 4.66 0.00 -0.27 4.34 -0.04 -1.26 -1.35 135.00 141.08 3ifv n PRO 113 Ca -0.15 0.29 0.10 0.00 -0.04 0.00 0.00 63.50 63.69 3ifv n PRO 113 Cb 0.46 -1.69 0.25 0.00 -0.04 0.00 0.00 33.50 32.48 3ifv n PRO 113 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3ifv n ASP 114 N -1.28 3.52 -0.10 3.54 8.00 -1.26 -5.01 116.55 123.97 3ifv n ASP 114 Ca 0.00 -1.98 0.15 0.00 0.71 0.00 0.00 54.79 53.67 3ifv n ASP 114 Cb 0.19 -0.36 0.71 0.00 -0.02 0.00 0.00 41.12 41.64 3ifv n ASP 114 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3ifv n SER 115 N 1.29 0.37 -3.59 -2.24 2.88 -0.45 -5.27 113.62 106.60 3ifv n SER 115 Ca 0.19 -0.69 -0.11 0.00 -1.33 0.00 0.00 58.87 56.93 3ifv n SER 115 Cb 0.56 -0.09 -0.04 0.00 -0.75 0.00 0.00 64.21 63.89 3ifv n SER 115 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 3ifv s PRO 120 N -2.33 1.09 -0.70 -1.46 0.02 -1.26 -5.10 135.00 125.25 3ifv s PRO 120 Ca 0.34 -0.59 -0.19 0.00 0.02 0.00 0.00 61.00 60.58 3ifv s PRO 120 Cb 0.21 0.48 0.11 0.00 0.02 0.00 0.00 34.50 35.32 3ifv s PRO 120 CO 0.43 -0.43 0.87 0.34 -0.33 0.00 0.00 177.00 177.89 3ifv s ASP 121 N -2.64 6.32 -0.65 2.53 -1.08 -1.26 -4.98 116.67 114.92 3ifv s ASP 121 Ca 0.01 -1.55 -0.27 0.00 -0.52 0.00 0.00 52.55 50.23 3ifv s ASP 121 Cb 0.01 -2.35 -0.00 0.00 -1.46 0.00 0.00 42.92 39.12 3ifv s ASP 121 CO -0.10 -1.15 1.65 -0.63 0.52 0.00 0.00 175.17 175.46 3ifv s ILE 122 N 2.87 3.49 0.53 4.11 1.01 -1.26 -4.99 121.20 126.97 3ifv s ILE 122 Ca 0.20 0.29 -0.21 0.00 0.00 0.00 0.00 60.65 60.93 3ifv s ILE 122 Cb -0.17 -4.28 -0.07 0.00 0.01 0.00 0.00 42.46 37.96 3ifv s ILE 122 CO 0.03 -1.22 1.11 -2.65 0.00 0.00 0.00 174.94 172.20 3ifv n PRO 123 N 9.22 1.30 -2.82 2.79 -0.02 -1.26 -4.98 135.00 139.22 3ifv n PRO 123 Ca 0.14 0.48 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 3ifv n PRO 123 Cb 0.51 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 3ifv n PRO 123 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ifv s ASP 124 N -0.98 7.10 0.11 2.55 1.11 -1.26 -5.03 116.67 120.27 3ifv s ASP 124 Ca 0.71 1.35 0.10 0.00 0.18 0.00 0.00 52.55 54.88 3ifv s ASP 124 Cb -0.46 -2.49 -0.04 0.00 1.07 0.00 0.00 42.92 41.00 3ifv s ASP 124 CO 0.51 -0.36 -0.23 -0.76 1.18 0.00 0.00 175.17 175.50 3ifv s LEU 125 N 1.81 2.46 -0.85 1.23 1.43 -1.26 -5.03 118.68 118.48 3ifv s LEU 125 Ca 0.43 -0.65 -0.07 0.00 -1.03 0.00 0.00 54.13 52.81 3ifv s LEU 125 Cb -0.18 -1.36 0.22 0.00 0.03 0.00 0.00 46.19 44.90 3ifv s LEU 125 CO 0.17 0.19 0.75 -1.81 0.23 0.00 0.00 176.35 175.88 3ifv s ASP 126 N -1.98 6.29 0.33 2.29 1.01 -1.26 -5.06 116.67 118.28 3ifv s ASP 126 Ca 0.15 -3.16 -0.27 0.00 0.71 0.00 0.00 52.55 49.98 3ifv s ASP 126 Cb -0.10 -2.05 -0.09 0.00 1.01 0.00 0.00 42.92 41.69 3ifv s ASP 126 CO 0.07 -0.37 1.09 -0.76 0.21 0.00 0.00 175.17 175.41 3ifv s LEU 127 N -0.54 4.40 0.56 1.23 1.43 -1.26 -4.95 118.68 119.55 3ifv s LEU 127 Ca 0.22 2.20 0.28 0.00 -1.03 0.00 0.00 54.13 55.80 3ifv s LEU 127 Cb -0.12 -3.83 1.63 0.00 0.03 0.00 0.00 46.19 43.90 3ifv s LEU 127 CO -0.08 -0.29 2.17 0.00 0.23 0.00 0.00 176.35 178.38 3ifv h ALA 128 N 3.32 1.45 -2.34 4.21 0.00 -1.83 -3.44 119.26 120.63 3ifv h ALA 128 Ca -0.47 -0.05 -0.56 0.00 0.00 0.00 0.00 54.91 53.82 3ifv h ALA 128 Cb 1.21 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.85 3ifv h ALA 128 CO 0.65 0.07 -0.76 0.00 0.00 0.00 0.00 179.25 179.21 3ifv s ALA 129 N -4.47 2.48 -0.07 0.00 0.00 -0.54 -3.22 121.76 115.94 3ifv s ALA 129 Ca -0.04 -1.77 -0.03 0.00 0.00 0.00 0.00 51.96 50.12 3ifv s ALA 129 Cb 0.14 -0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.09 3ifv s ALA 129 CO 0.57 0.23 0.14 1.21 0.00 0.00 0.00 175.76 177.91 3ifv s ASN 130 N -3.33 0.54 -0.05 0.00 3.84 -0.50 -2.68 114.94 112.75 3ifv s ASN 130 Ca 0.26 0.29 0.04 0.00 0.21 0.00 0.00 52.86 53.66 3ifv s ASN 130 Cb -0.04 0.20 0.00 0.00 -0.55 0.00 0.00 41.25 40.86 3ifv s ASN 130 CO 0.12 -0.22 -0.16 -0.63 -2.79 0.00 0.00 177.10 173.43 3ifv s ILE 131 N 1.94 1.34 -0.14 -5.21 1.09 -0.33 0.57 121.20 120.46 3ifv s ILE 131 Ca -0.00 -0.64 -0.01 0.00 -1.10 0.00 0.00 60.65 58.90 3ifv s ILE 131 Cb -0.12 -1.18 -0.01 0.00 -1.06 0.00 0.00 42.46 40.09 3ifv s ILE 131 CO -0.05 0.39 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.38 3ifv s VAL 132 N 0.27 3.15 0.14 2.92 1.01 0.15 -0.17 120.40 127.88 3ifv s VAL 132 Ca -0.08 -0.62 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 3ifv s VAL 132 Cb -0.13 -2.34 0.02 0.00 0.00 0.00 0.00 36.38 33.93 3ifv s VAL 132 CO 0.03 0.51 0.37 -1.48 0.00 0.00 0.00 175.10 174.53 3ifv s LEU 133 N 0.46 0.61 0.14 3.92 0.05 -0.40 -0.54 118.68 122.92 3ifv s LEU 133 Ca -0.09 -0.52 -0.31 0.00 0.05 0.00 0.00 54.13 53.26 3ifv s LEU 133 Cb -0.16 1.64 -0.09 0.00 -2.05 0.00 0.00 46.19 45.54 3ifv s LEU 133 CO 0.04 -0.89 1.46 -1.61 -0.55 0.00 0.00 176.35 174.81 3ifv s GLU 134 N -3.86 4.28 0.22 1.48 0.41 -1.26 -0.30 118.70 119.67 3ifv s GLU 134 Ca 0.07 2.19 0.01 0.00 -0.41 0.00 0.00 54.97 56.84 3ifv s GLU 134 Cb 0.02 -3.21 0.55 0.00 -1.78 0.00 0.00 34.13 29.71 3ifv s GLU 134 CO -0.07 -0.50 1.12 0.41 -0.49 0.00 0.00 175.26 175.73 3ifv n GLY 135 N 3.56 -0.98 0.34 -1.39 0.00 -0.27 -1.33 105.19 105.12 3ifv n GLY 135 Ca 0.12 0.70 0.17 0.00 0.00 0.00 0.00 46.02 47.02 3ifv n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ifv h THR 136 N 0.00 0.50 -0.36 2.61 1.03 -1.84 -1.50 112.91 113.35 3ifv h THR 136 Ca 0.43 -0.18 -0.00 0.00 -0.01 0.00 0.00 66.41 66.65 3ifv h THR 136 Cb 0.89 -0.07 -0.02 0.00 -1.07 0.00 0.00 68.15 67.89 3ifv h THR 136 CO -0.67 0.10 0.21 0.45 -0.01 0.00 0.00 175.52 175.59 3ifv h HIS 137 N 0.52 0.47 -0.51 0.00 3.86 -1.59 0.24 115.15 118.15 3ifv h HIS 137 Ca 0.64 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.77 3ifv h HIS 137 Cb 1.24 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.53 3ifv h HIS 137 CO -0.03 0.35 0.04 1.25 0.86 0.00 0.00 177.93 180.40 3ifv h LEU 138 N 0.46 0.84 -0.41 2.43 5.85 -1.41 0.13 115.31 123.20 3ifv h LEU 138 Ca 0.13 -0.28 0.06 0.00 0.84 0.00 0.00 57.88 58.62 3ifv h LEU 138 Cb 0.02 -0.22 -0.09 0.00 0.37 0.00 0.00 40.66 40.74 3ifv h LEU 138 CO -0.02 0.91 -0.52 0.44 -0.34 0.00 0.00 178.44 178.91 3ifv h ASP 139 N 0.74 -1.74 -0.38 1.25 5.19 -1.03 -1.46 116.42 118.98 3ifv h ASP 139 Ca 0.15 0.24 0.06 0.00 -0.62 0.00 0.00 57.03 56.86 3ifv h ASP 139 Cb 0.46 0.73 -0.06 0.00 0.18 0.00 0.00 39.33 40.64 3ifv h ASP 139 CO 0.02 -0.40 0.04 -0.09 -3.12 0.00 0.00 179.24 175.70 3ifv h ARG 140 N -0.38 0.15 -0.79 3.56 2.43 -0.79 -0.79 114.38 117.77 3ifv h ARG 140 Ca 0.09 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3ifv h ARG 140 Cb 0.60 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 3ifv h ARG 140 CO -0.60 0.10 0.38 0.78 -1.51 0.00 0.00 179.97 179.13 3ifv h GLY 141 N 0.16 1.22 0.99 2.80 0.00 -0.65 -2.46 103.07 105.12 3ifv h GLY 141 Ca 0.18 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.81 3ifv h GLY 141 CO -0.27 0.57 -0.20 -2.22 0.00 0.00 0.00 176.54 174.42 3ifv h ILE 142 N 1.13 1.29 -0.41 2.60 2.04 -0.90 -0.98 117.51 122.28 3ifv h ILE 142 Ca 0.27 -1.33 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 3ifv h ILE 142 Cb 0.11 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3ifv h ILE 142 CO -0.03 0.44 0.22 0.50 0.00 0.00 0.00 178.15 179.28 3ifv h LYS 143 N 0.54 0.57 -0.00 2.37 3.64 -1.13 -1.32 116.57 121.25 3ifv h LYS 143 Ca 0.08 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3ifv h LYS 143 Cb 0.75 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3ifv h LYS 143 CO 0.06 0.46 0.00 0.00 -2.27 0.00 0.00 179.45 177.70 3ifv h ALA 144 N 1.08 0.00 -0.83 5.00 0.00 -1.39 -3.00 119.26 120.13 3ifv h ALA 144 Ca 0.14 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.07 3ifv h ALA 144 Cb 0.06 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.74 3ifv h ALA 144 CO -0.02 -0.35 0.37 0.00 0.00 0.00 0.00 179.25 179.25 3ifv h ALA 145 N 0.70 1.25 -0.58 0.00 0.00 -1.13 -2.43 119.26 117.09 3ifv h ALA 145 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.13 3ifv h ALA 145 Cb 0.30 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3ifv h ALA 145 CO 0.00 -0.22 0.39 0.22 0.00 0.00 0.00 179.25 179.64 3ifv h ASP 146 N 0.48 0.35 -0.06 0.00 3.58 -1.09 -1.39 116.42 118.30 3ifv h ASP 146 Ca 0.48 0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.95 3ifv h ASP 146 Cb 0.78 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.76 3ifv h ASP 146 CO -0.44 0.21 0.08 0.24 -2.88 0.00 0.00 179.24 176.46 3ifv h MET 147 N 0.39 0.00 0.00 0.28 2.86 -1.42 -3.30 114.93 113.74 3ifv h MET 147 Ca 0.26 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.87 3ifv h MET 147 Cb 0.52 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 3ifv h MET 147 CO -0.07 0.00 -1.15 1.33 1.06 0.00 0.00 176.91 178.08 3ifv n VAL 148 N -3.69 0.13 -4.09 -2.22 0.24 -0.66 -5.10 118.33 102.94 3ifv n VAL 148 Ca -0.01 -0.09 -0.11 0.00 -2.04 0.00 0.00 64.34 62.08 3ifv n VAL 148 Cb 0.17 -0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 31.79 3ifv n VAL 148 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3ifv s SER 149 N -3.10 0.18 0.00 -1.34 0.15 -0.61 -4.26 113.70 104.71 3ifv s SER 149 Ca -0.01 -1.20 0.14 0.00 0.70 0.00 0.00 55.95 55.59 3ifv s SER 149 Cb 0.01 0.52 0.33 0.00 -1.71 0.00 0.00 66.02 65.17 3ifv s SER 149 CO 0.10 -1.05 1.24 0.47 1.20 0.00 0.00 173.24 175.20 3ifv n ASP 150 N -0.52 2.97 -4.59 5.45 8.00 -1.26 -4.26 116.55 122.34 3ifv n ASP 150 Ca 0.00 -1.90 -0.34 0.00 0.71 0.00 0.00 54.79 53.26 3ifv n ASP 150 Cb 0.63 -0.23 -0.11 0.00 -0.02 0.00 0.00 41.12 41.40 3ifv n ASP 150 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3ifv s HIS 151 N -1.06 3.08 -0.06 1.24 3.76 -1.26 -1.35 115.29 119.64 3ifv s HIS 151 Ca 0.27 -0.05 0.04 0.00 -0.15 0.00 0.00 55.06 55.18 3ifv s HIS 151 Cb 0.15 -1.88 -0.00 0.00 1.11 0.00 0.00 32.58 31.96 3ifv s HIS 151 CO 0.20 0.21 -0.20 -1.50 -0.85 0.00 0.00 174.74 172.60 3ifv s ILE 152 N -0.22 1.68 -0.18 0.60 2.07 -0.13 -4.66 121.20 120.37 3ifv s ILE 152 Ca 0.05 -0.83 -0.07 0.00 -1.41 0.00 0.00 60.65 58.38 3ifv s ILE 152 Cb -0.13 -1.45 -0.04 0.00 0.13 0.00 0.00 42.46 40.97 3ifv s ILE 152 CO 0.02 0.48 0.06 -0.60 -1.91 0.00 0.00 174.94 172.98 3ifv s ARG 153 N 0.16 3.94 -0.19 3.50 3.52 0.46 -0.46 118.95 129.88 3ifv s ARG 153 Ca -0.09 -0.35 -0.03 0.00 -0.13 0.00 0.00 55.73 55.13 3ifv s ARG 153 Cb -0.14 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.05 3ifv s ARG 153 CO 0.04 0.29 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.25 3ifv s LEU 154 N 0.31 2.88 -0.01 -0.88 1.02 -0.80 -1.00 118.68 120.19 3ifv s LEU 154 Ca 0.03 -0.35 -0.06 0.00 0.02 0.00 0.00 54.13 53.78 3ifv s LEU 154 Cb -0.12 -1.71 0.00 0.00 0.02 0.00 0.00 46.19 44.38 3ifv s LEU 154 CO 0.00 0.05 0.12 -0.60 0.02 0.00 0.00 176.35 175.94 3ifv s ARG 155 N 1.04 0.35 0.02 1.70 3.52 -0.15 -2.09 118.95 123.34 3ifv s ARG 155 Ca 0.00 -0.21 0.05 0.00 -0.13 0.00 0.00 55.73 55.44 3ifv s ARG 155 Cb -0.15 0.15 -0.03 0.00 -1.56 0.00 0.00 34.95 33.36 3ifv s ARG 155 CO -0.00 -0.07 -0.12 0.08 -0.81 0.00 0.00 175.30 174.37 3ifv s VAL 156 N -0.88 3.24 -0.45 7.11 1.01 -0.35 0.65 120.40 130.73 3ifv s VAL 156 Ca -0.10 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 60.81 3ifv s VAL 156 Cb -0.06 -2.39 0.10 0.00 0.00 0.00 0.00 36.38 34.03 3ifv s VAL 156 CO 0.01 0.37 0.32 -0.62 0.00 0.00 0.00 175.10 175.18 3ifv s ASP 157 N -1.43 5.74 0.18 3.32 -1.08 0.46 -4.51 116.67 119.35 3ifv s ASP 157 Ca 0.16 -1.68 -0.13 0.00 -0.52 0.00 0.00 52.55 50.38 3ifv s ASP 157 Cb -0.11 -2.03 0.14 0.00 -1.46 0.00 0.00 42.92 39.47 3ifv s ASP 157 CO 0.07 -0.64 1.78 1.23 0.52 0.00 0.00 175.17 178.13 3ifv h GLY 158 N 8.49 0.70 0.24 2.66 0.00 -1.85 0.14 103.07 113.45 3ifv h GLY 158 Ca -0.23 -0.16 0.01 0.00 0.00 0.00 0.00 47.33 46.95 3ifv h GLY 158 CO 0.83 0.09 -0.48 0.00 0.00 0.00 0.00 176.54 176.97 3ifv h ALA 159 N 1.29 -0.92 -0.23 3.60 0.00 -1.93 -1.87 119.26 119.21 3ifv h ALA 159 Ca 0.23 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ifv h ALA 159 Cb 0.16 0.80 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3ifv h ALA 159 CO -0.18 -1.08 0.00 0.39 0.00 0.00 0.00 179.25 178.38 3ifv n GLU 160 N -5.49 1.66 -4.02 0.00 1.02 -1.17 -4.94 120.64 107.70 3ifv n GLU 160 Ca -0.09 -0.87 -0.34 0.00 -0.02 0.00 0.00 57.16 55.85 3ifv n GLU 160 Cb 0.41 -1.28 -0.02 0.00 -0.02 0.00 0.00 31.44 30.53 3ifv n GLU 160 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3ifv n GLU 161 N 0.19 -0.59 -4.40 3.49 1.02 0.01 -4.58 120.64 115.77 3ifv n GLU 161 Ca 0.08 -0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.94 3ifv n GLU 161 Cb 0.26 -2.29 -0.17 0.00 -0.02 0.00 0.00 31.44 29.23 3ifv n GLU 161 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3ifv s THR 162 N -3.94 1.45 -0.09 2.62 2.01 -1.02 -3.58 115.64 113.09 3ifv s THR 162 Ca 0.24 -0.61 -0.18 0.00 0.31 0.00 0.00 61.69 61.45 3ifv s THR 162 Cb -0.13 -1.33 -0.05 0.00 0.01 0.00 0.00 72.50 71.00 3ifv s THR 162 CO 0.81 0.43 0.49 0.12 -0.69 0.00 0.00 174.62 175.78 3ifv s PHE 163 N 1.05 3.56 -0.03 4.92 5.36 -0.84 -0.40 117.98 131.60 3ifv s PHE 163 Ca -0.06 0.95 0.04 0.00 -0.96 0.00 0.00 56.93 56.91 3ifv s PHE 163 Cb -0.15 -2.53 -0.03 0.00 -0.34 0.00 0.00 43.02 39.98 3ifv s PHE 163 CO -0.02 0.25 -0.15 -1.01 -1.46 0.00 0.00 175.22 172.83 3ifv s HIS 164 N 0.29 2.67 -0.23 10.12 3.76 0.21 -0.80 115.29 131.30 3ifv s HIS 164 Ca 0.26 -0.18 -0.00 0.00 -0.15 0.00 0.00 55.06 54.99 3ifv s HIS 164 Cb -0.16 -1.59 0.03 0.00 1.11 0.00 0.00 32.58 31.97 3ifv s HIS 164 CO 0.12 0.20 -0.11 0.42 -0.85 0.00 0.00 174.74 174.51 3ifv s ILE 165 N -0.77 2.52 0.05 0.60 1.01 -0.59 -0.98 121.20 123.05 3ifv s ILE 165 Ca 0.12 -1.11 -0.06 0.00 0.00 0.00 0.00 60.65 59.60 3ifv s ILE 165 Cb -0.11 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.09 3ifv s ILE 165 CO 0.02 0.25 0.12 -1.83 0.00 0.00 0.00 174.94 173.49 3ifv s GLU 166 N 1.27 0.68 0.03 2.79 -1.05 -0.17 -0.60 118.70 121.65 3ifv s GLU 166 Ca -0.00 -0.87 -0.08 0.00 -0.15 0.00 0.00 54.97 53.87 3ifv s GLU 166 Cb -0.16 0.27 -0.00 0.00 -0.44 0.00 0.00 34.13 33.80 3ifv s GLU 166 CO -0.07 -0.18 0.16 0.00 0.95 0.00 0.00 175.26 176.12 3ifv s ALA 167 N -3.18 -0.29 -0.13 -0.84 0.00 -0.51 -0.41 121.76 116.41 3ifv s ALA 167 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.66 3ifv s ALA 167 Cb 0.02 0.22 0.02 0.00 0.00 0.00 0.00 23.12 23.39 3ifv s ALA 167 CO -0.07 -0.31 -0.12 -2.00 0.00 0.00 0.00 175.76 173.26 3ifv s GLU 168 N -2.25 2.03 0.10 0.00 2.12 -1.26 -1.41 118.70 118.04 3ifv s GLU 168 Ca -0.08 -0.46 0.00 0.00 0.36 0.00 0.00 54.97 54.80 3ifv s GLU 168 Cb -0.03 -1.91 0.02 0.00 0.26 0.00 0.00 34.13 32.47 3ifv s GLU 168 CO -0.02 -0.23 0.14 0.41 -0.54 0.00 0.00 175.26 175.02 3ifv n GLY 169 N 4.77 0.92 0.24 -1.50 0.00 0.22 -4.70 105.19 105.14 3ifv n GLY 169 Ca -0.16 -1.99 -0.01 0.00 0.00 0.00 0.00 46.02 43.86 3ifv n GLY 169 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ifv h ASP 170 N -0.07 0.36 0.00 1.61 3.32 -2.01 -3.38 116.42 116.25 3ifv h ASP 170 Ca -0.05 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3ifv h ASP 170 Cb 0.18 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3ifv h ASP 170 CO 0.05 0.23 -0.42 0.35 -1.72 0.00 0.00 179.24 177.72 3ifv n THR 171 N -4.91 0.00 -3.82 0.35 -2.24 -1.26 -5.11 114.28 97.29 3ifv n THR 171 Ca 0.08 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.65 3ifv n THR 171 Cb 0.22 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 3ifv n THR 171 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3ifv s ASP 172 N -1.35 5.43 0.01 3.42 1.11 -1.26 -5.14 116.67 118.89 3ifv s ASP 172 Ca 0.00 -0.41 -0.08 0.00 0.18 0.00 0.00 52.55 52.25 3ifv s ASP 172 Cb 0.00 -1.09 0.00 0.00 1.07 0.00 0.00 42.92 42.90 3ifv s ASP 172 CO 0.00 -0.31 0.15 -1.81 1.18 0.00 0.00 175.17 174.38 3ifv s ASP 173 N -3.99 0.03 0.04 0.27 1.01 -1.26 0.70 116.67 113.47 3ifv s ASP 173 Ca 0.40 -0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.42 3ifv s ASP 173 Cb -0.07 0.22 -0.03 0.00 1.01 0.00 0.00 42.92 44.06 3ifv s ASP 173 CO 0.27 -0.41 -0.06 0.54 0.21 0.00 0.00 175.17 175.72 3ifv s VAL 174 N -1.67 0.37 -0.27 -1.27 0.11 -0.50 -5.01 120.40 112.16 3ifv s VAL 174 Ca -0.12 -1.18 0.00 0.00 -2.93 0.00 0.00 61.98 57.75 3ifv s VAL 174 Cb -0.06 -0.68 0.16 0.00 -1.53 0.00 0.00 36.38 34.27 3ifv s VAL 174 CO 0.00 -0.53 0.45 -0.62 -3.33 0.00 0.00 175.10 171.07 3ifv s ASP 175 N -1.82 -0.22 -0.48 3.54 2.15 -1.26 -1.42 116.67 117.17 3ifv s ASP 175 Ca -0.08 0.14 -0.27 0.00 0.43 0.00 0.00 52.55 52.77 3ifv s ASP 175 Cb -0.07 1.41 0.03 0.00 -0.30 0.00 0.00 42.92 43.99 3ifv s ASP 175 CO -0.02 -0.31 1.00 -0.22 -0.17 0.00 0.00 175.17 175.46 3ifv s LEU 176 N 2.63 3.87 -0.28 -1.34 2.96 0.23 -4.96 118.68 121.80 3ifv s LEU 176 Ca 0.13 0.19 -0.11 0.00 -0.22 0.00 0.00 54.13 54.12 3ifv s LEU 176 Cb -0.14 -3.28 -0.05 0.00 0.50 0.00 0.00 46.19 43.22 3ifv s LEU 176 CO -0.23 -1.14 0.18 -0.55 -1.32 0.00 0.00 176.35 173.29 3ifv s SER 177 N 2.39 5.99 -0.57 3.68 0.15 -1.26 -1.54 113.70 122.54 3ifv s SER 177 Ca 0.40 -0.01 0.03 0.00 0.70 0.00 0.00 55.95 57.07 3ifv s SER 177 Cb -0.09 -2.11 0.14 0.00 -1.71 0.00 0.00 66.02 62.25 3ifv s SER 177 CO 0.28 -0.04 0.33 -0.76 1.20 0.00 0.00 173.24 174.25 3ifv s LEU 178 N 1.71 4.57 0.00 3.45 1.43 0.02 -4.99 118.68 124.86 3ifv s LEU 178 Ca 0.07 -3.11 -0.16 0.00 -1.03 0.00 0.00 54.13 49.91 3ifv s LEU 178 Cb -0.16 -1.69 0.23 0.00 0.03 0.00 0.00 46.19 44.60 3ifv s LEU 178 CO 0.10 -0.24 1.01 -0.81 0.23 0.00 0.00 176.35 176.65 3ifv n PRO 179 N 3.02 -2.03 -0.27 1.29 -0.04 -1.26 -1.99 135.00 133.72 3ifv n PRO 179 Ca 0.08 -1.59 0.07 0.00 -0.04 0.00 0.00 63.50 62.02 3ifv n PRO 179 Cb 0.33 -1.28 0.21 0.00 -0.04 0.00 0.00 33.50 32.73 3ifv n PRO 179 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 3ifv h PRO 180 N 0.00 0.38 -0.31 0.54 0.11 -1.81 0.95 132.00 131.86 3ifv h PRO 180 Ca -0.35 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.82 3ifv h PRO 180 Cb 1.03 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3ifv h PRO 180 CO 0.24 0.25 0.36 0.00 -0.21 0.00 0.00 178.00 178.64 3ifv h ALA 181 N 1.61 1.96 -0.45 -0.75 0.00 -1.93 -0.61 119.26 119.09 3ifv h ALA 181 Ca 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.35 3ifv h ALA 181 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3ifv h ALA 181 CO -0.47 -0.52 0.00 -0.25 0.00 0.00 0.00 179.25 178.01 3ifv n ASP 182 N -3.68 3.55 -4.59 0.00 8.00 0.32 -4.96 116.55 115.19 3ifv n ASP 182 Ca 0.05 -2.23 -0.25 0.00 0.71 0.00 0.00 54.79 53.06 3ifv n ASP 182 Cb 0.51 -0.38 -0.09 0.00 -0.02 0.00 0.00 41.12 41.14 3ifv n ASP 182 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ifv s LEU 183 N -1.43 3.04 -0.09 0.64 1.43 -0.24 -4.75 118.68 117.29 3ifv s LEU 183 Ca 0.35 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 52.71 3ifv s LEU 183 Cb 0.21 -1.66 -0.09 0.00 0.03 0.00 0.00 46.19 44.67 3ifv s LEU 183 CO 0.19 0.07 0.43 0.40 0.23 0.00 0.00 176.35 177.66 3ifv h ILE 184 N 2.44 0.52 -3.89 -0.59 2.04 -1.09 -3.49 117.51 113.44 3ifv h ILE 184 Ca -0.46 -1.22 -0.12 0.00 1.00 0.00 0.00 64.86 64.07 3ifv h ILE 184 Cb 1.22 0.94 -0.10 0.00 -0.74 0.00 0.00 36.82 38.14 3ifv h ILE 184 CO 0.57 0.16 -0.23 -0.94 0.00 0.00 0.00 178.15 177.71 3ifv s SER 185 N -5.56 0.05 -0.22 1.72 1.04 -0.71 -4.94 113.70 105.07 3ifv s SER 185 Ca -0.07 -1.08 -0.14 0.00 0.48 0.00 0.00 55.95 55.13 3ifv s SER 185 Cb -0.00 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.74 3ifv s SER 185 CO 0.27 -1.10 0.55 -0.51 0.98 0.00 0.00 173.24 173.43 3ifv s ILE 186 N -3.94 -0.01 -0.44 -1.02 2.07 -1.26 -0.67 121.20 115.92 3ifv s ILE 186 Ca 0.27 0.04 -0.08 0.00 -1.41 0.00 0.00 60.65 59.46 3ifv s ILE 186 Cb 0.01 -0.80 0.10 0.00 0.13 0.00 0.00 42.46 41.91 3ifv s ILE 186 CO 0.11 0.02 0.29 -1.61 -1.91 0.00 0.00 174.94 171.83 3ifv s GLU 187 N 1.24 2.45 -1.00 3.50 2.02 0.19 -4.99 118.70 122.12 3ifv s GLU 187 Ca -0.08 -1.66 -0.06 0.00 0.02 0.00 0.00 54.97 53.19 3ifv s GLU 187 Cb -0.06 -3.82 -0.02 0.00 0.10 0.00 0.00 34.13 30.34 3ifv s GLU 187 CO -0.12 -1.09 2.85 0.00 0.02 0.00 0.00 175.26 176.91 3ifv n ALA 188 N 4.86 6.88 -0.99 5.21 0.00 -1.26 -1.42 120.51 133.79 3ifv n ALA 188 Ca -0.08 -3.32 -0.33 0.00 0.00 0.00 0.00 53.44 49.71 3ifv n ALA 188 Cb 0.42 -2.73 0.14 0.00 0.00 0.00 0.00 19.45 17.27 3ifv n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ifv n GLY 189 N 2.19 -0.21 3.66 0.00 0.00 -1.20 -4.43 105.19 105.21 3ifv n GLY 189 Ca 0.61 -0.55 -0.49 0.00 0.00 0.00 0.00 46.02 45.59 3ifv n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ifv n ALA 190 N -3.52 0.58 -3.61 4.61 0.00 -1.26 -4.54 120.51 112.77 3ifv n ALA 190 Ca 0.13 0.40 -0.12 0.00 0.00 0.00 0.00 53.44 53.85 3ifv n ALA 190 Cb 0.51 -2.33 -0.07 0.00 0.00 0.00 0.00 19.45 17.56 3ifv n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ifv s ALA 191 N 2.21 -1.90 -0.30 0.00 0.00 -1.26 -4.45 121.76 116.06 3ifv s ALA 191 Ca 0.87 1.80 -0.13 0.00 0.00 0.00 0.00 51.96 54.50 3ifv s ALA 191 Cb -0.79 -1.09 0.18 0.00 0.00 0.00 0.00 23.12 21.43 3ifv s ALA 191 CO 0.48 -0.29 1.05 0.34 0.00 0.00 0.00 175.76 177.34 3ifv s ASP 192 N -0.13 -0.45 0.07 0.00 -1.08 -0.14 -1.21 116.67 113.73 3ifv s ASP 192 Ca -0.00 0.22 0.02 0.00 -0.52 0.00 0.00 52.55 52.28 3ifv s ASP 192 Cb -0.04 1.36 -0.03 0.00 -1.46 0.00 0.00 42.92 42.75 3ifv s ASP 192 CO -0.01 -0.08 -0.08 -0.44 0.52 0.00 0.00 175.17 175.08 3ifv s SER 193 N 2.95 1.07 -0.03 -0.34 0.01 -0.89 -2.19 113.70 114.28 3ifv s SER 193 Ca 0.05 -0.78 0.02 0.00 1.31 0.00 0.00 55.95 56.56 3ifv s SER 193 Cb -0.08 0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.17 3ifv s SER 193 CO -0.14 -0.32 -0.08 -0.22 0.41 0.00 0.00 173.24 172.90 3ifv s LEU 194 N -2.31 3.12 0.04 2.44 2.96 -1.26 -1.90 118.68 121.77 3ifv s LEU 194 Ca 0.01 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3ifv s LEU 194 Cb -0.03 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 3ifv s LEU 194 CO -0.02 0.32 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.96 3ifv s PHE 195 N -0.89 0.41 -0.02 5.38 0.40 0.40 0.11 117.98 123.76 3ifv s PHE 195 Ca 0.14 -0.85 -0.30 0.00 -0.60 0.00 0.00 56.93 55.33 3ifv s PHE 195 Cb -0.11 -0.30 -0.07 0.00 0.51 0.00 0.00 43.02 43.04 3ifv s PHE 195 CO 0.04 -0.32 1.92 0.45 0.70 0.00 0.00 175.22 178.00 3ifv s SER 196 N -2.41 6.38 0.26 1.36 0.15 -1.26 -0.95 113.70 117.22 3ifv s SER 196 Ca -0.01 2.45 0.04 0.00 0.70 0.00 0.00 55.95 59.13 3ifv s SER 196 Cb 0.02 -2.53 0.33 0.00 -1.71 0.00 0.00 66.02 62.13 3ifv s SER 196 CO -0.07 -1.14 1.63 0.25 1.20 0.00 0.00 173.24 175.10 3ifv h LEU 197 N 11.10 0.31 -0.87 3.45 6.46 -1.54 -2.80 115.31 131.42 3ifv h LEU 197 Ca -0.46 -0.15 -0.08 0.00 -0.12 0.00 0.00 57.88 57.07 3ifv h LEU 197 Cb 1.22 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 41.04 3ifv h LEU 197 CO 0.95 0.75 -0.00 0.44 -0.62 0.00 0.00 178.44 179.96 3ifv h ASP 198 N 0.23 0.80 -0.22 1.25 3.32 -1.90 0.15 116.42 120.05 3ifv h ASP 198 Ca 0.01 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.76 3ifv h ASP 198 Cb 0.95 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.28 3ifv h ASP 198 CO 0.08 0.87 -0.26 1.88 -1.72 0.00 0.00 179.24 180.09 3ifv h TYR 199 N 0.77 0.69 -0.89 4.55 -1.99 -1.94 -1.20 116.97 116.96 3ifv h TYR 199 Ca 0.15 -0.22 0.01 0.00 2.00 0.00 0.00 58.73 60.67 3ifv h TYR 199 Cb 0.47 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.02 3ifv h TYR 199 CO 0.03 0.92 0.59 1.25 -0.00 0.00 0.00 178.16 180.95 3ifv h LEU 200 N 0.25 1.02 -0.29 3.88 5.85 -1.18 -1.45 115.31 123.40 3ifv h LEU 200 Ca 0.03 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 3ifv h LEU 200 Cb 0.83 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3ifv h LEU 200 CO 0.06 0.73 -0.02 0.50 -0.34 0.00 0.00 178.44 179.38 3ifv h LYS 201 N 1.20 0.52 -0.11 1.25 3.64 -0.67 -0.05 116.57 122.35 3ifv h LYS 201 Ca 0.33 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 3ifv h LYS 201 Cb -0.13 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 3ifv h LYS 201 CO -0.07 0.69 -0.01 -0.44 -2.27 0.00 0.00 179.45 177.34 3ifv h ASP 202 N 0.31 -0.06 0.12 4.20 3.32 -0.95 -1.96 116.42 121.39 3ifv h ASP 202 Ca 0.08 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.18 3ifv h ASP 202 Cb 0.46 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 3ifv h ASP 202 CO 0.02 -0.01 -0.37 0.24 -1.72 0.00 0.00 179.24 177.40 3ifv h MET 203 N 0.03 -0.58 -1.01 3.56 2.86 -1.14 -2.60 114.93 116.05 3ifv h MET 203 Ca 0.05 0.04 0.25 0.00 -2.06 0.00 0.00 59.70 57.98 3ifv h MET 203 Cb 0.07 0.13 -0.09 0.00 0.06 0.00 0.00 31.60 31.77 3ifv h MET 203 CO -0.10 -0.38 0.65 -0.97 1.06 0.00 0.00 176.91 177.17 3ifv h ASN 204 N -0.60 0.48 -1.02 1.22 -1.24 -0.81 -1.48 115.58 112.13 3ifv h ASN 204 Ca 0.03 0.08 0.25 0.00 0.71 0.00 0.00 56.30 57.37 3ifv h ASN 204 Cb 0.63 -0.00 -0.12 0.00 0.73 0.00 0.00 38.32 39.56 3ifv h ASN 204 CO -0.22 0.12 0.61 0.11 -1.29 0.00 0.00 177.43 176.77 3ifv h LYS 205 N 0.44 0.52 0.00 6.67 1.57 -0.94 -2.49 116.57 122.34 3ifv h LYS 205 Ca 0.57 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 3ifv h LYS 205 Cb 1.38 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.57 3ifv h LYS 205 CO -0.28 0.34 -0.71 0.00 -0.57 0.00 0.00 179.45 178.23 3ifv n ALA 206 N -2.35 3.01 -2.38 3.86 0.00 -0.56 -4.85 120.51 117.25 3ifv n ALA 206 Ca 0.27 -0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 3ifv n ALA 206 Cb 0.78 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 3ifv n ALA 206 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ifv s ILE 207 N -3.17 4.04 0.62 0.00 1.01 -0.94 -4.64 121.20 118.13 3ifv s ILE 207 Ca 0.06 1.40 -0.18 0.00 0.00 0.00 0.00 60.65 61.93 3ifv s ILE 207 Cb 0.14 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 3ifv s ILE 207 CO 0.74 0.01 0.92 -2.65 0.00 0.00 0.00 174.94 173.96 3ifv n PRO 208 N 5.07 0.79 0.29 2.79 -0.02 -1.26 -4.89 135.00 137.77 3ifv n PRO 208 Ca 0.11 0.31 0.15 0.00 -2.02 0.00 0.00 63.50 62.05 3ifv n PRO 208 Cb 0.45 -2.13 0.87 0.00 -0.02 0.00 0.00 33.50 32.67 3ifv n PRO 208 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3ifv h THR 209 N 0.33 0.51 -0.11 3.45 1.35 -1.96 -2.87 112.91 113.61 3ifv h THR 209 Ca -0.48 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 3ifv h THR 209 Cb 1.37 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 3ifv h THR 209 CO 0.50 0.04 0.00 -0.90 -0.25 0.00 0.00 175.52 174.90 3ifv n ASP 210 N -3.74 2.39 -4.57 5.36 5.75 -1.26 -4.31 116.55 116.17 3ifv n ASP 210 Ca -0.03 -2.16 -0.45 0.00 -0.01 0.00 0.00 54.79 52.14 3ifv n ASP 210 Cb 0.13 -0.14 -0.02 0.00 -1.03 0.00 0.00 41.12 40.07 3ifv n ASP 210 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ifv n ALA 211 N -0.31 -0.56 -2.59 2.12 0.00 -1.09 -4.79 120.51 113.29 3ifv n ALA 211 Ca 0.06 0.40 -0.39 0.00 0.00 0.00 0.00 53.44 53.51 3ifv n ALA 211 Cb 0.37 -1.97 -0.05 0.00 0.00 0.00 0.00 19.45 17.79 3ifv n ALA 211 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ifv s GLU 212 N -1.40 4.37 -0.12 0.00 2.02 -1.26 -1.12 118.70 121.19 3ifv s GLU 212 Ca 0.60 0.75 0.01 0.00 0.02 0.00 0.00 54.97 56.36 3ifv s GLU 212 Cb -0.74 -3.39 -0.01 0.00 0.10 0.00 0.00 34.13 30.09 3ifv s GLU 212 CO 0.59 0.24 -0.17 0.08 0.02 0.00 0.00 175.26 176.02 3ifv s VAL 213 N 0.25 2.69 -0.18 2.63 1.01 0.59 -4.48 120.40 122.92 3ifv s VAL 213 Ca 0.33 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.43 3ifv s VAL 213 Cb -0.18 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3ifv s VAL 213 CO 0.17 0.54 0.09 -0.89 0.00 0.00 0.00 175.10 175.01 3ifv s THR 214 N 0.36 5.08 -0.15 3.92 2.01 -0.06 -1.27 115.64 125.52 3ifv s THR 214 Ca -0.14 0.07 0.00 0.00 0.31 0.00 0.00 61.69 61.94 3ifv s THR 214 Cb -0.17 -3.29 -0.00 0.00 0.01 0.00 0.00 72.50 69.05 3ifv s THR 214 CO 0.07 0.47 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.62 3ifv s VAL 215 N 0.20 2.62 -0.10 3.82 1.01 0.76 -0.51 120.40 128.21 3ifv s VAL 215 Ca 0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 3ifv s VAL 215 Cb -0.12 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 3ifv s VAL 215 CO -0.00 0.52 -0.05 -1.61 0.00 0.00 0.00 175.10 173.95 3ifv s GLU 216 N 0.78 3.08 -0.11 2.72 2.02 -0.49 -1.19 118.70 125.51 3ifv s GLU 216 Ca -0.06 -0.52 -0.11 0.00 0.02 0.00 0.00 54.97 54.30 3ifv s GLU 216 Cb -0.15 -2.72 0.03 0.00 0.10 0.00 0.00 34.13 31.39 3ifv s GLU 216 CO 0.00 0.53 0.30 -1.17 0.02 0.00 0.00 175.26 174.95 3ifv s LEU 217 N -0.44 0.84 0.00 1.80 2.96 -1.09 -1.38 118.68 121.37 3ifv s LEU 217 Ca 0.07 0.61 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 3ifv s LEU 217 Cb -0.12 1.04 0.00 0.00 0.50 0.00 0.00 46.19 47.61 3ifv s LEU 217 CO 0.02 -0.11 0.00 0.61 -1.32 0.00 0.00 176.35 175.56 3ifv n GLY 218 N 2.91 5.16 3.22 7.98 0.00 -1.26 -1.46 105.19 121.74 3ifv n GLY 218 Ca -0.13 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 3ifv n GLY 218 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ifv s GLU 219 N 1.90 2.66 -1.06 1.61 2.02 -1.26 -0.96 118.70 123.61 3ifv s GLU 219 Ca 0.00 -1.12 -0.19 0.00 0.02 0.00 0.00 54.97 53.68 3ifv s GLU 219 Cb 0.00 -3.22 0.02 0.00 0.10 0.00 0.00 34.13 31.03 3ifv s GLU 219 CO 0.00 -0.55 0.69 0.39 0.02 0.00 0.00 175.26 175.81 3ifv n GLU 220 N 4.71 -0.93 -4.01 1.61 1.02 -0.93 -4.95 120.64 117.16 3ifv n GLU 220 Ca -0.14 0.46 -0.09 0.00 -0.02 0.00 0.00 57.16 57.37 3ifv n GLU 220 Cb 0.45 -3.11 -0.08 0.00 -0.02 0.00 0.00 31.44 28.68 3ifv n GLU 220 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3ifv s PHE 221 N -3.33 0.48 0.82 -0.32 0.08 -1.26 -4.98 117.98 109.47 3ifv s PHE 221 Ca 0.32 -0.90 -0.12 0.00 0.12 0.00 0.00 56.93 56.35 3ifv s PHE 221 Cb -0.15 -0.23 0.09 0.00 -0.57 0.00 0.00 43.02 42.16 3ifv s PHE 221 CO 0.91 -0.56 1.17 -2.14 -0.10 0.00 0.00 175.22 174.50 3ifv s PRO 222 N -3.95 1.64 0.01 0.24 0.02 -1.26 -4.34 135.00 127.35 3ifv s PRO 222 Ca 0.14 1.61 -0.04 0.00 0.02 0.00 0.00 61.00 62.73 3ifv s PRO 222 Cb 0.06 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.74 3ifv s PRO 222 CO -0.04 -2.18 0.22 0.54 -0.33 0.00 0.00 177.00 175.21 3ifv s VAL 223 N -2.37 5.37 -0.03 3.83 0.11 -0.68 -4.49 120.40 122.15 3ifv s VAL 223 Ca 0.70 -0.04 0.04 0.00 -2.93 0.00 0.00 61.98 59.75 3ifv s VAL 223 Cb -0.25 -3.56 -0.03 0.00 -1.53 0.00 0.00 36.38 31.01 3ifv s VAL 223 CO 0.52 0.32 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.92 3ifv s LYS 224 N -1.92 2.41 -0.05 1.54 1.02 -0.48 -0.53 119.74 121.73 3ifv s LYS 224 Ca 0.28 -0.76 0.06 0.00 0.02 0.00 0.00 55.97 55.57 3ifv s LYS 224 Cb -0.13 -2.34 -0.01 0.00 -0.52 0.00 0.00 37.83 34.83 3ifv s LYS 224 CO 0.18 0.60 -0.23 -0.51 -0.92 0.00 0.00 175.35 174.48 3ifv s LEU 225 N -0.92 2.03 -0.07 3.17 1.43 0.13 -1.40 118.68 123.05 3ifv s LEU 225 Ca 0.13 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 3ifv s LEU 225 Cb -0.11 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 44.86 3ifv s LEU 225 CO 0.02 0.22 -0.19 -1.00 0.23 0.00 0.00 176.35 175.63 3ifv s HIS 226 N -0.09 1.95 0.17 0.29 3.76 0.33 -0.10 115.29 121.60 3ifv s HIS 226 Ca -0.04 -0.68 -0.12 0.00 -0.15 0.00 0.00 55.06 54.07 3ifv s HIS 226 Cb -0.13 -1.33 0.01 0.00 1.11 0.00 0.00 32.58 32.24 3ifv s HIS 226 CO 0.03 -0.27 0.37 1.52 -0.85 0.00 0.00 174.74 175.54 3ifv s TYR 227 N 0.26 0.19 0.09 1.40 -0.85 -0.31 -0.88 117.35 117.25 3ifv s TYR 227 Ca -0.11 -0.55 0.06 0.00 -0.52 0.00 0.00 57.07 55.96 3ifv s TYR 227 Cb -0.15 0.11 -0.04 0.00 0.38 0.00 0.00 41.96 42.27 3ifv s TYR 227 CO 0.05 -0.78 -0.09 -0.65 -1.52 0.00 0.00 175.55 172.55 3ifv s GLN 228 N -3.93 2.23 0.28 -3.49 -0.21 -1.26 0.41 119.66 113.70 3ifv s GLN 228 Ca 0.13 -0.96 0.01 0.00 0.02 0.00 0.00 55.36 54.57 3ifv s GLN 228 Cb 0.02 -2.35 -0.01 0.00 1.00 0.00 0.00 33.01 31.67 3ifv s GLN 228 CO -0.02 0.53 0.05 0.44 -2.12 0.00 0.00 175.29 174.17 3ifv n ILE 229 N 0.84 0.00 -4.00 1.08 -5.35 0.48 -4.75 119.36 107.66 3ifv n ILE 229 Ca -0.14 -1.49 -0.31 0.00 -0.27 0.00 0.00 62.75 60.55 3ifv n ILE 229 Cb 0.52 0.44 0.00 0.00 -1.74 0.00 0.00 39.64 38.86 3ifv n ILE 229 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ifv n ALA 230 N -1.88 -1.44 -2.66 -1.28 0.00 -1.26 -0.11 120.51 111.88 3ifv n ALA 230 Ca -0.11 0.04 -0.18 0.00 0.00 0.00 0.00 53.44 53.19 3ifv n ALA 230 Cb 0.39 -3.57 0.02 0.00 0.00 0.00 0.00 19.45 16.28 3ifv n ALA 230 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3ifv n GLU 231 N -4.52 -3.00 -0.72 0.00 4.07 -1.26 -1.36 120.64 113.84 3ifv n GLU 231 Ca -0.02 0.78 0.00 0.00 -0.06 0.00 0.00 57.16 57.86 3ifv n GLU 231 Cb 0.55 -5.27 0.00 0.00 -0.06 0.00 0.00 31.44 26.66 3ifv n GLU 231 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3ifv n GLY 232 N -1.24 0.70 0.12 8.31 0.00 0.31 -4.88 105.19 108.49 3ifv n GLY 232 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.00 3ifv n GLY 232 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ifv h MET 233 N 2.27 0.00 -5.67 1.61 2.86 0.08 -3.46 114.93 112.63 3ifv h MET 233 Ca 0.00 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.10 3ifv h MET 233 Cb 0.00 0.00 -0.29 0.00 0.06 0.00 0.00 31.60 31.37 3ifv h MET 233 CO 0.00 0.00 -0.83 0.20 1.06 0.00 0.00 176.91 177.34 3ifv s GLY 234 N -3.95 0.87 -0.06 8.32 0.00 0.84 -1.84 107.32 111.51 3ifv s GLY 234 Ca 0.05 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 44.02 3ifv s GLY 234 CO 0.71 -0.67 -0.13 -0.51 0.00 0.00 0.00 173.10 172.51 3ifv s THR 235 N -0.48 1.14 -0.03 0.90 -4.23 -0.38 0.18 115.64 112.74 3ifv s THR 235 Ca 0.06 -0.50 0.07 0.00 -1.18 0.00 0.00 61.69 60.14 3ifv s THR 235 Cb -0.07 -1.03 -0.02 0.00 1.34 0.00 0.00 72.50 72.72 3ifv s THR 235 CO -0.00 0.35 -0.23 -0.63 -0.54 0.00 0.00 174.62 173.57 3ifv s ILE 236 N 0.50 2.31 -0.05 2.99 -1.09 0.17 -0.03 121.20 126.01 3ifv s ILE 236 Ca -0.11 -1.01 0.05 0.00 -2.23 0.00 0.00 60.65 57.35 3ifv s ILE 236 Cb -0.14 -1.83 -0.01 0.00 -1.58 0.00 0.00 42.46 38.90 3ifv s ILE 236 CO 0.03 0.58 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.22 3ifv s THR 237 N -0.61 1.72 0.15 2.92 2.01 0.35 -1.16 115.64 121.03 3ifv s THR 237 Ca 0.10 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.29 3ifv s THR 237 Cb -0.10 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 3ifv s THR 237 CO -0.00 0.49 -0.12 -0.31 -0.69 0.00 0.00 174.62 173.98 3ifv s TYR 238 N -0.11 2.63 -0.03 4.92 4.12 0.85 -0.02 117.35 129.71 3ifv s TYR 238 Ca -0.02 -0.22 0.02 0.00 0.02 0.00 0.00 57.07 56.86 3ifv s TYR 238 Cb -0.12 -1.33 0.01 0.00 -1.52 0.00 0.00 41.96 39.00 3ifv s TYR 238 CO 0.02 0.46 -0.06 1.41 0.02 0.00 0.00 175.55 177.40 3ifv s MET 239 N -2.49 0.86 -0.11 -0.62 1.75 -0.65 -0.69 119.30 117.35 3ifv s MET 239 Ca 0.22 -0.19 0.01 0.00 -1.25 0.00 0.00 55.69 54.49 3ifv s MET 239 Cb -0.10 -0.83 0.02 0.00 2.84 0.00 0.00 34.83 36.76 3ifv s MET 239 CO 0.13 0.01 -0.14 -1.17 -0.65 0.00 0.00 175.02 173.20 3ifv s LEU 240 N 0.56 1.65 0.51 4.11 2.96 0.31 -1.23 118.68 127.56 3ifv s LEU 240 Ca -0.08 -0.40 -0.22 0.00 -0.22 0.00 0.00 54.13 53.21 3ifv s LEU 240 Cb -0.11 -1.04 -0.06 0.00 0.50 0.00 0.00 46.19 45.48 3ifv s LEU 240 CO 0.00 -0.00 1.24 0.00 -1.32 0.00 0.00 176.35 176.28 3ifv s ALA 241 N 1.05 2.87 0.76 5.97 0.00 -0.34 -1.69 121.76 130.39 3ifv s ALA 241 Ca -0.06 1.10 -0.12 0.00 0.00 0.00 0.00 51.96 52.88 3ifv s ALA 241 Cb -0.15 -3.46 0.05 0.00 0.00 0.00 0.00 23.12 19.56 3ifv s ALA 241 CO -0.02 -0.98 1.13 -1.25 0.00 0.00 0.00 175.76 174.64 3ifv s PRO 242 N -2.84 2.37 0.00 0.00 0.04 -1.26 -4.74 135.00 128.57 3ifv s PRO 242 Ca 0.68 0.31 0.03 0.00 0.04 0.00 0.00 61.00 62.07 3ifv s PRO 242 Cb -0.33 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.25 3ifv s PRO 242 CO 0.40 -1.35 0.61 0.54 0.04 0.00 0.00 177.00 177.23