#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 0.25 -0.04 -4.13 1.02 -0.31 -2.23 119.74 114.30 3ifv s LYS 3 Ca 0.00 0.80 -0.08 0.00 0.02 0.00 0.00 55.97 56.71 3ifv s LYS 3 Cb 0.00 0.06 0.01 0.00 -0.52 0.00 0.00 37.83 37.38 3ifv s LYS 3 CO 0.00 -0.23 0.20 0.00 -0.92 0.00 0.00 175.35 174.39 3ifv s ALA 4 N 2.09 -0.48 -0.11 5.17 0.00 -0.92 0.11 121.76 127.61 3ifv s ALA 4 Ca -0.03 0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.25 3ifv s ALA 4 Cb -0.11 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.89 3ifv s ALA 4 CO -0.11 -0.16 -0.18 0.42 0.00 0.00 0.00 175.76 175.73 3ifv s ILE 5 N -0.61 1.72 0.02 0.00 1.01 -0.60 0.20 121.20 122.95 3ifv s ILE 5 Ca -0.07 -0.79 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 3ifv s ILE 5 Cb -0.04 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 3ifv s ILE 5 CO 0.01 0.48 0.03 0.54 0.00 0.00 0.00 174.94 176.01 3ifv s VAL 6 N 0.78 0.11 0.39 2.92 0.11 0.35 -1.45 120.40 123.61 3ifv s VAL 6 Ca -0.10 -0.93 -0.26 0.00 -2.93 0.00 0.00 61.98 57.76 3ifv s VAL 6 Cb -0.16 -0.48 -0.09 0.00 -1.53 0.00 0.00 36.38 34.13 3ifv s VAL 6 CO 0.01 -0.51 1.15 -0.94 -3.33 0.00 0.00 175.10 171.48 3ifv s SER 7 N -1.63 6.62 0.14 3.54 1.04 -1.26 0.05 113.70 122.20 3ifv s SER 7 Ca -0.13 2.31 -0.19 0.00 0.48 0.00 0.00 55.95 58.43 3ifv s SER 7 Cb -0.07 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.44 3ifv s SER 7 CO -0.01 -0.60 1.72 0.00 0.98 0.00 0.00 173.24 175.32 3ifv h ALA 8 N 2.74 0.22 -0.48 5.32 0.00 -1.33 -1.71 119.26 124.02 3ifv h ALA 8 Ca -0.48 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3ifv h ALA 8 Cb 1.23 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 3ifv h ALA 8 CO 0.63 -0.42 0.23 0.00 0.00 0.00 0.00 179.25 179.69 3ifv h ALA 9 N 1.21 1.50 0.00 0.00 0.00 -1.82 -1.26 119.26 118.90 3ifv h ALA 9 Ca 0.12 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3ifv h ALA 9 Cb 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ifv h ALA 9 CO -0.20 0.40 -0.00 1.15 0.00 0.00 0.00 179.25 180.60 3ifv h THR 10 N 0.67 1.14 -0.54 0.00 2.02 -1.66 -1.10 112.91 113.45 3ifv h THR 10 Ca 0.17 -0.43 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 3ifv h THR 10 Cb 0.08 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3ifv h THR 10 CO -0.02 0.11 0.00 0.25 0.37 0.00 0.00 175.52 176.23 3ifv h LEU 11 N -0.19 0.90 -0.17 2.58 5.85 -1.18 0.76 115.31 123.85 3ifv h LEU 11 Ca -0.00 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 3ifv h LEU 11 Cb 0.19 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3ifv h LEU 11 CO 0.00 0.96 0.09 0.03 -0.34 0.00 0.00 178.44 179.17 3ifv h ARG 12 N 0.85 0.25 -0.84 1.25 3.08 -1.23 0.33 114.38 118.07 3ifv h ARG 12 Ca 0.16 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 3ifv h ARG 12 Cb 0.50 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 3ifv h ARG 12 CO 0.02 0.28 0.49 -0.44 -1.07 0.00 0.00 179.97 179.26 3ifv h ASP 13 N 0.16 1.01 -0.03 7.04 3.32 -0.77 -0.28 116.42 126.88 3ifv h ASP 13 Ca 0.06 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3ifv h ASP 13 Cb 0.11 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 3ifv h ASP 13 CO -0.01 0.79 -0.00 0.00 -1.72 0.00 0.00 179.24 178.29 3ifv h ALA 14 N 1.39 0.04 -0.05 3.45 0.00 -0.41 -3.17 119.26 120.51 3ifv h ALA 14 Ca 0.30 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 3ifv h ALA 14 Cb -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3ifv h ALA 14 CO -0.05 -0.28 -0.63 -0.07 0.00 0.00 0.00 179.25 178.21 3ifv h LEU 15 N -0.28 0.20 -0.96 0.00 3.38 -0.22 -3.09 115.31 114.34 3ifv h LEU 15 Ca 0.01 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.93 3ifv h LEU 15 Cb 0.36 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 3ifv h LEU 15 CO 0.00 0.78 0.61 -0.78 0.09 0.00 0.00 178.44 179.14 3ifv h ASP 16 N 0.13 0.97 -0.32 -0.43 3.58 -1.04 0.10 116.42 119.40 3ifv h ASP 16 Ca -0.01 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 3ifv h ASP 16 Cb 1.14 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.99 3ifv h ASP 16 CO 0.09 0.61 0.15 0.77 -2.88 0.00 0.00 179.24 177.98 3ifv h SER 17 N 1.10 0.43 -0.73 2.28 4.64 -1.51 -1.88 113.55 117.88 3ifv h SER 17 Ca 0.42 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.55 3ifv h SER 17 Cb 0.20 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 3ifv h SER 17 CO -0.18 0.44 0.20 0.58 -0.87 0.00 0.00 176.83 176.99 3ifv h VAL 18 N 0.39 1.26 -0.44 0.95 2.07 -1.56 -3.29 116.25 115.63 3ifv h VAL 18 Ca 0.11 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 3ifv h VAL 18 Cb 0.12 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3ifv h VAL 18 CO -0.01 0.37 0.20 -1.28 0.02 0.00 0.00 177.57 176.87 3ifv h SER 19 N 1.10 0.55 -1.37 0.57 0.87 -0.20 -1.88 113.55 113.19 3ifv h SER 19 Ca 0.23 -0.05 0.40 0.00 -1.23 0.00 0.00 61.79 61.14 3ifv h SER 19 Cb 0.35 -0.14 -0.07 0.00 -0.44 0.00 0.00 62.40 62.10 3ifv h SER 19 CO -0.00 0.48 0.97 0.58 -0.53 0.00 0.00 176.83 178.33 3ifv h VAL 20 N 0.62 0.30 0.00 2.23 2.07 -1.48 -3.20 116.25 116.78 3ifv h VAL 20 Ca 0.16 -0.02 -0.17 0.00 0.82 0.00 0.00 66.70 67.49 3ifv h VAL 20 Cb 0.08 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.07 3ifv h VAL 20 CO -0.02 0.01 -1.63 0.18 0.02 0.00 0.00 177.57 176.13 3ifv n LEU 21 N -4.22 1.29 -4.07 2.57 4.77 -0.73 -4.90 117.00 111.71 3ifv n LEU 21 Ca 0.31 -0.03 -0.07 0.00 -0.03 0.00 0.00 56.01 56.19 3ifv n LEU 21 Cb 1.41 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 42.35 3ifv n LEU 21 CO 0.38 0.42 -0.34 0.68 -1.33 0.00 0.00 177.39 177.20 3ifv s VAL 22 N -2.22 0.21 -0.48 4.08 -7.23 -1.04 -4.52 120.40 109.19 3ifv s VAL 22 Ca -0.09 -1.73 0.22 0.00 -1.81 0.00 0.00 61.98 58.57 3ifv s VAL 22 Cb 0.03 -1.47 -0.22 0.00 0.56 0.00 0.00 36.38 35.28 3ifv s VAL 22 CO 0.32 -0.96 0.79 0.47 -0.31 0.00 0.00 175.10 175.42 3ifv n ASP 23 N 0.14 0.50 -4.15 4.85 8.00 -1.26 -4.33 116.55 120.30 3ifv n ASP 23 Ca -0.14 -0.31 -0.10 0.00 0.71 0.00 0.00 54.79 54.94 3ifv n ASP 23 Cb 0.61 1.28 -0.10 0.00 -0.02 0.00 0.00 41.12 42.89 3ifv n ASP 23 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3ifv s GLU 24 N -3.27 1.00 0.04 -1.24 -1.05 -1.26 -1.06 118.70 111.85 3ifv s GLU 24 Ca 0.00 -1.47 -0.27 0.00 -0.15 0.00 0.00 54.97 53.08 3ifv s GLU 24 Cb 0.14 0.26 0.09 0.00 -0.44 0.00 0.00 34.13 34.18 3ifv s GLU 24 CO 0.86 -0.30 0.80 0.00 0.95 0.00 0.00 175.26 177.58 3ifv s LYS 26 N -3.19 4.45 -0.24 0.00 1.02 -1.26 -1.96 119.74 118.56 3ifv s LYS 26 Ca 0.03 0.98 -0.03 0.00 0.02 0.00 0.00 55.97 56.97 3ifv s LYS 26 Cb -0.01 -3.37 0.00 0.00 -0.52 0.00 0.00 37.83 33.93 3ifv s LYS 26 CO -0.09 0.27 -0.04 0.42 -0.92 0.00 0.00 175.35 174.98 3ifv s ILE 27 N 0.04 3.24 -0.29 2.17 1.01 -0.46 -4.36 121.20 122.54 3ifv s ILE 27 Ca 0.37 -0.69 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 3ifv s ILE 27 Cb -0.20 -2.54 -0.00 0.00 0.01 0.00 0.00 42.46 39.73 3ifv s ILE 27 CO 0.21 0.32 0.76 -0.13 0.00 0.00 0.00 174.94 176.10 3ifv s ARG 28 N 1.43 4.00 -0.64 2.79 1.81 -0.11 -1.99 118.95 126.24 3ifv s ARG 28 Ca 0.04 0.60 -0.23 0.00 -1.72 0.00 0.00 55.73 54.42 3ifv s ARG 28 Cb -0.15 -3.71 0.07 0.00 -0.45 0.00 0.00 34.95 30.70 3ifv s ARG 28 CO -0.03 -0.62 0.96 -0.51 -0.68 0.00 0.00 175.30 174.41 3ifv s LEU 29 N 2.85 4.34 0.29 2.53 1.43 0.74 -2.37 118.68 128.50 3ifv s LEU 29 Ca 0.31 -0.89 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 3ifv s LEU 29 Cb -0.14 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 3ifv s LEU 29 CO 0.11 -1.40 0.17 0.20 0.23 0.00 0.00 176.35 175.66 3ifv s ASN 30 N 3.53 5.09 0.21 2.29 0.02 -0.78 -2.13 114.94 123.17 3ifv s ASN 30 Ca 0.23 -0.50 -0.09 0.00 -1.02 0.00 0.00 52.86 51.48 3ifv s ASN 30 Cb -0.16 -1.04 0.15 0.00 0.02 0.00 0.00 41.25 40.22 3ifv s ASN 30 CO 0.12 -0.16 1.79 -0.08 0.02 0.00 0.00 177.10 178.78 3ifv h GLU 31 N 1.52 1.13 -0.00 -0.60 4.22 -1.94 -3.10 114.58 115.81 3ifv h GLU 31 Ca -0.46 -0.18 0.00 0.00 0.08 0.00 0.00 59.36 58.81 3ifv h GLU 31 Cb 1.25 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3ifv h GLU 31 CO 0.61 0.89 -0.63 0.39 -2.18 0.00 0.00 179.01 178.09 3ifv n GLU 32 N -4.35 2.10 -3.56 1.92 -0.58 -1.26 -4.59 120.64 110.32 3ifv n GLU 32 Ca 0.07 -0.13 -0.14 0.00 -0.42 0.00 0.00 57.16 56.54 3ifv n GLU 32 Cb 0.15 -1.20 -0.06 0.00 -0.57 0.00 0.00 31.44 29.76 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 -2.29 -0.51 -0.19 1.62 1.04 -1.17 0.29 113.70 112.49 3ifv s SER 33 Ca 0.07 0.60 -0.12 0.00 0.48 0.00 0.00 55.95 56.98 3ifv s SER 33 Cb 0.11 0.48 -0.05 0.00 0.10 0.00 0.00 66.02 66.66 3ifv s SER 33 CO 0.56 -0.45 0.20 -0.22 0.98 0.00 0.00 173.24 174.32 3ifv s LEU 34 N -1.02 4.22 0.02 2.42 0.20 0.83 -1.86 118.68 123.48 3ifv s LEU 34 Ca -0.05 0.33 0.02 0.00 0.69 0.00 0.00 54.13 55.12 3ifv s LEU 34 Cb -0.01 -2.20 -0.02 0.00 -0.43 0.00 0.00 46.19 43.53 3ifv s LEU 34 CO 0.05 0.14 -0.08 -0.94 -0.29 0.00 0.00 176.35 175.23 3ifv s SER 35 N 0.46 0.88 -0.03 3.68 1.04 -1.00 0.94 113.70 119.67 3ifv s SER 35 Ca 0.11 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.21 3ifv s SER 35 Cb -0.12 -0.02 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 3ifv s SER 35 CO 0.01 -0.07 -0.13 -0.63 0.98 0.00 0.00 173.24 173.40 3ifv s ILE 36 N -0.83 1.09 -0.01 -1.02 1.01 -0.94 -0.93 121.20 119.57 3ifv s ILE 36 Ca -0.04 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3ifv s ILE 36 Cb -0.07 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.47 3ifv s ILE 36 CO 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 174.94 175.23 3ifv s ARG 37 N 0.01 0.32 0.13 2.79 1.70 -1.26 -0.62 118.95 122.02 3ifv s ARG 37 Ca -0.01 -0.09 -0.08 0.00 -0.47 0.00 0.00 55.73 55.08 3ifv s ARG 37 Cb -0.09 -0.34 -0.01 0.00 -0.57 0.00 0.00 34.95 33.94 3ifv s ARG 37 CO 0.01 0.03 0.21 0.00 -1.08 0.00 0.00 175.30 174.47 3ifv s ALA 38 N 0.16 0.01 0.04 7.88 0.00 -0.92 -4.62 121.76 124.32 3ifv s ALA 38 Ca -0.01 -0.85 0.06 0.00 0.00 0.00 0.00 51.96 51.15 3ifv s ALA 38 Cb -0.04 0.69 -0.02 0.00 0.00 0.00 0.00 23.12 23.75 3ifv s ALA 38 CO -0.00 -0.57 -0.16 0.54 0.00 0.00 0.00 175.76 175.57 3ifv s VAL 39 N -3.93 1.26 1.06 0.00 0.11 -1.26 -1.33 120.40 116.31 3ifv s VAL 39 Ca 0.13 -1.04 -0.14 0.00 -2.93 0.00 0.00 61.98 57.99 3ifv s VAL 39 Cb 0.04 -1.13 0.22 0.00 -1.53 0.00 0.00 36.38 33.99 3ifv s VAL 39 CO -0.05 0.07 1.10 1.51 -3.33 0.00 0.00 175.10 174.40 3ifv s ASP 40 N -1.13 2.13 0.26 3.54 -4.77 -0.55 -4.89 116.67 111.27 3ifv s ASP 40 Ca 0.03 1.00 -0.01 0.00 -3.30 0.00 0.00 52.55 50.27 3ifv s ASP 40 Cb -0.08 -1.54 0.34 0.00 -1.09 0.00 0.00 42.92 40.55 3ifv s ASP 40 CO 0.01 -3.42 1.74 1.55 0.70 0.00 0.00 175.17 175.76 3ifv h PRO 41 N -2.09 0.72 0.00 2.11 0.13 -1.93 -1.51 132.00 129.43 3ifv h PRO 41 Ca -0.52 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.39 3ifv h PRO 41 Cb 1.32 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3ifv h PRO 41 CO 0.52 0.78 0.00 0.00 -0.23 0.00 0.00 178.00 179.07 3ifv n ALA 42 N -2.48 2.24 -2.90 -0.56 0.00 -1.26 -4.86 120.51 110.68 3ifv n ALA 42 Ca 0.02 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.11 3ifv n ALA 42 Cb 0.34 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.00 -6.07 -0.07 0.00 3.02 -0.57 -4.91 115.26 105.67 3ifv n ASN 43 Ca 0.15 -0.23 -0.08 0.00 -0.03 0.00 0.00 54.58 54.39 3ifv n ASN 43 Cb 0.07 -4.94 -0.08 0.00 -0.61 0.00 0.00 39.78 34.22 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 -4.41 0.83 -4.66 2.41 0.31 -1.26 -4.96 118.33 106.59 3ifv n VAL 44 Ca -0.14 -0.43 -0.30 0.00 -0.01 0.00 0.00 64.34 63.47 3ifv n VAL 44 Cb 0.63 -0.84 -0.13 0.00 -0.91 0.00 0.00 33.84 32.59 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 -4.89 1.52 0.02 2.92 0.00 -1.26 -1.23 107.32 104.39 3ifv s GLY 45 Ca -0.12 -1.32 -0.00 0.00 0.00 0.00 0.00 44.72 43.28 3ifv s GLY 45 CO 0.42 -1.24 -0.02 1.06 0.00 0.00 0.00 173.10 173.32 3ifv s MET 46 N -1.59 0.29 0.04 2.90 1.00 -0.57 -1.48 119.30 119.90 3ifv s MET 46 Ca 0.14 -0.56 0.03 0.00 0.00 0.00 0.00 55.69 55.29 3ifv s MET 46 Cb -0.10 0.10 -0.02 0.00 0.00 0.00 0.00 34.83 34.81 3ifv s MET 46 CO 0.05 -0.05 -0.09 0.54 0.00 0.00 0.00 175.02 175.47 3ifv s VAL 47 N -1.36 0.66 -0.15 -6.03 0.11 -0.44 -1.50 120.40 111.69 3ifv s VAL 47 Ca -0.15 -1.04 -0.03 0.00 -2.93 0.00 0.00 61.98 57.84 3ifv s VAL 47 Cb -0.09 -0.69 0.05 0.00 -1.53 0.00 0.00 36.38 34.12 3ifv s VAL 47 CO -0.01 -0.29 0.04 -0.62 -3.33 0.00 0.00 175.10 170.89 3ifv s ASP 48 N -1.45 2.33 -0.08 3.54 -1.08 0.21 -2.16 116.67 117.97 3ifv s ASP 48 Ca -0.07 -0.52 0.01 0.00 -0.52 0.00 0.00 52.55 51.46 3ifv s ASP 48 Cb -0.09 -0.47 -0.02 0.00 -1.46 0.00 0.00 42.92 40.88 3ifv s ASP 48 CO 0.01 -0.28 -0.11 -0.22 0.52 0.00 0.00 175.17 175.09 3ifv s LEU 49 N 1.96 2.87 -0.17 -1.34 2.96 0.21 -0.04 118.68 125.13 3ifv s LEU 49 Ca 0.02 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 3ifv s LEU 49 Cb -0.15 -1.62 0.03 0.00 0.50 0.00 0.00 46.19 44.95 3ifv s LEU 49 CO -0.07 0.29 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.21 3ifv s THR 50 N -0.38 1.70 -0.33 3.68 2.01 0.18 -2.23 115.64 120.27 3ifv s THR 50 Ca 0.05 -0.78 -0.01 0.00 0.31 0.00 0.00 61.69 61.25 3ifv s THR 50 Cb -0.12 -1.61 0.07 0.00 0.01 0.00 0.00 72.50 70.84 3ifv s THR 50 CO 0.02 0.42 0.05 -0.22 -0.69 0.00 0.00 174.62 174.20 3ifv s LEU 51 N 1.42 4.31 0.56 4.42 2.96 0.27 -1.64 118.68 130.97 3ifv s LEU 51 Ca 0.04 -1.58 -0.15 0.00 -0.22 0.00 0.00 54.13 52.22 3ifv s LEU 51 Cb -0.14 -1.72 -0.06 0.00 0.50 0.00 0.00 46.19 44.78 3ifv s LEU 51 CO -0.11 -0.34 1.01 -0.62 -1.32 0.00 0.00 176.35 174.98 3ifv s ASP 52 N 1.34 6.30 0.23 3.68 2.15 -0.82 0.29 116.67 129.85 3ifv s ASP 52 Ca -0.00 1.59 -0.16 0.00 0.43 0.00 0.00 52.55 54.41 3ifv s ASP 52 Cb -0.20 -2.51 0.26 0.00 -0.30 0.00 0.00 42.92 40.17 3ifv s ASP 52 CO -0.03 -0.81 1.53 0.00 -0.17 0.00 0.00 175.17 175.69 3ifv n ALA 53 N -1.99 -0.09 0.00 3.66 0.00 0.14 -0.57 120.51 121.67 3ifv n ALA 53 Ca 0.07 0.99 0.00 0.00 0.00 0.00 0.00 53.44 54.50 3ifv n ALA 53 Cb 0.54 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.53 3ifv n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ifv n ALA 54 N -3.49 1.08 0.08 0.00 0.00 -1.26 0.95 120.51 117.87 3ifv n ALA 54 Ca 0.11 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.59 3ifv n ALA 54 Cb 0.40 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 3ifv n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ifv h ALA 55 N 1.81 0.63 -2.77 0.00 0.00 -1.08 -3.46 119.26 114.39 3ifv h ALA 55 Ca 0.00 -0.46 -0.57 0.00 0.00 0.00 0.00 54.91 53.88 3ifv h ALA 55 Cb 0.06 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3ifv h ALA 55 CO 0.00 0.52 0.01 -0.06 0.00 0.00 0.00 179.25 179.72 3ifv s PHE 56 N -3.09 3.57 0.33 0.00 0.08 0.27 -4.72 117.98 114.42 3ifv s PHE 56 Ca -0.01 1.14 0.13 0.00 0.12 0.00 0.00 56.93 58.31 3ifv s PHE 56 Cb 0.09 -2.71 1.04 0.00 -0.57 0.00 0.00 43.02 40.87 3ifv s PHE 56 CO 0.79 0.14 1.66 0.93 -0.10 0.00 0.00 175.22 178.63 3ifv h GLU 57 N 6.65 0.28 -3.76 0.44 4.39 -1.53 -3.39 114.58 117.67 3ifv h GLU 57 Ca -0.41 -0.02 -0.18 0.00 0.34 0.00 0.00 59.36 59.09 3ifv h GLU 57 Cb 1.19 -0.06 -0.23 0.00 -0.10 0.00 0.00 28.75 29.55 3ifv h GLU 57 CO 0.75 0.19 -0.64 0.45 -1.16 0.00 0.00 179.01 178.60 3ifv s SER 58 N -4.91 0.10 -0.28 1.42 0.15 -1.12 -4.97 113.70 104.08 3ifv s SER 58 Ca -0.10 -0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.31 3ifv s SER 58 Cb 0.30 0.13 0.18 0.00 -1.71 0.00 0.00 66.02 64.91 3ifv s SER 58 CO 0.79 -0.22 0.53 -0.47 1.20 0.00 0.00 173.24 175.06 3ifv s TYR 59 N -0.97 -1.41 -0.11 3.44 5.04 -1.26 -1.55 117.35 120.54 3ifv s TYR 59 Ca -0.11 1.27 0.02 0.00 -2.44 0.00 0.00 57.07 55.81 3ifv s TYR 59 Cb -0.06 0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.59 3ifv s TYR 59 CO -0.00 -0.89 -0.17 -1.21 -1.34 0.00 0.00 175.55 171.95 3ifv s GLU 60 N 2.75 2.34 0.27 4.97 0.41 0.12 -5.00 118.70 124.56 3ifv s GLU 60 Ca 0.16 -0.61 -0.10 0.00 -0.41 0.00 0.00 54.97 54.01 3ifv s GLU 60 Cb -0.14 -1.95 -0.00 0.00 -1.78 0.00 0.00 34.13 30.26 3ifv s GLU 60 CO -0.21 -0.03 0.45 0.00 -0.49 0.00 0.00 175.26 174.98 3ifv s ALA 61 N 0.88 0.10 0.00 5.21 0.00 -1.26 -1.16 121.76 125.52 3ifv s ALA 61 Ca -0.08 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.78 3ifv s ALA 61 Cb -0.15 1.11 0.00 0.00 0.00 0.00 0.00 23.12 24.07 3ifv s ALA 61 CO -0.00 -0.82 0.81 1.58 0.00 0.00 0.00 175.76 177.33 3ifv n HIS 62 N -0.41 0.00 0.00 0.00 -0.00 -1.26 -4.37 115.22 109.17 3ifv n HIS 62 Ca -0.01 -0.35 0.00 0.00 -0.00 0.00 0.00 57.72 57.36 3ifv n HIS 62 Cb 0.62 0.42 0.00 0.00 -0.00 0.00 0.00 29.99 31.04 3ifv n HIS 62 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3ifv n GLY 63 N 0.00 0.74 1.10 1.57 0.00 -0.91 -4.98 105.19 102.71 3ifv n GLY 63 Ca -0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 3ifv n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ifv n GLY 64 N -1.65 -0.85 3.33 -0.02 0.00 -1.00 -4.75 105.19 100.25 3ifv n GLY 64 Ca 0.00 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 3ifv n GLY 64 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ifv s VAL 65 N -1.61 0.03 0.02 1.61 -7.23 -1.26 -0.18 120.40 111.78 3ifv s VAL 65 Ca 0.21 -0.21 -0.04 0.00 -1.81 0.00 0.00 61.98 60.13 3ifv s VAL 65 Cb -0.01 -0.69 -0.01 0.00 0.56 0.00 0.00 36.38 36.23 3ifv s VAL 65 CO 0.15 -0.12 0.05 0.27 -0.31 0.00 0.00 175.10 175.14 3ifv s ILE 66 N -0.73 0.12 -0.08 -0.62 -4.36 -0.84 -4.96 121.20 109.73 3ifv s ILE 66 Ca -0.08 -0.99 -0.03 0.00 -0.26 0.00 0.00 60.65 59.29 3ifv s ILE 66 Cb -0.03 -0.60 -0.04 0.00 1.25 0.00 0.00 42.46 43.04 3ifv s ILE 66 CO 0.04 -0.55 0.06 -0.83 0.24 0.00 0.00 174.94 173.91 3ifv s GLY 67 N -1.77 1.99 0.00 6.27 0.00 -1.01 -1.36 107.32 111.44 3ifv s GLY 67 Ca -0.10 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 43.85 3ifv s GLY 67 CO -0.02 -0.55 -0.02 0.14 0.00 0.00 0.00 173.10 172.65 3ifv s VAL 68 N -1.00 0.13 -0.46 1.40 1.01 -0.83 0.82 120.40 121.47 3ifv s VAL 68 Ca 0.16 -0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.75 3ifv s VAL 68 Cb -0.12 -0.13 0.03 0.00 0.00 0.00 0.00 36.38 36.16 3ifv s VAL 68 CO 0.06 -0.00 0.97 0.21 0.00 0.00 0.00 175.10 176.34 3ifv s ASN 69 N -0.15 6.54 0.11 3.32 2.47 -1.26 -2.42 114.94 123.56 3ifv s ASN 69 Ca -0.01 0.22 -0.12 0.00 0.42 0.00 0.00 52.86 53.37 3ifv s ASN 69 Cb -0.01 -2.47 -0.13 0.00 -1.45 0.00 0.00 41.25 37.19 3ifv s ASN 69 CO -0.00 -1.09 1.35 0.25 -3.72 0.00 0.00 177.10 173.89 3ifv h LEU 70 N 10.69 0.97 -0.81 3.21 5.85 -1.45 -2.78 115.31 130.98 3ifv h LEU 70 Ca -0.24 -0.58 0.11 0.00 0.84 0.00 0.00 57.88 58.01 3ifv h LEU 70 Cb 1.07 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.74 3ifv h LEU 70 CO 1.05 1.38 0.44 0.28 -0.34 0.00 0.00 178.44 181.25 3ifv h SER 71 N 0.60 0.60 -0.09 1.25 0.02 -1.92 -0.30 113.55 113.71 3ifv h SER 71 Ca -0.02 0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 60.84 3ifv h SER 71 Cb 1.29 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 63.79 3ifv h SER 71 CO 0.14 0.32 -0.55 -0.09 -1.14 0.00 0.00 176.83 175.52 3ifv h ARG 72 N 0.71 0.53 -0.49 3.45 9.65 -1.89 -0.06 114.38 126.28 3ifv h ARG 72 Ca 0.41 -0.45 -0.03 0.00 -1.10 0.00 0.00 59.98 58.80 3ifv h ARG 72 Cb 0.44 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.10 3ifv h ARG 72 CO -0.28 1.08 0.16 1.25 2.80 0.00 0.00 179.97 184.98 3ifv h LEU 73 N 0.12 0.65 -0.14 3.80 5.85 -1.18 -0.12 115.31 124.30 3ifv h LEU 73 Ca -0.04 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3ifv h LEU 73 Cb 1.20 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 3ifv h LEU 73 CO 0.11 0.62 0.04 -0.33 -0.34 0.00 0.00 178.44 178.54 3ifv h GLU 74 N 0.70 0.21 -0.91 1.25 5.08 -0.90 -1.73 114.58 118.29 3ifv h GLU 74 Ca 0.17 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3ifv h GLU 74 Cb 0.20 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 3ifv h GLU 74 CO -0.01 0.35 0.60 1.49 -1.00 0.00 0.00 179.01 180.44 3ifv h GLU 75 N 0.04 1.19 -0.13 2.33 4.81 -0.43 -0.72 114.58 121.67 3ifv h GLU 75 Ca 0.04 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3ifv h GLU 75 Cb 0.22 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 3ifv h GLU 75 CO -0.00 0.79 0.09 0.28 -0.73 0.00 0.00 179.01 179.43 3ifv h VAL 76 N 1.22 1.03 -0.16 0.32 2.07 -0.83 -2.66 116.25 117.25 3ifv h VAL 76 Ca 0.33 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.75 3ifv h VAL 76 Cb -0.13 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3ifv h VAL 76 CO -0.07 0.03 -0.12 0.00 0.02 0.00 0.00 177.57 177.43 3ifv h ALA 77 N 1.05 1.51 0.00 1.67 0.00 -1.00 -0.57 119.26 121.93 3ifv h ALA 77 Ca 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3ifv h ALA 77 Cb -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3ifv h ALA 77 CO -0.01 0.35 0.42 0.78 0.00 0.00 0.00 179.25 180.79 3ifv h GLY 78 N 0.73 0.00 1.25 0.00 0.00 -0.76 -2.08 103.07 102.21 3ifv h GLY 78 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3ifv h GLY 78 CO 0.02 0.00 -0.15 1.03 0.00 0.00 0.00 176.54 177.44 3ifv n MET 79 N -2.52 0.35 -3.21 4.80 2.81 -0.22 -4.90 117.12 114.22 3ifv n MET 79 Ca -0.01 -0.11 -0.28 0.00 -1.81 0.00 0.00 57.70 55.49 3ifv n MET 79 Cb 0.45 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.44 3ifv n MET 79 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ifv s ALA 80 N -2.73 3.58 0.26 3.04 0.00 -0.78 -5.05 121.76 120.07 3ifv s ALA 80 Ca 0.21 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 3ifv s ALA 80 Cb 0.19 -2.35 -0.11 0.00 0.00 0.00 0.00 23.12 20.86 3ifv s ALA 80 CO 0.53 0.11 1.53 0.20 0.00 0.00 0.00 175.76 178.14 3ifv s GLY 81 N -3.40 2.10 0.53 0.00 0.00 -1.26 -4.89 107.32 100.40 3ifv s GLY 81 Ca 0.44 1.45 0.31 0.00 0.00 0.00 0.00 44.72 46.93 3ifv s GLY 81 CO 0.33 2.46 1.88 0.00 0.00 0.00 0.00 173.10 177.77 3ifv h ALA 82 N 5.22 2.83 0.00 3.20 0.00 -1.95 1.23 119.26 129.79 3ifv h ALA 82 Ca -0.46 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 3ifv h ALA 82 Cb 1.22 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3ifv h ALA 82 CO 0.81 -1.09 -0.18 0.78 0.00 0.00 0.00 179.25 179.56 3ifv h GLY 83 N 0.02 0.00 -1.97 0.00 0.00 -1.98 -2.95 103.07 96.19 3ifv h GLY 83 Ca 0.44 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.27 3ifv h GLY 83 CO -0.02 0.00 0.40 0.99 0.00 0.00 0.00 176.54 177.92 3ifv s ASP 84 N -6.14 5.77 0.08 0.19 1.01 0.42 -4.78 116.67 113.22 3ifv s ASP 84 Ca -0.00 2.04 -0.20 0.00 0.71 0.00 0.00 52.55 55.10 3ifv s ASP 84 Cb 0.11 -2.56 -0.07 0.00 1.01 0.00 0.00 42.92 41.41 3ifv s ASP 84 CO 0.61 -1.18 0.59 -0.76 0.21 0.00 0.00 175.17 174.64 3ifv s LEU 85 N -3.99 4.53 -0.13 1.23 1.43 -1.26 -1.76 118.68 118.73 3ifv s LEU 85 Ca 0.69 1.29 -0.02 0.00 -1.03 0.00 0.00 54.13 55.06 3ifv s LEU 85 Cb -0.21 -2.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 3ifv s LEU 85 CO 0.29 0.26 -0.06 -0.63 0.23 0.00 0.00 176.35 176.44 3ifv s ILE 86 N -1.06 3.68 -0.26 -0.59 1.01 0.11 -4.48 121.20 119.60 3ifv s ILE 86 Ca 0.30 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.39 3ifv s ILE 86 Cb -0.20 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 3ifv s ILE 86 CO 0.19 0.52 0.18 -1.00 0.00 0.00 0.00 174.94 174.84 3ifv s HIS 87 N 0.14 3.28 -0.16 3.97 3.76 0.58 -0.50 115.29 126.36 3ifv s HIS 87 Ca -0.03 0.20 -0.03 0.00 -0.15 0.00 0.00 55.06 55.05 3ifv s HIS 87 Cb -0.14 -2.33 -0.03 0.00 1.11 0.00 0.00 32.58 31.20 3ifv s HIS 87 CO 0.03 -0.03 -0.04 -0.51 -0.85 0.00 0.00 174.74 173.34 3ifv s LEU 88 N 1.37 3.19 -0.04 0.89 1.43 0.13 -1.08 118.68 124.58 3ifv s LEU 88 Ca 0.08 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 3ifv s LEU 88 Cb -0.15 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.33 3ifv s LEU 88 CO 0.07 0.16 0.09 -0.89 0.23 0.00 0.00 176.35 176.01 3ifv s THR 89 N 0.43 -0.04 -0.04 5.49 2.01 0.11 -2.17 115.64 121.43 3ifv s THR 89 Ca -0.04 0.14 -0.03 0.00 0.31 0.00 0.00 61.69 62.08 3ifv s THR 89 Cb -0.14 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 3ifv s THR 89 CO 0.03 0.06 0.11 -0.22 -0.69 0.00 0.00 174.62 173.91 3ifv s LEU 90 N 0.83 4.10 0.00 4.42 2.96 -0.95 0.43 118.68 130.47 3ifv s LEU 90 Ca -0.07 0.28 0.00 0.00 -0.22 0.00 0.00 54.13 54.12 3ifv s LEU 90 Cb -0.09 -2.26 0.00 0.00 0.50 0.00 0.00 46.19 44.34 3ifv s LEU 90 CO -0.03 0.32 0.00 0.29 -1.32 0.00 0.00 176.35 175.60 3ifv n LYS 96 N 1.43 0.00 -4.46 1.98 5.02 -1.26 -4.88 118.16 115.99 3ifv n LYS 96 Ca -0.15 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.81 3ifv n LYS 96 Cb 0.53 -0.01 -0.12 0.00 -0.02 0.00 0.00 35.03 35.41 3ifv n LYS 96 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3ifv s LEU 97 N -0.10 3.20 -0.21 -0.35 2.96 0.22 -4.84 118.68 119.56 3ifv s LEU 97 Ca 0.00 -0.13 -0.09 0.00 -0.22 0.00 0.00 54.13 53.69 3ifv s LEU 97 Cb 0.00 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 3ifv s LEU 97 CO 0.00 0.19 0.11 0.21 -1.32 0.00 0.00 176.35 175.55 3ifv s ASN 98 N 0.21 5.91 -0.23 3.68 2.47 0.17 -1.34 114.94 125.80 3ifv s ASN 98 Ca -0.03 0.11 0.02 0.00 0.42 0.00 0.00 52.86 53.38 3ifv s ASN 98 Cb -0.14 -2.04 0.05 0.00 -1.45 0.00 0.00 41.25 37.67 3ifv s ASN 98 CO 0.03 0.13 -0.10 -0.63 -3.72 0.00 0.00 177.10 172.81 3ifv s ILE 99 N 0.65 1.84 -0.05 -5.21 1.01 -0.77 0.04 121.20 118.72 3ifv s ILE 99 Ca 0.06 -1.31 0.06 0.00 0.00 0.00 0.00 60.65 59.46 3ifv s ILE 99 Cb -0.12 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.36 3ifv s ILE 99 CO 0.01 0.04 -0.23 -0.60 0.00 0.00 0.00 174.94 174.16 3ifv s ARG 100 N 1.27 2.44 -0.22 2.79 3.52 -0.24 -1.72 118.95 126.80 3ifv s ARG 100 Ca -0.05 -0.87 -0.04 0.00 -0.13 0.00 0.00 55.73 54.64 3ifv s ARG 100 Cb -0.18 -2.18 0.08 0.00 -1.56 0.00 0.00 34.95 31.11 3ifv s ARG 100 CO -0.07 0.47 0.15 0.42 -0.81 0.00 0.00 175.30 175.46 3ifv s ILE 101 N -0.37 -0.17 0.00 4.11 1.01 -0.10 -0.31 121.20 125.37 3ifv s ILE 101 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.35 3ifv s ILE 101 Cb -0.12 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.62 3ifv s ILE 101 CO 0.02 -0.39 0.00 -0.67 0.00 0.00 0.00 174.94 173.90 3ifv n ASP 102 N 5.28 0.00 -0.74 3.58 -0.08 -1.26 -0.97 116.55 122.37 3ifv n ASP 102 Ca -0.06 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.31 3ifv n ASP 102 Cb 0.47 0.00 0.25 0.00 2.34 0.00 0.00 41.12 44.19 3ifv n ASP 102 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3ifv n GLY 103 N 0.00 0.81 3.58 0.27 0.00 -1.26 -4.86 105.19 103.73 3ifv n GLY 103 Ca 0.00 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.24 4.24 -0.10 0.99 2.96 -0.14 -5.08 118.68 120.31 3ifv s LEU 104 Ca 0.31 0.13 0.04 0.00 -0.22 0.00 0.00 54.13 54.38 3ifv s LEU 104 Cb 0.16 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 44.30 3ifv s LEU 104 CO 0.23 -0.38 -0.23 -0.94 -1.32 0.00 0.00 176.35 173.71 3ifv s SER 105 N 1.69 3.02 -0.09 3.68 1.04 -1.26 -0.93 113.70 120.85 3ifv s SER 105 Ca 0.18 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.08 3ifv s SER 105 Cb -0.16 -1.38 -0.02 0.00 0.10 0.00 0.00 66.02 64.57 3ifv s SER 105 CO 0.12 0.15 -0.16 -0.47 0.98 0.00 0.00 173.24 173.86 3ifv s TYR 106 N 0.37 2.71 -0.28 5.02 5.04 -0.70 -4.99 117.35 124.51 3ifv s TYR 106 Ca -0.19 -0.51 -0.07 0.00 -2.44 0.00 0.00 57.07 53.87 3ifv s TYR 106 Cb -0.18 -1.73 0.00 0.00 0.35 0.00 0.00 41.96 40.40 3ifv s TYR 106 CO 0.09 -0.09 0.07 0.99 -1.34 0.00 0.00 175.55 175.27 3ifv s THR 107 N -0.09 3.99 -0.20 4.34 2.01 -1.26 -1.85 115.64 122.58 3ifv s THR 107 Ca -0.03 -0.60 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 3ifv s THR 107 Cb -0.14 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.35 3ifv s THR 107 CO 0.04 0.14 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.81 3ifv s LEU 108 N 1.52 2.79 -0.14 4.42 2.96 -0.45 -4.95 118.68 124.83 3ifv s LEU 108 Ca 0.03 -0.41 -0.29 0.00 -0.22 0.00 0.00 54.13 53.24 3ifv s LEU 108 Cb -0.17 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 3ifv s LEU 108 CO 0.02 0.01 1.48 0.00 -1.32 0.00 0.00 176.35 176.54 3ifv s ALA 109 N 1.28 3.56 0.69 5.97 0.00 -1.26 0.72 121.76 132.72 3ifv s ALA 109 Ca 0.03 0.62 -0.02 0.00 0.00 0.00 0.00 51.96 52.59 3ifv s ALA 109 Cb -0.14 -3.72 0.04 0.00 0.00 0.00 0.00 23.12 19.30 3ifv s ALA 109 CO -0.03 -1.43 0.08 1.28 0.00 0.00 0.00 175.76 175.66 3ifv n LEU 110 N 7.19 0.00 -4.03 0.00 4.77 -1.26 -4.81 117.00 118.86 3ifv n LEU 110 Ca 0.16 -0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.93 3ifv n LEU 110 Cb 0.44 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.29 3ifv n LEU 110 CO 0.60 -1.50 -0.40 -0.63 -1.33 0.00 0.00 177.39 174.14 3ifv s ILE 111 N -0.84 0.46 -0.05 -0.08 1.01 0.24 -4.90 121.20 117.03 3ifv s ILE 111 Ca 0.06 -0.88 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 3ifv s ILE 111 Cb -0.01 -0.51 -0.08 0.00 0.01 0.00 0.00 42.46 41.87 3ifv s ILE 111 CO 0.05 -0.29 2.07 -0.67 0.00 0.00 0.00 174.94 176.09 3ifv n ASP 112 N 1.79 3.87 -0.10 3.58 -0.08 -1.26 -2.40 116.55 121.94 3ifv n ASP 112 Ca -0.21 0.66 0.11 0.00 -1.51 0.00 0.00 54.79 53.84 3ifv n ASP 112 Cb 0.55 -1.54 0.47 0.00 2.34 0.00 0.00 41.12 42.95 3ifv n ASP 112 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3ifv h PRO 113 N 12.18 0.46 0.00 -0.67 0.11 -1.91 0.14 132.00 142.32 3ifv h PRO 113 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3ifv h PRO 113 Cb 1.24 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ifv h PRO 113 CO 0.95 0.31 -0.04 -0.44 -0.21 0.00 0.00 178.00 178.56 3ifv h ASP 114 N 0.48 0.00 0.00 -2.05 5.19 -2.01 -0.82 116.42 117.21 3ifv h ASP 114 Ca 0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 3ifv h ASP 114 Cb 0.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.99 3ifv h ASP 114 CO -0.08 0.04 0.00 -0.24 -3.12 0.00 0.00 179.24 175.84 3ifv n SER 115 N -3.23 0.00 -4.50 6.45 2.88 0.49 -4.88 113.62 110.84 3ifv n SER 115 Ca -0.01 -0.97 -0.28 0.00 -1.33 0.00 0.00 58.87 56.27 3ifv n SER 115 Cb 0.23 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.58 3ifv n SER 115 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3ifv s ILE 116 N -2.00 2.87 0.14 2.46 1.01 -0.31 -5.03 121.20 120.33 3ifv s ILE 116 Ca 0.28 -1.60 -0.34 0.00 0.00 0.00 0.00 60.65 58.98 3ifv s ILE 116 Cb 0.13 -2.35 -0.16 0.00 0.01 0.00 0.00 42.46 40.08 3ifv s ILE 116 CO 0.21 0.02 1.18 -1.14 0.00 0.00 0.00 174.94 175.21 3ifv n ARG 117 N 0.55 1.01 -1.60 2.79 0.63 -1.26 -4.88 116.66 113.90 3ifv n ARG 117 Ca -0.14 0.36 -0.45 0.00 -0.92 0.00 0.00 57.85 56.71 3ifv n ARG 117 Cb 0.54 -1.88 -0.02 0.00 0.45 0.00 0.00 32.46 31.55 3ifv n ARG 117 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 3ifv n GLN 118 N 1.91 1.44 -2.62 -0.14 7.27 -1.26 -4.93 117.38 119.05 3ifv n GLN 118 Ca 0.16 0.51 -0.41 0.00 0.07 0.00 0.00 57.00 57.33 3ifv n GLN 118 Cb 0.22 -1.91 -0.04 0.00 2.41 0.00 0.00 30.24 30.92 3ifv n GLN 118 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 3ifv s GLU 119 N -1.50 4.61 0.78 3.69 2.02 -1.26 -4.70 118.70 122.34 3ifv s GLU 119 Ca 0.59 1.57 -0.11 0.00 0.02 0.00 0.00 54.97 57.04 3ifv s GLU 119 Cb -0.69 -3.35 0.06 0.00 0.10 0.00 0.00 34.13 30.24 3ifv s GLU 119 CO 0.60 0.07 1.09 -1.25 0.02 0.00 0.00 175.26 175.78 3ifv s PRO 120 N 0.17 2.20 -0.09 0.39 0.04 -1.26 -5.04 135.00 131.40 3ifv s PRO 120 Ca 0.50 0.79 0.01 0.00 0.04 0.00 0.00 61.00 62.33 3ifv s PRO 120 Cb -0.26 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 3ifv s PRO 120 CO 0.31 -1.58 -0.10 -0.51 0.04 0.00 0.00 177.00 175.16 3ifv s ASP 121 N -3.77 4.37 -0.04 6.66 1.01 -1.26 -4.83 116.67 118.81 3ifv s ASP 121 Ca 0.60 -0.15 -0.30 0.00 0.71 0.00 0.00 52.55 53.41 3ifv s ASP 121 Cb -0.15 -1.28 -0.04 0.00 1.01 0.00 0.00 42.92 42.46 3ifv s ASP 121 CO 0.55 0.28 1.27 -0.63 0.21 0.00 0.00 175.17 176.86 3ifv s ILE 122 N -0.35 4.07 0.00 0.77 -1.09 -1.26 -5.17 121.20 118.17 3ifv s ILE 122 Ca 0.04 1.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.87 3ifv s ILE 122 Cb -0.12 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 3ifv s ILE 122 CO 0.02 -0.01 0.00 -0.81 -1.23 0.00 0.00 174.94 172.92 3ifv n PRO 123 N 5.31 0.00 0.00 2.79 -0.04 -1.26 -5.20 135.00 136.60 3ifv n PRO 123 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 3ifv n PRO 123 Cb 0.45 -0.17 0.00 0.00 -0.04 0.00 0.00 33.50 33.74 3ifv n PRO 123 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3ifv n LEU 127 N -0.00 0.00 -0.10 1.53 4.77 -1.26 -5.19 117.00 116.74 3ifv n LEU 127 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3ifv n LEU 127 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 3ifv n LEU 127 CO 0.00 0.00 0.68 0.00 -1.33 0.00 0.00 177.39 176.74 3ifv h ALA 128 N 0.00 0.43 -2.50 -1.18 0.00 -1.83 -3.46 119.26 110.72 3ifv h ALA 128 Ca 0.00 -0.32 -0.53 0.00 0.00 0.00 0.00 54.91 54.06 3ifv h ALA 128 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3ifv h ALA 128 CO 0.00 0.30 -0.42 0.00 0.00 0.00 0.00 179.25 179.13 3ifv s ALA 129 N -4.65 3.93 -0.10 0.00 0.00 -0.72 -3.88 121.76 116.33 3ifv s ALA 129 Ca -0.13 -1.00 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 3ifv s ALA 129 Cb 0.09 -1.83 0.05 0.00 0.00 0.00 0.00 23.12 21.42 3ifv s ALA 129 CO 0.80 0.47 0.21 1.21 0.00 0.00 0.00 175.76 178.44 3ifv s ASN 130 N -3.32 0.20 -0.08 0.00 2.47 -0.37 -2.83 114.94 111.01 3ifv s ASN 130 Ca 0.36 0.45 0.02 0.00 0.42 0.00 0.00 52.86 54.11 3ifv s ASN 130 Cb -0.11 0.42 0.02 0.00 -1.45 0.00 0.00 41.25 40.13 3ifv s ASN 130 CO 0.29 -0.20 -0.11 -0.63 -3.72 0.00 0.00 177.10 172.73 3ifv s ILE 131 N 1.84 1.09 -0.20 -5.21 1.01 0.19 -0.22 121.20 119.70 3ifv s ILE 131 Ca -0.03 -0.42 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 3ifv s ILE 131 Cb -0.11 -1.02 -0.02 0.00 0.01 0.00 0.00 42.46 41.31 3ifv s ILE 131 CO -0.07 0.35 -0.00 -0.69 0.00 0.00 0.00 174.94 174.53 3ifv s VAL 132 N 0.91 3.93 0.30 2.92 1.01 -0.54 0.12 120.40 129.05 3ifv s VAL 132 Ca -0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 3ifv s VAL 132 Cb -0.15 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 3ifv s VAL 132 CO 0.01 0.43 0.34 -1.48 0.00 0.00 0.00 175.10 174.40 3ifv s LEU 133 N 0.97 1.19 -0.02 3.92 -0.00 -0.24 -1.70 118.68 122.80 3ifv s LEU 133 Ca 0.01 -1.49 -0.29 0.00 -0.00 0.00 0.00 54.13 52.37 3ifv s LEU 133 Cb -0.14 0.99 -0.03 0.00 -0.00 0.00 0.00 46.19 47.01 3ifv s LEU 133 CO 0.02 -1.11 0.92 -1.61 -0.00 0.00 0.00 176.35 174.56 3ifv s GLU 134 N -3.51 4.52 0.44 1.48 0.41 -1.26 0.33 118.70 121.11 3ifv s GLU 134 Ca 0.35 1.30 0.23 0.00 -0.41 0.00 0.00 54.97 56.43 3ifv s GLU 134 Cb 0.02 -3.46 1.21 0.00 -1.78 0.00 0.00 34.13 30.12 3ifv s GLU 134 CO 0.20 -0.04 1.80 0.78 -0.49 0.00 0.00 175.26 177.50 3ifv h GLY 135 N 6.86 0.85 0.55 -1.39 0.00 -1.65 -0.49 103.07 107.80 3ifv h GLY 135 Ca -0.40 -0.15 0.18 0.00 0.00 0.00 0.00 47.33 46.96 3ifv h GLY 135 CO 0.76 -0.08 0.55 0.00 0.00 0.00 0.00 176.54 177.76 3ifv h THR 136 N 0.29 0.46 0.09 4.70 1.03 -1.84 -0.39 112.91 117.25 3ifv h THR 136 Ca 0.56 0.00 -0.26 0.00 -0.01 0.00 0.00 66.41 66.70 3ifv h THR 136 Cb 1.61 0.59 0.00 0.00 -1.07 0.00 0.00 68.15 69.28 3ifv h THR 136 CO -0.20 0.00 -1.15 0.45 -0.01 0.00 0.00 175.52 174.60 3ifv h HIS 137 N 0.00 0.48 -0.57 0.00 3.86 -1.48 -2.49 115.15 114.96 3ifv h HIS 137 Ca 0.30 -0.33 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3ifv h HIS 137 Cb 1.40 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.81 3ifv h HIS 137 CO 0.00 1.22 0.34 -0.07 0.86 0.00 0.00 177.93 180.28 3ifv h LEU 138 N 0.10 0.68 0.01 2.43 3.38 -1.25 -0.26 115.31 120.40 3ifv h LEU 138 Ca -0.11 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.82 3ifv h LEU 138 Cb 1.86 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 42.38 3ifv h LEU 138 CO 0.19 0.54 -0.42 0.44 0.09 0.00 0.00 178.44 179.28 3ifv h ASP 139 N 0.76 -1.28 0.27 -0.43 3.32 -1.33 0.27 116.42 118.00 3ifv h ASP 139 Ca 0.20 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.41 3ifv h ASP 139 Cb -0.01 0.50 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 3ifv h ASP 139 CO -0.04 -0.46 -0.32 -0.09 -1.72 0.00 0.00 179.24 176.61 3ifv h ARG 140 N -0.58 -0.61 -0.12 3.56 2.43 -1.44 -0.17 114.38 117.44 3ifv h ARG 140 Ca 0.04 0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 3ifv h ARG 140 Cb 0.66 0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.28 3ifv h ARG 140 CO -0.31 -0.41 -0.38 0.78 -1.51 0.00 0.00 179.97 178.14 3ifv h GLY 141 N -0.63 -0.60 0.51 2.80 0.00 -1.02 0.83 103.07 104.95 3ifv h GLY 141 Ca -0.00 0.47 0.07 0.00 0.00 0.00 0.00 47.33 47.87 3ifv h GLY 141 CO -0.09 -0.23 0.22 -2.22 0.00 0.00 0.00 176.54 174.23 3ifv h ILE 142 N -0.46 0.83 0.13 2.60 2.04 -0.88 -1.65 117.51 120.13 3ifv h ILE 142 Ca 0.08 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 3ifv h ILE 142 Cb 0.60 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3ifv h ILE 142 CO -0.38 0.08 -0.08 0.50 0.00 0.00 0.00 178.15 178.27 3ifv h LYS 143 N 0.42 -0.20 0.21 2.37 3.64 -0.49 -2.45 116.57 120.08 3ifv h LYS 143 Ca 0.27 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 3ifv h LYS 143 Cb 0.28 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 3ifv h LYS 143 CO -0.25 -0.13 -0.47 0.00 -2.27 0.00 0.00 179.45 176.32 3ifv h ALA 144 N 0.66 -0.91 -1.07 5.00 0.00 -0.76 -3.04 119.26 119.14 3ifv h ALA 144 Ca -0.01 -0.11 0.33 0.00 0.00 0.00 0.00 54.91 55.11 3ifv h ALA 144 Cb 0.17 0.77 -0.13 0.00 0.00 0.00 0.00 17.79 18.60 3ifv h ALA 144 CO 0.02 -1.08 0.64 0.00 0.00 0.00 0.00 179.25 178.83 3ifv h ALA 145 N -0.44 2.13 -0.08 0.00 0.00 -1.27 -2.57 119.26 117.03 3ifv h ALA 145 Ca -0.01 0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 3ifv h ALA 145 Cb 0.75 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3ifv h ALA 145 CO -0.22 -0.70 -0.46 0.22 0.00 0.00 0.00 179.25 178.09 3ifv h ASP 146 N 0.31 0.20 -0.13 0.00 3.58 -1.32 -1.56 116.42 117.50 3ifv h ASP 146 Ca 0.72 -0.09 0.04 0.00 0.42 0.00 0.00 57.03 58.12 3ifv h ASP 146 Cb 1.77 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 42.76 3ifv h ASP 146 CO -0.51 0.63 0.16 0.24 -2.88 0.00 0.00 179.24 176.89 3ifv h MET 147 N 0.15 0.00 -0.00 0.28 2.86 -1.46 -3.15 114.93 113.60 3ifv h MET 147 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3ifv h MET 147 Cb 0.88 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 3ifv h MET 147 CO 0.07 0.00 -0.07 0.28 1.06 0.00 0.00 176.91 178.25 3ifv n VAL 148 N -3.72 0.00 -3.60 -2.22 0.31 -0.78 -5.09 118.33 103.23 3ifv n VAL 148 Ca 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 3ifv n VAL 148 Cb 0.27 1.00 -0.01 0.00 -0.91 0.00 0.00 33.84 34.19 3ifv n VAL 148 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3ifv s SER 149 N -1.03 -0.04 0.00 4.52 0.15 -0.66 -3.93 113.70 112.72 3ifv s SER 149 Ca 0.01 -0.03 0.12 0.00 0.70 0.00 0.00 55.95 56.75 3ifv s SER 149 Cb 0.01 0.06 0.30 0.00 -1.71 0.00 0.00 66.02 64.68 3ifv s SER 149 CO 0.06 -0.11 1.21 0.47 1.20 0.00 0.00 173.24 176.07 3ifv n ASP 150 N -0.29 2.85 -4.43 5.45 9.92 -1.26 -4.14 116.55 124.65 3ifv n ASP 150 Ca -0.03 -1.91 -0.32 0.00 -0.53 0.00 0.00 54.79 52.00 3ifv n ASP 150 Cb 0.61 -0.21 -0.14 0.00 -0.64 0.00 0.00 41.12 40.74 3ifv n ASP 150 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 3ifv s HIS 151 N -1.01 2.57 -0.02 1.24 3.76 -1.26 -0.96 115.29 119.60 3ifv s HIS 151 Ca 0.24 -0.26 0.03 0.00 -0.15 0.00 0.00 55.06 54.92 3ifv s HIS 151 Cb 0.13 -1.54 0.00 0.00 1.11 0.00 0.00 32.58 32.28 3ifv s HIS 151 CO 0.17 0.16 -0.09 -1.50 -0.85 0.00 0.00 174.74 172.63 3ifv s ILE 152 N -0.77 0.77 -0.12 0.60 2.07 -0.58 -4.68 121.20 118.48 3ifv s ILE 152 Ca 0.12 -0.37 -0.01 0.00 -1.41 0.00 0.00 60.65 58.99 3ifv s ILE 152 Cb -0.10 -0.68 -0.02 0.00 0.13 0.00 0.00 42.46 41.79 3ifv s ILE 152 CO 0.02 0.24 -0.10 -0.60 -1.91 0.00 0.00 174.94 172.58 3ifv s ARG 153 N 0.12 3.32 -0.10 3.50 3.52 0.09 -0.54 118.95 128.86 3ifv s ARG 153 Ca -0.02 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 54.97 3ifv s ARG 153 Cb -0.08 -2.67 -0.01 0.00 -1.56 0.00 0.00 34.95 30.63 3ifv s ARG 153 CO 0.00 0.30 -0.18 -0.51 -0.81 0.00 0.00 175.30 174.10 3ifv s LEU 154 N 0.15 2.47 -0.13 -0.88 1.02 -0.72 -1.41 118.68 119.19 3ifv s LEU 154 Ca -0.05 -0.40 -0.09 0.00 0.02 0.00 0.00 54.13 53.61 3ifv s LEU 154 Cb -0.15 -1.52 0.04 0.00 0.02 0.00 0.00 46.19 44.58 3ifv s LEU 154 CO 0.04 0.19 0.32 -0.60 0.02 0.00 0.00 176.35 176.32 3ifv s ARG 155 N 0.17 0.33 -0.15 1.70 3.52 -0.89 -2.02 118.95 121.62 3ifv s ARG 155 Ca -0.10 0.56 -0.09 0.00 -0.13 0.00 0.00 55.73 55.97 3ifv s ARG 155 Cb -0.16 0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.23 3ifv s ARG 155 CO 0.06 -0.11 0.15 0.08 -0.81 0.00 0.00 175.30 174.67 3ifv s VAL 156 N 0.81 5.46 -0.57 7.11 1.01 -0.53 -1.09 120.40 132.60 3ifv s VAL 156 Ca -0.05 0.22 -0.15 0.00 0.00 0.00 0.00 61.98 62.00 3ifv s VAL 156 Cb -0.06 -3.44 0.14 0.00 0.00 0.00 0.00 36.38 33.02 3ifv s VAL 156 CO -0.06 0.54 0.51 -0.62 0.00 0.00 0.00 175.10 175.48 3ifv s ASP 157 N -0.44 6.18 0.11 3.32 2.15 0.91 -4.43 116.67 124.47 3ifv s ASP 157 Ca 0.12 -1.93 -0.29 0.00 0.43 0.00 0.00 52.55 50.89 3ifv s ASP 157 Cb -0.12 -2.18 -0.09 0.00 -0.30 0.00 0.00 42.92 40.24 3ifv s ASP 157 CO 0.02 -0.80 1.62 1.23 -0.17 0.00 0.00 175.17 177.07 3ifv h GLY 158 N 8.67 -0.63 0.09 2.66 0.00 -1.84 0.13 103.07 112.14 3ifv h GLY 158 Ca -0.23 0.38 0.07 0.00 0.00 0.00 0.00 47.33 47.55 3ifv h GLY 158 CO 0.98 -0.25 -0.25 0.00 0.00 0.00 0.00 176.54 177.01 3ifv h ALA 159 N 0.08 -0.12 -0.01 3.60 0.00 -1.93 0.86 119.26 121.74 3ifv h ALA 159 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ifv h ALA 159 Cb 0.58 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3ifv h ALA 159 CO -0.18 -0.67 -0.04 0.39 0.00 0.00 0.00 179.25 178.75 3ifv n GLU 160 N -5.38 1.10 -3.94 0.00 -0.58 -1.01 -4.90 120.64 105.92 3ifv n GLU 160 Ca -0.00 -0.37 -0.37 0.00 -0.42 0.00 0.00 57.16 55.99 3ifv n GLU 160 Cb 0.30 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.69 3ifv n GLU 160 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3ifv n GLU 161 N -0.63 -1.02 -4.04 3.49 1.02 0.30 -4.58 120.64 115.18 3ifv n GLU 161 Ca 0.19 0.25 -0.19 0.00 -0.02 0.00 0.00 57.16 57.39 3ifv n GLU 161 Cb 0.24 -3.44 -0.16 0.00 -0.02 0.00 0.00 31.44 28.06 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 -3.63 0.38 -0.14 2.62 2.01 -0.53 -3.38 115.64 112.97 3ifv s THR 162 Ca 0.39 -0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.28 3ifv s THR 162 Cb -0.18 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 3ifv s THR 162 CO 0.93 0.20 0.17 0.12 -0.69 0.00 0.00 174.62 175.34 3ifv s PHE 163 N 1.05 3.54 -0.03 4.92 5.36 -0.54 -0.06 117.98 132.21 3ifv s PHE 163 Ca -0.09 0.51 0.04 0.00 -0.96 0.00 0.00 56.93 56.43 3ifv s PHE 163 Cb -0.14 -2.07 -0.00 0.00 -0.34 0.00 0.00 43.02 40.47 3ifv s PHE 163 CO -0.01 0.55 -0.16 -1.01 -1.46 0.00 0.00 175.22 173.13 3ifv s HIS 164 N -0.48 1.53 -0.25 10.12 3.76 -0.25 -0.35 115.29 129.38 3ifv s HIS 164 Ca 0.14 -0.40 0.01 0.00 -0.15 0.00 0.00 55.06 54.66 3ifv s HIS 164 Cb -0.12 -1.03 0.05 0.00 1.11 0.00 0.00 32.58 32.58 3ifv s HIS 164 CO 0.03 -0.13 -0.11 0.42 -0.85 0.00 0.00 174.74 174.10 3ifv s ILE 165 N -0.02 2.34 0.11 0.60 1.01 -0.46 -2.08 121.20 122.69 3ifv s ILE 165 Ca -0.02 -1.37 -0.02 0.00 0.00 0.00 0.00 60.65 59.24 3ifv s ILE 165 Cb -0.10 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 3ifv s ILE 165 CO 0.01 0.12 0.05 -1.83 0.00 0.00 0.00 174.94 173.29 3ifv s GLU 166 N 1.19 0.85 -0.08 2.79 -1.05 -0.50 -0.71 118.70 121.18 3ifv s GLU 166 Ca -0.04 -1.34 -0.22 0.00 -0.15 0.00 0.00 54.97 53.22 3ifv s GLU 166 Cb -0.18 0.25 0.05 0.00 -0.44 0.00 0.00 34.13 33.81 3ifv s GLU 166 CO -0.06 -0.23 0.51 0.00 0.95 0.00 0.00 175.26 176.43 3ifv s ALA 167 N -4.00 -1.31 -0.31 -0.84 0.00 -0.34 -0.73 121.76 114.23 3ifv s ALA 167 Ca 0.18 1.05 -0.04 0.00 0.00 0.00 0.00 51.96 53.15 3ifv s ALA 167 Cb 0.07 -0.25 0.04 0.00 0.00 0.00 0.00 23.12 22.98 3ifv s ALA 167 CO -0.02 -0.30 0.04 -2.00 0.00 0.00 0.00 175.76 173.48 3ifv s GLU 168 N -0.78 2.62 0.00 0.00 2.12 -1.26 -0.22 118.70 121.17 3ifv s GLU 168 Ca -0.08 -1.16 0.00 0.00 0.36 0.00 0.00 54.97 54.09 3ifv s GLU 168 Cb -0.03 -3.29 0.00 0.00 0.26 0.00 0.00 34.13 31.07 3ifv s GLU 168 CO 0.05 -0.60 0.00 0.41 -0.54 0.00 0.00 175.26 174.59 3ifv n GLY 169 N 4.73 -2.90 0.13 -1.50 0.00 3.02 -4.84 105.19 103.84 3ifv n GLY 169 Ca -0.13 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.37 3ifv n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ifv n ASP 170 N 0.00 1.94 0.05 1.61 8.00 -1.26 -4.58 116.55 122.30 3ifv n ASP 170 Ca 0.00 0.35 -0.18 0.00 0.71 0.00 0.00 54.79 55.67 3ifv n ASP 170 Cb 0.00 -0.84 -0.14 0.00 -0.02 0.00 0.00 41.12 40.11 3ifv n ASP 170 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3ifv h THR 171 N -1.00 0.98 -3.73 -3.53 1.35 -1.94 -3.49 112.91 101.55 3ifv h THR 171 Ca -0.65 -2.64 -0.29 0.00 -0.55 0.00 0.00 66.41 62.28 3ifv h THR 171 Cb 1.57 2.68 -0.17 0.00 -1.73 0.00 0.00 68.15 70.50 3ifv h THR 171 CO -0.39 0.81 -0.72 -1.81 -0.25 0.00 0.00 175.52 173.16 3ifv s ASP 172 N -6.98 1.36 0.28 5.36 1.01 -1.26 -5.16 116.67 111.27 3ifv s ASP 172 Ca -0.12 -0.88 0.05 0.00 0.71 0.00 0.00 52.55 52.31 3ifv s ASP 172 Cb 0.07 0.03 -0.06 0.00 1.01 0.00 0.00 42.92 43.97 3ifv s ASP 172 CO 0.84 -0.33 -0.01 -1.81 0.21 0.00 0.00 175.17 174.07 3ifv s ASP 173 N -2.65 2.37 0.03 0.27 1.01 -1.26 0.66 116.67 117.09 3ifv s ASP 173 Ca 0.08 -1.26 -0.03 0.00 0.71 0.00 0.00 52.55 52.05 3ifv s ASP 173 Cb -0.00 -0.09 -0.02 0.00 1.01 0.00 0.00 42.92 43.82 3ifv s ASP 173 CO -0.01 -0.47 0.04 0.54 0.21 0.00 0.00 175.17 175.47 3ifv s VAL 174 N -3.22 0.14 -0.24 -1.27 0.11 0.69 -4.90 120.40 111.71 3ifv s VAL 174 Ca 0.31 -1.12 -0.07 0.00 -2.93 0.00 0.00 61.98 58.17 3ifv s VAL 174 Cb 0.06 -0.76 0.11 0.00 -1.53 0.00 0.00 36.38 34.26 3ifv s VAL 174 CO 0.12 -0.62 0.48 -0.62 -3.33 0.00 0.00 175.10 171.14 3ifv s ASP 175 N -1.99 -0.50 -0.33 3.54 2.15 -1.26 -1.20 116.67 117.08 3ifv s ASP 175 Ca -0.07 1.04 -0.14 0.00 0.43 0.00 0.00 52.55 53.80 3ifv s ASP 175 Cb -0.03 1.62 -0.02 0.00 -0.30 0.00 0.00 42.92 44.19 3ifv s ASP 175 CO -0.04 -0.24 0.30 -0.22 -0.17 0.00 0.00 175.17 174.80 3ifv s LEU 176 N 2.70 4.40 -0.24 -1.34 1.98 0.11 -4.97 118.68 121.31 3ifv s LEU 176 Ca 0.01 -0.25 -0.06 0.00 -2.89 0.00 0.00 54.13 50.94 3ifv s LEU 176 Cb -0.13 -2.25 -0.02 0.00 0.66 0.00 0.00 46.19 44.45 3ifv s LEU 176 CO -0.15 -0.26 0.04 -0.55 -1.89 0.00 0.00 176.35 173.53 3ifv s SER 177 N 1.73 4.88 -0.58 3.68 0.15 -1.26 -1.36 113.70 120.94 3ifv s SER 177 Ca 0.09 -0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.50 3ifv s SER 177 Cb -0.17 -1.87 0.15 0.00 -1.71 0.00 0.00 66.02 62.42 3ifv s SER 177 CO 0.11 -0.03 0.35 -0.76 1.20 0.00 0.00 173.24 174.11 3ifv s LEU 178 N 1.57 4.66 1.21 3.45 1.43 0.53 -4.98 118.68 126.54 3ifv s LEU 178 Ca 0.06 -3.08 -0.20 0.00 -1.03 0.00 0.00 54.13 49.88 3ifv s LEU 178 Cb -0.15 -1.71 0.29 0.00 0.03 0.00 0.00 46.19 44.65 3ifv s LEU 178 CO 0.02 -0.25 1.13 -2.16 0.23 0.00 0.00 176.35 175.31 3ifv s PRO 179 N -0.39 -1.27 0.47 1.29 0.04 -1.26 -1.47 135.00 132.42 3ifv s PRO 179 Ca 0.18 -0.17 0.30 0.00 0.04 0.00 0.00 61.00 61.35 3ifv s PRO 179 Cb -0.22 -1.60 1.38 0.00 0.04 0.00 0.00 34.50 34.10 3ifv s PRO 179 CO -0.03 -3.72 1.74 -1.35 0.04 0.00 0.00 177.00 173.68 3ifv h PRO 180 N -2.59 0.15 0.00 0.56 0.11 -1.80 0.69 132.00 129.13 3ifv h PRO 180 Ca -0.44 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 3ifv h PRO 180 Cb 1.28 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3ifv h PRO 180 CO 0.31 0.10 -0.26 0.00 -0.21 0.00 0.00 178.00 177.95 3ifv h ALA 181 N 1.49 1.13 -0.66 -0.75 0.00 -1.93 -2.34 119.26 116.19 3ifv h ALA 181 Ca 0.66 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3ifv h ALA 181 Cb 2.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.92 3ifv h ALA 181 CO -0.19 0.32 0.00 -0.25 0.00 0.00 0.00 179.25 179.13 3ifv n ASP 182 N -3.59 4.26 -4.56 0.00 8.00 0.23 -4.91 116.55 115.98 3ifv n ASP 182 Ca -0.01 -2.22 -0.28 0.00 0.71 0.00 0.00 54.79 52.99 3ifv n ASP 182 Cb 0.39 -0.51 -0.10 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.42 2.94 0.12 0.64 1.43 -0.88 -4.79 118.68 116.72 3ifv s LEU 183 Ca 0.48 -0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 52.93 3ifv s LEU 183 Cb 0.28 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.74 3ifv s LEU 183 CO 0.28 0.14 1.43 0.40 0.23 0.00 0.00 176.35 178.82 3ifv h ILE 184 N 3.02 1.28 0.00 -0.59 2.04 -1.60 -3.49 117.51 118.17 3ifv h ILE 184 Ca -0.48 -1.61 0.00 0.00 1.00 0.00 0.00 64.86 63.77 3ifv h ILE 184 Cb 1.19 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.82 3ifv h ILE 184 CO 0.52 0.53 0.00 -1.54 0.00 0.00 0.00 178.15 177.66 3ifv n SER 185 N -4.10 0.00 -3.72 1.72 3.41 -1.13 -4.98 113.62 104.82 3ifv n SER 185 Ca -0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.44 3ifv n SER 185 Cb 0.56 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.42 3ifv n SER 185 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3ifv s ILE 186 N -2.00 -0.00 -0.38 -1.33 2.07 -1.26 -1.47 121.20 116.83 3ifv s ILE 186 Ca 0.00 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.19 3ifv s ILE 186 Cb 0.00 -0.63 0.08 0.00 0.13 0.00 0.00 42.46 42.04 3ifv s ILE 186 CO 0.00 0.00 0.17 -1.61 -1.91 0.00 0.00 174.94 171.59 3ifv s GLU 187 N 0.28 2.38 -0.74 3.50 2.02 0.69 -4.97 118.70 121.86 3ifv s GLU 187 Ca -0.00 -1.51 -0.05 0.00 0.02 0.00 0.00 54.97 53.43 3ifv s GLU 187 Cb -0.03 -3.56 0.02 0.00 0.10 0.00 0.00 34.13 30.65 3ifv s GLU 187 CO 0.00 -0.89 2.81 0.00 0.02 0.00 0.00 175.26 177.19 3ifv n ALA 188 N 4.74 6.64 -1.29 5.21 0.00 -1.26 -1.24 120.51 133.31 3ifv n ALA 188 Ca -0.08 -3.21 -0.33 0.00 0.00 0.00 0.00 53.44 49.81 3ifv n ALA 188 Cb 0.43 -2.46 0.09 0.00 0.00 0.00 0.00 19.45 17.51 3ifv n ALA 188 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ifv s GLY 189 N 0.75 2.19 0.08 0.00 0.00 -1.25 -4.42 107.32 104.68 3ifv s GLY 189 Ca 0.60 0.75 -0.36 0.00 0.00 0.00 0.00 44.72 45.71 3ifv s GLY 189 CO -0.14 1.15 1.43 0.00 0.00 0.00 0.00 173.10 175.54 3ifv n ALA 190 N -2.91 -0.33 -3.64 3.20 0.00 -1.26 -4.25 120.51 111.32 3ifv n ALA 190 Ca 0.12 0.49 -0.07 0.00 0.00 0.00 0.00 53.44 53.98 3ifv n ALA 190 Cb 0.51 -2.16 -0.07 0.00 0.00 0.00 0.00 19.45 17.73 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 0.82 -1.91 -0.30 0.00 0.00 -1.26 -4.33 121.76 114.78 3ifv s ALA 191 Ca 0.84 2.35 -0.14 0.00 0.00 0.00 0.00 51.96 55.01 3ifv s ALA 191 Cb -0.89 -1.42 0.15 0.00 0.00 0.00 0.00 23.12 20.96 3ifv s ALA 191 CO 0.46 -0.37 0.89 0.34 0.00 0.00 0.00 175.76 177.07 3ifv s ASP 192 N 1.42 -0.74 -0.18 0.00 -1.08 0.15 -1.45 116.67 114.79 3ifv s ASP 192 Ca -0.08 1.03 -0.22 0.00 -0.52 0.00 0.00 52.55 52.75 3ifv s ASP 192 Cb -0.05 1.81 0.06 0.00 -1.46 0.00 0.00 42.92 43.28 3ifv s ASP 192 CO -0.17 -0.14 0.59 -0.44 0.52 0.00 0.00 175.17 175.53 3ifv s SER 193 N 2.50 -0.60 -0.07 -0.34 0.01 -0.85 -1.50 113.70 112.84 3ifv s SER 193 Ca -0.04 1.04 -0.02 0.00 1.31 0.00 0.00 55.95 58.24 3ifv s SER 193 Cb -0.08 1.04 -0.03 0.00 0.21 0.00 0.00 66.02 67.16 3ifv s SER 193 CO -0.18 -0.29 0.02 -0.22 0.41 0.00 0.00 173.24 172.97 3ifv s LEU 194 N -0.06 3.65 0.17 2.44 2.96 -1.26 -1.75 118.68 124.82 3ifv s LEU 194 Ca -0.03 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.05 3ifv s LEU 194 Cb -0.04 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 3ifv s LEU 194 CO 0.03 0.36 -0.02 -0.36 -1.32 0.00 0.00 176.35 175.04 3ifv s PHE 195 N -0.94 1.23 -0.17 5.38 0.40 0.30 -0.26 117.98 123.93 3ifv s PHE 195 Ca 0.15 -0.95 -0.29 0.00 -0.60 0.00 0.00 56.93 55.23 3ifv s PHE 195 Cb -0.11 -0.69 -0.03 0.00 0.51 0.00 0.00 43.02 42.69 3ifv s PHE 195 CO 0.04 -0.13 1.62 0.45 0.70 0.00 0.00 175.22 177.89 3ifv s SER 196 N -3.18 6.49 0.22 1.36 0.15 -1.26 -1.53 113.70 115.95 3ifv s SER 196 Ca 0.22 1.82 -0.07 0.00 0.70 0.00 0.00 55.95 58.62 3ifv s SER 196 Cb 0.05 -2.53 0.18 0.00 -1.71 0.00 0.00 66.02 62.01 3ifv s SER 196 CO 0.03 -1.14 1.75 0.25 1.20 0.00 0.00 173.24 175.33 3ifv h LEU 197 N 11.19 1.03 -1.05 3.45 6.46 -1.37 -2.81 115.31 132.20 3ifv h LEU 197 Ca -0.35 -0.21 -0.03 0.00 -0.12 0.00 0.00 57.88 57.17 3ifv h LEU 197 Cb 1.16 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.79 3ifv h LEU 197 CO 0.98 0.98 0.26 0.44 -0.62 0.00 0.00 178.44 180.48 3ifv h ASP 198 N 1.04 0.85 -0.49 1.25 3.32 -1.91 0.20 116.42 120.69 3ifv h ASP 198 Ca 0.22 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.16 3ifv h ASP 198 Cb 0.34 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 3ifv h ASP 198 CO -0.00 0.76 0.32 1.88 -1.72 0.00 0.00 179.24 180.48 3ifv h TYR 199 N 0.92 0.60 -0.41 4.55 -1.99 -1.92 -1.85 116.97 116.87 3ifv h TYR 199 Ca 0.22 0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.83 3ifv h TYR 199 Cb 0.17 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.69 3ifv h TYR 199 CO 0.01 0.38 -0.25 1.25 -0.00 0.00 0.00 178.16 179.54 3ifv h LEU 200 N 0.65 0.94 -0.50 3.88 5.85 -0.88 -1.23 115.31 124.02 3ifv h LEU 200 Ca 0.18 -0.42 0.01 0.00 0.84 0.00 0.00 57.88 58.49 3ifv h LEU 200 Cb -0.06 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.68 3ifv h LEU 200 CO -0.05 1.16 0.31 0.50 -0.34 0.00 0.00 178.44 180.03 3ifv h LYS 201 N 0.72 0.62 -0.24 1.25 3.64 -0.63 0.31 116.57 122.24 3ifv h LYS 201 Ca 0.09 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 3ifv h LYS 201 Cb 0.83 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 3ifv h LYS 201 CO 0.07 0.41 -0.19 -0.44 -2.27 0.00 0.00 179.45 177.03 3ifv h ASP 202 N 0.63 0.58 -0.36 4.20 3.32 -1.19 0.13 116.42 123.73 3ifv h ASP 202 Ca 0.19 -0.45 0.06 0.00 0.02 0.00 0.00 57.03 56.85 3ifv h ASP 202 Cb -0.03 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.31 3ifv h ASP 202 CO -0.07 0.91 0.04 0.24 -1.72 0.00 0.00 179.24 178.64 3ifv h MET 203 N 0.25 0.15 -0.59 3.56 2.86 -0.90 -2.21 114.93 118.05 3ifv h MET 203 Ca 0.04 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3ifv h MET 203 Cb 0.73 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.32 3ifv h MET 203 CO 0.05 0.10 0.39 -0.97 1.06 0.00 0.00 176.91 177.54 3ifv h ASN 204 N 0.15 0.66 -0.10 1.22 -1.24 -0.20 -1.30 115.58 114.78 3ifv h ASN 204 Ca 0.17 -0.02 0.03 0.00 0.71 0.00 0.00 56.30 57.20 3ifv h ASN 204 Cb 0.22 -0.16 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 3ifv h ASN 204 CO -0.25 0.48 0.10 0.50 -1.29 0.00 0.00 177.43 176.97 3ifv h LYS 205 N 0.78 0.00 0.00 6.67 1.63 -0.32 -2.26 116.57 123.08 3ifv h LYS 205 Ca 0.22 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.94 3ifv h LYS 205 Cb -0.07 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.55 3ifv h LYS 205 CO -0.05 0.00 -0.78 0.00 -3.45 0.00 0.00 179.45 175.17 3ifv h ALA 206 N 1.89 0.69 -2.49 5.00 0.00 -1.18 -3.45 119.26 119.72 3ifv h ALA 206 Ca 0.05 -0.37 -0.53 0.00 0.00 0.00 0.00 54.91 54.06 3ifv h ALA 206 Cb 0.25 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.11 3ifv h ALA 206 CO -0.00 0.44 0.83 0.42 0.00 0.00 0.00 179.25 180.93 3ifv s ILE 207 N -3.10 3.28 0.81 0.00 1.01 -0.85 -4.72 121.20 117.63 3ifv s ILE 207 Ca 0.02 0.83 -0.13 0.00 0.00 0.00 0.00 60.65 61.36 3ifv s ILE 207 Cb 0.08 -3.53 0.09 0.00 0.01 0.00 0.00 42.46 39.10 3ifv s ILE 207 CO 0.76 0.03 1.21 -2.84 0.00 0.00 0.00 174.94 174.10 3ifv s PRO 208 N 1.77 1.60 0.44 2.79 0.02 -1.26 -4.87 135.00 135.49 3ifv s PRO 208 Ca 0.67 1.77 0.15 0.00 0.02 0.00 0.00 61.00 63.61 3ifv s PRO 208 Cb -0.37 -1.77 1.07 0.00 0.02 0.00 0.00 34.50 33.45 3ifv s PRO 208 CO 0.30 -2.25 1.98 1.15 -0.33 0.00 0.00 177.00 177.85 3ifv h THR 209 N -0.93 0.87 -0.02 0.99 2.02 -1.96 -1.85 112.91 112.03 3ifv h THR 209 Ca -0.46 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.59 3ifv h THR 209 Cb 1.30 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 3ifv h THR 209 CO 0.46 0.07 -0.05 0.47 0.37 0.00 0.00 175.52 176.84 3ifv n ASP 210 N -4.46 2.22 -4.70 4.18 8.00 -1.26 -4.39 116.55 116.13 3ifv n ASP 210 Ca 0.10 -1.61 -0.38 0.00 0.71 0.00 0.00 54.79 53.61 3ifv n ASP 210 Cb 0.40 0.07 0.05 0.00 -0.02 0.00 0.00 41.12 41.62 3ifv n ASP 210 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ifv n ALA 211 N 0.75 1.03 -2.53 2.24 0.00 -0.70 -4.74 120.51 116.56 3ifv n ALA 211 Ca 0.09 0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.20 3ifv n ALA 211 Cb 0.39 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.51 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 -3.00 4.30 -0.12 0.00 2.02 -1.26 -1.85 118.70 118.78 3ifv s GLU 212 Ca 0.77 0.68 0.01 0.00 0.02 0.00 0.00 54.97 56.45 3ifv s GLU 212 Cb -0.41 -3.35 -0.01 0.00 0.10 0.00 0.00 34.13 30.46 3ifv s GLU 212 CO 0.46 0.34 -0.17 0.08 0.02 0.00 0.00 175.26 175.99 3ifv s VAL 213 N -0.07 2.67 -0.20 2.63 1.01 0.15 -4.45 120.40 122.13 3ifv s VAL 213 Ca 0.30 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 3ifv s VAL 213 Cb -0.18 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 3ifv s VAL 213 CO 0.16 0.54 0.08 -0.89 0.00 0.00 0.00 175.10 174.99 3ifv s THR 214 N 0.39 4.85 -0.16 3.92 2.01 0.39 -1.07 115.64 125.97 3ifv s THR 214 Ca -0.13 -0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.85 3ifv s THR 214 Cb -0.17 -3.21 -0.01 0.00 0.01 0.00 0.00 72.50 69.12 3ifv s THR 214 CO 0.06 0.42 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.60 3ifv s VAL 215 N 0.67 2.91 -0.14 3.82 1.01 0.33 0.50 120.40 129.50 3ifv s VAL 215 Ca 0.04 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 3ifv s VAL 215 Cb -0.13 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3ifv s VAL 215 CO 0.01 0.50 -0.11 -1.61 0.00 0.00 0.00 175.10 173.89 3ifv s GLU 216 N 0.87 3.43 0.01 2.72 2.02 -0.59 0.55 118.70 127.71 3ifv s GLU 216 Ca -0.03 -0.65 -0.05 0.00 0.02 0.00 0.00 54.97 54.25 3ifv s GLU 216 Cb -0.15 -2.70 -0.00 0.00 0.10 0.00 0.00 34.13 31.37 3ifv s GLU 216 CO -0.00 0.19 0.10 -1.17 0.02 0.00 0.00 175.26 174.40 3ifv s LEU 217 N 0.42 1.73 0.00 1.80 2.96 -1.13 -1.81 118.68 122.66 3ifv s LEU 217 Ca -0.09 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 3ifv s LEU 217 Cb -0.15 0.54 0.00 0.00 0.50 0.00 0.00 46.19 47.07 3ifv s LEU 217 CO 0.05 -0.37 0.00 0.61 -1.32 0.00 0.00 176.35 175.32 3ifv n GLY 218 N 1.42 4.00 3.46 7.98 0.00 -1.26 -1.75 105.19 119.03 3ifv n GLY 218 Ca -0.23 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.24 3.34 -1.30 1.61 2.02 -1.26 0.32 118.70 123.19 3ifv s GLU 219 Ca 0.00 -0.73 -0.11 0.00 0.02 0.00 0.00 54.97 54.16 3ifv s GLU 219 Cb 0.00 -3.64 0.00 0.00 0.10 0.00 0.00 34.13 30.59 3ifv s GLU 219 CO 0.00 -0.44 0.57 0.39 0.02 0.00 0.00 175.26 175.79 3ifv n GLU 220 N 5.01 -2.23 -4.19 1.61 1.02 -0.56 -4.92 120.64 116.38 3ifv n GLU 220 Ca -0.13 0.39 -0.11 0.00 -0.02 0.00 0.00 57.16 57.28 3ifv n GLU 220 Cb 0.49 -4.18 -0.10 0.00 -0.02 0.00 0.00 31.44 27.63 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 -3.76 0.98 0.57 -0.32 0.08 -1.26 -4.94 117.98 109.34 3ifv s PHE 221 Ca 0.21 -1.08 -0.19 0.00 0.12 0.00 0.00 56.93 56.00 3ifv s PHE 221 Cb -0.09 -0.57 -0.04 0.00 -0.57 0.00 0.00 43.02 41.75 3ifv s PHE 221 CO 0.89 -0.31 1.20 -2.14 -0.10 0.00 0.00 175.22 174.75 3ifv s PRO 222 N -3.94 3.10 0.05 0.24 0.02 -1.26 -4.11 135.00 129.09 3ifv s PRO 222 Ca 0.20 1.81 -0.14 0.00 0.02 0.00 0.00 61.00 62.89 3ifv s PRO 222 Cb 0.07 -1.99 -0.06 0.00 0.02 0.00 0.00 34.50 32.54 3ifv s PRO 222 CO 0.00 -1.10 0.44 0.54 -0.33 0.00 0.00 177.00 176.55 3ifv s VAL 223 N -1.60 4.99 0.06 3.83 0.11 -0.89 -4.60 120.40 122.30 3ifv s VAL 223 Ca 0.76 0.78 0.07 0.00 -2.93 0.00 0.00 61.98 60.66 3ifv s VAL 223 Cb -0.30 -3.72 -0.03 0.00 -1.53 0.00 0.00 36.38 30.80 3ifv s VAL 223 CO 0.33 0.46 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.87 3ifv s LYS 224 N -1.40 2.10 -0.05 1.54 1.02 -0.75 -1.16 119.74 121.05 3ifv s LYS 224 Ca 0.28 -0.98 0.05 0.00 0.02 0.00 0.00 55.97 55.34 3ifv s LYS 224 Cb -0.16 -2.24 -0.01 0.00 -0.52 0.00 0.00 37.83 34.90 3ifv s LYS 224 CO 0.16 0.53 -0.21 -0.51 -0.92 0.00 0.00 175.35 174.40 3ifv s LEU 225 N -1.68 2.00 0.06 3.17 1.43 -0.21 -1.54 118.68 121.92 3ifv s LEU 225 Ca 0.17 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.90 3ifv s LEU 225 Cb -0.11 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 3ifv s LEU 225 CO 0.08 0.20 -0.18 -1.00 0.23 0.00 0.00 176.35 175.69 3ifv s HIS 226 N -0.10 1.52 0.25 0.29 3.76 0.18 -1.29 115.29 119.90 3ifv s HIS 226 Ca -0.03 -0.39 -0.22 0.00 -0.15 0.00 0.00 55.06 54.27 3ifv s HIS 226 Cb -0.12 -0.87 0.03 0.00 1.11 0.00 0.00 32.58 32.73 3ifv s HIS 226 CO 0.03 0.10 0.73 1.52 -0.85 0.00 0.00 174.74 176.26 3ifv s TYR 227 N -1.00 -0.23 0.09 1.40 -0.85 -1.10 -0.46 117.35 115.21 3ifv s TYR 227 Ca 0.04 -0.18 0.07 0.00 -0.52 0.00 0.00 57.07 56.48 3ifv s TYR 227 Cb -0.09 0.68 -0.04 0.00 0.38 0.00 0.00 41.96 42.89 3ifv s TYR 227 CO 0.02 -1.15 -0.13 -0.65 -1.52 0.00 0.00 175.55 172.12 3ifv s GLN 228 N -3.83 2.03 0.39 -3.49 -0.21 -1.26 -2.52 119.66 110.78 3ifv s GLN 228 Ca 0.10 -1.05 0.04 0.00 0.02 0.00 0.00 55.36 54.47 3ifv s GLN 228 Cb -0.05 -2.24 -0.05 0.00 1.00 0.00 0.00 33.01 31.67 3ifv s GLN 228 CO 0.04 0.51 0.05 0.96 -2.12 0.00 0.00 175.29 174.72 3ifv s ILE 229 N -1.15 1.34 -0.84 1.08 -4.36 -0.97 -4.87 121.20 111.44 3ifv s ILE 229 Ca 0.19 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.57 3ifv s ILE 229 Cb -0.11 -2.69 0.00 0.00 1.25 0.00 0.00 42.46 40.92 3ifv s ILE 229 CO 0.11 0.00 0.70 0.00 0.24 0.00 0.00 174.94 176.00 3ifv n ALA 230 N -0.90 -1.28 -0.33 2.27 0.00 -1.26 -1.42 120.51 117.59 3ifv n ALA 230 Ca -0.06 0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.40 3ifv n ALA 230 Cb 0.67 -2.23 -0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 -3.21 -1.95 0.00 0.00 4.07 -1.26 -0.88 120.64 117.41 3ifv n GLU 231 Ca -0.16 0.15 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 3ifv n GLU 231 Cb 0.60 -3.27 0.00 0.00 -0.06 0.00 0.00 31.44 28.71 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 0.26 0.72 0.60 8.31 0.00 -0.51 -5.03 105.19 109.54 3ifv n GLY 232 Ca -0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 3ifv n GLY 232 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3ifv n MET 233 N 0.00 1.82 -4.25 1.61 2.81 -0.06 -4.83 117.12 114.21 3ifv n MET 233 Ca 0.00 -1.20 -0.18 0.00 -1.81 0.00 0.00 57.70 54.51 3ifv n MET 233 Cb 0.00 -1.46 -0.11 0.00 -0.71 0.00 0.00 33.22 30.94 3ifv n MET 233 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3ifv s GLY 234 N -1.86 1.12 -0.00 3.03 0.00 -1.04 -1.94 107.32 106.62 3ifv s GLY 234 Ca 0.35 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 43.74 3ifv s GLY 234 CO 0.31 -1.42 -0.05 -0.51 0.00 0.00 0.00 173.10 171.44 3ifv s THR 235 N -2.33 0.37 -0.09 0.90 -4.23 -0.65 -2.28 115.64 107.33 3ifv s THR 235 Ca 0.11 -0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.43 3ifv s THR 235 Cb -0.04 -0.32 0.01 0.00 1.34 0.00 0.00 72.50 73.49 3ifv s THR 235 CO 0.03 0.09 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.39 3ifv s ILE 236 N -0.15 1.59 -0.09 2.99 1.01 -1.05 -0.64 121.20 124.86 3ifv s ILE 236 Ca 0.01 -0.74 0.04 0.00 0.00 0.00 0.00 60.65 59.96 3ifv s ILE 236 Cb -0.02 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 3ifv s ILE 236 CO -0.00 0.46 -0.21 -0.89 0.00 0.00 0.00 174.94 174.29 3ifv s THR 237 N 0.59 2.35 0.06 2.92 2.01 0.94 -2.72 115.64 121.79 3ifv s THR 237 Ca -0.15 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 60.96 3ifv s THR 237 Cb -0.17 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 3ifv s THR 237 CO 0.05 0.56 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.20 3ifv s TYR 238 N 0.10 2.95 -0.01 4.92 4.12 -0.41 0.64 117.35 129.67 3ifv s TYR 238 Ca -0.10 -0.02 0.04 0.00 0.02 0.00 0.00 57.07 57.00 3ifv s TYR 238 Cb -0.16 -1.56 -0.01 0.00 -1.52 0.00 0.00 41.96 38.71 3ifv s TYR 238 CO 0.06 0.45 -0.13 1.41 0.02 0.00 0.00 175.55 177.36 3ifv s MET 239 N -1.97 1.06 -0.12 -0.62 1.75 -0.56 -1.04 119.30 117.79 3ifv s MET 239 Ca 0.22 -0.45 0.01 0.00 -1.25 0.00 0.00 55.69 54.22 3ifv s MET 239 Cb -0.11 -1.01 0.02 0.00 2.84 0.00 0.00 34.83 36.56 3ifv s MET 239 CO 0.14 0.27 -0.13 -1.17 -0.65 0.00 0.00 175.02 173.48 3ifv s LEU 240 N -0.26 1.56 0.49 4.11 2.96 -0.31 -1.51 118.68 125.72 3ifv s LEU 240 Ca 0.04 -0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 53.31 3ifv s LEU 240 Cb -0.05 -1.03 -0.07 0.00 0.50 0.00 0.00 46.19 45.54 3ifv s LEU 240 CO -0.00 -0.04 1.42 0.00 -1.32 0.00 0.00 176.35 176.40 3ifv n ALA 241 N 4.56 1.90 -1.43 5.97 0.00 -0.37 -2.10 120.51 129.04 3ifv n ALA 241 Ca -0.17 0.20 -0.31 0.00 0.00 0.00 0.00 53.44 53.15 3ifv n ALA 241 Cb 0.51 -2.39 0.06 0.00 0.00 0.00 0.00 19.45 17.63 3ifv n ALA 241 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3ifv s PRO 242 N -2.65 2.66 0.00 0.00 0.04 -1.26 -4.73 135.00 129.06 3ifv s PRO 242 Ca 0.66 1.12 0.31 0.00 0.04 0.00 0.00 61.00 63.12 3ifv s PRO 242 Cb -0.43 -1.95 1.62 0.00 0.04 0.00 0.00 34.50 33.78 3ifv s PRO 242 CO 0.54 -1.33 2.07 0.54 0.04 0.00 0.00 177.00 178.86