#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf5 s THR 34 N 0.00 -0.03 -0.82 1.96 -1.32 -1.26 -5.01 115.64 109.16 3cf5 s THR 34 Ca 0.00 0.11 -0.03 0.00 -1.21 0.00 0.00 61.69 60.56 3cf5 s THR 34 Cb 0.00 -0.46 -0.04 0.00 -1.51 0.00 0.00 72.50 70.50 3cf5 s THR 34 CO 0.00 0.05 0.73 1.21 -2.21 0.00 0.00 174.62 174.40 3cf5 n GLU 35 N 4.07 -1.67 -4.41 7.08 4.07 -1.26 -5.08 120.64 123.44 3cf5 n GLU 35 Ca -0.23 0.99 -0.20 0.00 -0.06 0.00 0.00 57.16 57.66 3cf5 n GLU 35 Cb 0.54 -5.28 -0.10 0.00 -0.06 0.00 0.00 31.44 26.54 3cf5 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3cf5 s ALA 36 N -3.21 2.19 0.35 4.31 0.00 -1.26 -4.69 121.76 119.45 3cf5 s ALA 36 Ca 0.25 -1.97 0.07 0.00 0.00 0.00 0.00 51.96 50.31 3cf5 s ALA 36 Cb -0.03 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 3cf5 s ALA 36 CO 0.65 -0.36 0.47 -0.51 0.00 0.00 0.00 175.76 176.02 3cf5 s LEU 37 N -3.44 3.87 -0.19 0.00 1.43 0.73 -4.94 118.68 116.14 3cf5 s LEU 37 Ca 0.36 -0.27 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 3cf5 s LEU 37 Cb 0.08 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.59 3cf5 s LEU 37 CO 0.15 -0.49 0.48 -2.16 0.23 0.00 0.00 176.35 174.55 3cf5 s PRO 38 N -4.19 4.21 -0.02 1.29 0.04 -1.26 -0.14 135.00 134.92 3cf5 s PRO 38 Ca 0.47 0.36 -0.01 0.00 0.04 0.00 0.00 61.00 61.86 3cf5 s PRO 38 Cb -0.09 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 3cf5 s PRO 38 CO 0.31 -0.07 0.07 0.21 0.04 0.00 0.00 177.00 177.56 3cf5 s LYS 39 N 1.37 3.06 -0.06 4.56 2.47 -1.25 -4.76 119.74 125.13 3cf5 s LYS 39 Ca 0.23 -0.46 0.04 0.00 -1.56 0.00 0.00 55.97 54.22 3cf5 s LYS 39 Cb -0.15 -2.86 -0.00 0.00 -1.46 0.00 0.00 37.83 33.36 3cf5 s LYS 39 CO 0.09 0.66 -0.20 -0.08 0.16 0.00 0.00 175.35 175.99 3cf5 s THR 40 N -1.13 1.66 1.35 3.43 -1.32 -1.26 -4.75 115.64 113.62 3cf5 s THR 40 Ca 0.21 -0.83 -0.19 0.00 -1.21 0.00 0.00 61.69 59.67 3cf5 s THR 40 Cb -0.12 -1.43 0.35 0.00 -1.51 0.00 0.00 72.50 69.79 3cf5 s THR 40 CO 0.11 0.47 0.95 -0.83 -2.21 0.00 0.00 174.62 173.11 3cf5 s GLY 41 N 0.12 1.45 0.00 6.08 0.00 -1.26 -5.01 107.32 108.69 3cf5 s GLY 41 Ca -0.08 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.10 3cf5 s GLY 41 CO 0.04 0.38 0.00 0.61 0.00 0.00 0.00 173.10 174.12 3cf5 n GLY 42 N 1.42 3.10 2.19 0.20 0.00 -1.26 -5.09 105.19 105.75 3cf5 n GLY 42 Ca 0.08 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 3cf5 n GLY 42 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3cf5 n ARG 43 N 0.00 3.28 -3.65 1.61 0.00 -1.26 -5.03 116.66 111.61 3cf5 n ARG 43 Ca 0.00 -4.08 -0.04 0.00 -0.00 0.00 0.00 57.85 53.73 3cf5 n ARG 43 Cb 0.00 -2.16 -0.07 0.00 -0.00 0.00 0.00 32.46 30.23 3cf5 n ARG 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3cf5 s ASN 44 N -3.62 -0.21 0.56 2.89 6.03 -1.26 -3.65 114.94 115.68 3cf5 s ASN 44 Ca 0.47 0.38 0.00 0.00 -1.03 0.00 0.00 52.86 52.68 3cf5 s ASN 44 Cb 0.40 0.52 0.00 0.00 -3.03 0.00 0.00 41.25 39.14 3cf5 s ASN 44 CO 0.01 -0.06 0.00 -0.46 -2.03 0.00 0.00 177.10 174.56 3cf5 n ASN 45 N 2.10 -1.11 -0.01 3.54 6.94 -1.24 -4.91 115.26 120.58 3cf5 n ASN 45 Ca -0.12 -0.01 -0.03 0.00 -0.02 0.00 0.00 54.58 54.40 3cf5 n ASN 45 Cb 0.57 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.96 3cf5 n ASN 45 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3cf5 h ARG 46 N 0.00 -0.12 0.00 -3.83 1.12 -2.03 -3.41 114.38 106.11 3cf5 h ARG 46 Ca 0.00 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.88 3cf5 h ARG 46 Cb 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 29.97 29.99 3cf5 h ARG 46 CO 0.00 -0.08 0.00 0.41 -3.11 0.00 0.00 179.97 177.19 3cf5 n GLY 47 N -1.09 -3.14 0.00 2.80 0.00 -1.26 -5.02 105.19 97.47 3cf5 n GLY 47 Ca -0.01 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.55 3cf5 n GLY 47 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3cf5 n ARG 48 N 0.00 0.70 -2.26 1.61 0.00 -1.26 -5.02 116.66 110.42 3cf5 n ARG 48 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.44 3cf5 n ARG 48 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 32.46 32.43 3cf5 n ARG 48 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3cf5 s ILE 49 N -0.04 3.24 0.00 8.89 2.07 -1.26 -3.64 121.20 130.45 3cf5 s ILE 49 Ca 0.00 1.08 0.00 0.00 -1.41 0.00 0.00 60.65 60.32 3cf5 s ILE 49 Cb 0.00 -3.69 0.00 0.00 0.13 0.00 0.00 42.46 38.90 3cf5 s ILE 49 CO 0.00 0.19 0.00 0.41 -1.91 0.00 0.00 174.94 173.63 3cf5 n THR 50 N 2.16 0.00 -2.93 4.00 -1.04 -1.24 -4.91 114.28 110.32 3cf5 n THR 50 Ca 0.04 0.23 -0.44 0.00 -2.04 0.00 0.00 64.05 61.85 3cf5 n THR 50 Cb 0.43 -1.18 -0.04 0.00 -1.82 0.00 0.00 70.33 67.72 3cf5 n THR 50 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3cf5 s SER 51 N -3.02 6.23 0.69 8.00 0.15 -1.26 -5.02 113.70 119.47 3cf5 s SER 51 Ca 0.00 -1.23 -0.15 0.00 0.70 0.00 0.00 55.95 55.27 3cf5 s SER 51 Cb 0.00 -2.39 -0.13 0.00 -1.71 0.00 0.00 66.02 61.79 3cf5 s SER 51 CO 0.00 -1.32 -0.47 0.54 1.20 0.00 0.00 173.24 173.19 3cf5 n ARG 52 N 7.24 0.00 0.00 5.44 1.74 -1.26 -4.62 116.66 125.20 3cf5 n ARG 52 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3cf5 n ARG 52 Cb 0.45 -0.86 0.00 0.00 -1.02 0.00 0.00 32.46 31.03 3cf5 n ARG 52 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3cf5 n PHE 53 N -1.82 0.00 -3.07 -1.55 3.72 -1.26 -4.96 117.46 108.53 3cf5 n PHE 53 Ca 0.02 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.31 3cf5 n PHE 53 Cb 0.45 0.07 0.01 0.00 -0.94 0.00 0.00 39.48 39.07 3cf5 n PHE 53 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 3cf5 n ILE 54 N 0.00 -6.85 0.00 4.37 0.13 -1.26 -4.84 119.36 110.91 3cf5 n ILE 54 Ca 0.00 0.85 0.00 0.00 -1.10 0.00 0.00 62.75 62.50 3cf5 n ILE 54 Cb 0.00 -4.99 0.00 0.00 -0.84 0.00 0.00 39.64 33.81 3cf5 n ILE 54 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3cf5 n GLY 55 N 0.52 0.16 0.00 4.50 0.00 -1.26 -4.65 105.19 104.46 3cf5 n GLY 55 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3cf5 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf5 n GLY 56 N 0.01 -2.14 0.00 -0.02 0.00 -1.26 -4.73 105.19 97.04 3cf5 n GLY 56 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3cf5 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf5 n GLY 57 N 0.00 -0.55 0.00 -0.02 0.00 -1.26 -4.76 105.19 98.61 3cf5 n GLY 57 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.21 3cf5 n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3cf5 n HIS 58 N 5.22 0.00 0.00 1.61 -0.00 -1.26 -4.54 115.22 116.25 3cf5 n HIS 58 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3cf5 n HIS 58 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 3cf5 n HIS 58 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 3cf5 n LYS 59 N -0.91 0.00 -3.60 1.57 3.00 -1.26 -5.15 118.16 111.81 3cf5 n LYS 59 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.09 3cf5 n LYS 59 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.02 3cf5 n LYS 59 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 3cf5 s ARG 60 N -0.19 3.41 0.04 1.64 1.70 -1.26 -5.10 118.95 119.19 3cf5 s ARG 60 Ca 0.00 -0.57 0.09 0.00 -0.47 0.00 0.00 55.73 54.78 3cf5 s ARG 60 Cb 0.00 -2.76 -0.03 0.00 -0.57 0.00 0.00 34.95 31.59 3cf5 s ARG 60 CO 0.00 0.23 -0.26 -0.51 -1.08 0.00 0.00 175.30 173.68 3cf5 s LEU 61 N -4.18 2.16 0.16 -1.89 1.43 -1.26 -3.89 118.68 111.20 3cf5 s LEU 61 Ca 0.38 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 3cf5 s LEU 61 Cb -0.09 -1.28 -0.07 0.00 0.03 0.00 0.00 46.19 44.78 3cf5 s LEU 61 CO 0.33 0.26 1.07 -0.47 0.23 0.00 0.00 176.35 177.77 3cf5 s TYR 62 N -0.80 3.64 -0.31 0.29 5.04 0.80 -4.86 117.35 121.15 3cf5 s TYR 62 Ca 0.12 1.64 0.02 0.00 -2.44 0.00 0.00 57.07 56.40 3cf5 s TYR 62 Cb -0.10 -3.23 0.09 0.00 0.35 0.00 0.00 41.96 39.08 3cf5 s TYR 62 CO 0.02 -0.43 0.04 1.03 -1.34 0.00 0.00 175.55 174.87 3cf5 s ARG 63 N -0.22 1.34 -0.28 4.97 0.52 -1.26 -0.20 118.95 123.83 3cf5 s ARG 63 Ca 0.49 -1.53 -0.37 0.00 -0.52 0.00 0.00 55.73 53.80 3cf5 s ARG 63 Cb -0.28 -2.79 -0.13 0.00 0.52 0.00 0.00 34.95 32.26 3cf5 s ARG 63 CO 0.33 -0.89 1.94 -0.89 0.02 0.00 0.00 175.30 175.82 3cf5 n ILE 64 N 4.47 0.31 -4.01 1.52 5.41 -1.26 -4.94 119.36 120.86 3cf5 n ILE 64 Ca -0.01 -0.13 -0.34 0.00 1.00 0.00 0.00 62.75 63.27 3cf5 n ILE 64 Cb 0.42 -1.47 -0.15 0.00 -0.71 0.00 0.00 39.64 37.73 3cf5 n ILE 64 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3cf5 s ILE 65 N 5.07 2.65 0.06 1.39 1.01 -1.26 -4.24 121.20 125.89 3cf5 s ILE 65 Ca 1.02 -0.97 -0.35 0.00 0.00 0.00 0.00 60.65 60.35 3cf5 s ILE 65 Cb -0.94 -2.28 -0.14 0.00 0.01 0.00 0.00 42.46 39.11 3cf5 s ILE 65 CO 0.57 0.31 1.60 -0.67 0.00 0.00 0.00 174.94 176.76 3cf5 n ASP 66 N 4.65 2.79 0.00 3.58 -0.08 -0.96 -4.85 116.55 121.68 3cf5 n ASP 66 Ca -0.18 1.07 0.00 0.00 -1.51 0.00 0.00 54.79 54.17 3cf5 n ASP 66 Cb 0.48 -1.34 0.00 0.00 2.34 0.00 0.00 41.12 42.60 3cf5 n ASP 66 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3cf5 n PHE 67 N 4.04 0.00 0.00 -0.67 0.99 -1.26 -4.57 117.46 115.99 3cf5 n PHE 67 Ca 0.19 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.52 3cf5 n PHE 67 Cb 0.25 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 38.64 3cf5 n PHE 67 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.76 178.33 3cf5 h LYS 68 N 0.00 -0.07 -5.91 -1.08 -0.00 -1.86 -0.84 116.57 106.82 3cf5 h LYS 68 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 60.65 60.28 3cf5 h LYS 68 Cb 0.64 0.02 0.11 0.00 -0.00 0.00 0.00 32.23 33.00 3cf5 h LYS 68 CO 0.00 0.47 -0.85 -2.13 -0.00 0.00 0.00 179.45 176.94 3cf5 n ARG 69 N -4.85 -3.91 0.00 0.07 0.63 -1.26 -4.82 116.66 102.52 3cf5 n ARG 69 Ca -0.09 0.68 0.00 0.00 -0.92 0.00 0.00 57.85 57.52 3cf5 n ARG 69 Cb 0.29 -5.23 0.00 0.00 0.45 0.00 0.00 32.46 27.96 3cf5 n ARG 69 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3cf5 n ARG 70 N -4.00 1.49 0.00 -0.14 1.74 -1.26 -4.49 116.66 110.00 3cf5 n ARG 70 Ca -0.21 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 56.88 3cf5 n ARG 70 Cb 0.65 -0.98 0.08 0.00 -1.02 0.00 0.00 32.46 31.18 3cf5 n ARG 70 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3cf5 n ASP 71 N -2.27 0.00 -0.16 0.55 3.85 -1.26 -0.76 116.55 116.50 3cf5 n ASP 71 Ca 0.00 -0.36 0.01 0.00 -0.71 0.00 0.00 54.79 53.73 3cf5 n ASP 71 Cb 0.48 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.26 3cf5 n ASP 71 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3cf5 n LYS 72 N -0.69 0.39 -2.01 0.11 4.76 -1.26 -5.08 118.16 114.38 3cf5 n LYS 72 Ca 0.02 -0.89 -0.42 0.00 -2.87 0.00 0.00 58.31 54.15 3cf5 n LYS 72 Cb 0.01 -0.62 -0.03 0.00 -1.84 0.00 0.00 35.03 32.56 3cf5 n LYS 72 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3cf5 s SER 73 N -0.60 6.66 0.00 4.39 1.04 0.06 -2.42 113.70 122.83 3cf5 s SER 73 Ca 0.02 2.56 0.00 0.00 0.48 0.00 0.00 55.95 59.01 3cf5 s SER 73 Cb 0.02 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3cf5 s SER 73 CO 0.00 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.08 3cf5 n GLY 74 N 3.28 0.93 3.21 7.32 0.00 0.00 -4.79 105.19 115.15 3cf5 n GLY 74 Ca 0.11 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 3cf5 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cf5 s VAL 75 N -2.00 1.85 0.57 1.61 1.01 -1.02 -4.98 120.40 117.44 3cf5 s VAL 75 Ca 0.00 -0.94 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 3cf5 s VAL 75 Cb 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 3cf5 s VAL 75 CO 0.00 0.52 0.88 0.20 0.00 0.00 0.00 175.10 176.70 3cf5 s ASN 76 N 0.04 5.81 0.14 3.32 0.01 -1.26 -3.88 114.94 119.13 3cf5 s ASN 76 Ca -0.07 0.83 -0.23 0.00 -0.71 0.00 0.00 52.86 52.68 3cf5 s ASN 76 Cb -0.14 -1.91 0.07 0.00 0.41 0.00 0.00 41.25 39.67 3cf5 s ASN 76 CO 0.04 -0.93 0.58 0.00 -1.51 0.00 0.00 177.10 175.29 3cf5 s ALA 77 N -2.95 -1.53 -0.06 0.60 0.00 0.11 -2.69 121.76 115.23 3cf5 s ALA 77 Ca 0.52 0.47 0.03 0.00 0.00 0.00 0.00 51.96 52.99 3cf5 s ALA 77 Cb -0.11 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 3cf5 s ALA 77 CO 0.46 -0.73 -0.15 0.15 0.00 0.00 0.00 175.76 175.49 3cf5 s LYS 78 N -3.62 2.66 -1.14 0.00 1.02 -0.98 -0.46 119.74 117.22 3cf5 s LYS 78 Ca 0.01 -0.70 -0.23 0.00 0.02 0.00 0.00 55.97 55.06 3cf5 s LYS 78 Cb -0.01 -2.41 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 3cf5 s LYS 78 CO -0.12 0.54 1.95 0.08 -0.92 0.00 0.00 175.35 176.89 3cf5 s VAL 79 N -0.52 3.50 0.49 3.17 1.01 -1.23 -1.57 120.40 125.25 3cf5 s VAL 79 Ca 0.07 -0.80 0.25 0.00 0.00 0.00 0.00 61.98 61.50 3cf5 s VAL 79 Cb -0.12 -4.46 0.44 0.00 0.00 0.00 0.00 36.38 32.24 3cf5 s VAL 79 CO 0.01 -0.92 1.88 0.00 0.00 0.00 0.00 175.10 176.08 3cf5 h ALA 80 N 10.04 2.56 0.00 5.51 0.00 -1.90 -2.96 119.26 132.51 3cf5 h ALA 80 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3cf5 h ALA 80 Cb 0.95 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3cf5 h ALA 80 CO 1.21 -0.83 0.00 0.00 0.00 0.00 0.00 179.25 179.63 3cf5 n ALA 81 N -2.63 0.00 -4.09 0.00 0.00 -1.26 -4.91 120.51 107.62 3cf5 n ALA 81 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.30 3cf5 n ALA 81 Cb 0.84 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 20.13 3cf5 n ALA 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3cf5 s ILE 82 N -2.00 1.95 -0.07 0.00 1.01 -1.26 -1.22 121.20 119.62 3cf5 s ILE 82 Ca 0.00 -0.95 -0.04 0.00 0.00 0.00 0.00 60.65 59.66 3cf5 s ILE 82 Cb 0.00 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 3cf5 s ILE 82 CO 0.00 0.45 0.12 -1.61 0.00 0.00 0.00 174.94 173.90 3cf5 s GLU 83 N 1.32 3.29 -0.88 2.79 2.02 -1.06 -4.84 118.70 121.35 3cf5 s GLU 83 Ca 0.03 -0.29 -0.18 0.00 0.02 0.00 0.00 54.97 54.56 3cf5 s GLU 83 Cb -0.14 -3.04 0.15 0.00 0.10 0.00 0.00 34.13 31.20 3cf5 s GLU 83 CO -0.12 0.72 1.01 -0.47 0.02 0.00 0.00 175.26 176.43 3cf5 s TYR 84 N -1.11 3.24 0.18 1.61 6.14 -1.26 -2.67 117.35 123.49 3cf5 s TYR 84 Ca 0.19 -1.47 0.02 0.00 0.64 0.00 0.00 57.07 56.45 3cf5 s TYR 84 Cb -0.12 -4.16 -0.04 0.00 0.42 0.00 0.00 41.96 38.06 3cf5 s TYR 84 CO 0.09 -1.37 0.33 -0.51 0.64 0.00 0.00 175.55 174.73 3cf5 s ASP 85 N 3.30 6.35 0.98 4.32 1.01 -1.26 -5.10 116.67 126.26 3cf5 s ASP 85 Ca 0.28 0.22 -0.14 0.00 0.71 0.00 0.00 52.55 53.62 3cf5 s ASP 85 Cb -0.08 -1.93 0.19 0.00 1.01 0.00 0.00 42.92 42.12 3cf5 s ASP 85 CO -0.08 -0.01 1.15 -0.81 0.21 0.00 0.00 175.17 175.63 3cf5 n PRO 86 N -0.77 -1.06 -3.71 8.23 -0.04 -1.26 -4.41 135.00 131.98 3cf5 n PRO 86 Ca -0.07 -1.85 -0.25 0.00 -0.04 0.00 0.00 63.50 61.29 3cf5 n PRO 86 Cb 0.54 -1.16 0.06 0.00 -0.04 0.00 0.00 33.50 32.91 3cf5 n PRO 86 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3cf5 n ASN 87 N -3.69 -5.06 0.00 3.54 3.02 -1.26 -4.76 115.26 107.05 3cf5 n ASN 87 Ca 0.15 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 54.04 3cf5 n ASN 87 Cb 0.51 -4.56 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 3cf5 n ASN 87 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3cf5 n ARG 88 N -4.77 0.00 -3.52 3.52 0.63 -1.26 -5.00 116.66 106.26 3cf5 n ARG 88 Ca -0.03 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 56.70 3cf5 n ARG 88 Cb 0.57 -0.00 0.08 0.00 0.45 0.00 0.00 32.46 33.56 3cf5 n ARG 88 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3cf5 n SER 89 N -1.73 -3.96 0.00 6.15 2.88 -1.26 -4.15 113.62 111.54 3cf5 n SER 89 Ca 0.00 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 3cf5 n SER 89 Cb 0.00 -5.05 0.00 0.00 -0.75 0.00 0.00 64.21 58.41 3cf5 n SER 89 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3cf5 n ALA 90 N -4.53 0.00 -2.40 -1.46 0.00 -1.26 -2.58 120.51 108.28 3cf5 n ALA 90 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.08 3cf5 n ALA 90 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 3cf5 n ALA 90 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3cf5 s ARG 91 N 1.07 1.64 -0.03 0.00 0.52 -1.26 -4.67 118.95 116.22 3cf5 s ARG 91 Ca 0.00 -1.93 -0.01 0.00 -0.52 0.00 0.00 55.73 53.27 3cf5 s ARG 91 Cb 0.00 -0.46 0.03 0.00 0.52 0.00 0.00 34.95 35.04 3cf5 s ARG 91 CO 0.00 -0.35 0.04 0.42 0.02 0.00 0.00 175.30 175.43 3cf5 s ILE 92 N -3.47 -0.04 -0.21 1.52 1.01 -1.09 -2.85 121.20 116.07 3cf5 s ILE 92 Ca 0.34 0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.99 3cf5 s ILE 92 Cb 0.06 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.39 3cf5 s ILE 92 CO 0.15 0.14 0.99 0.00 0.00 0.00 0.00 174.94 176.22 3cf5 s ALA 93 N 1.55 3.64 -0.89 9.38 0.00 0.77 -2.55 121.76 133.65 3cf5 s ALA 93 Ca -0.03 0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 3cf5 s ALA 93 Cb -0.13 -3.47 0.25 0.00 0.00 0.00 0.00 23.12 19.77 3cf5 s ALA 93 CO -0.03 -0.95 2.18 -0.11 0.00 0.00 0.00 175.76 176.85 3cf5 n LEU 94 N 6.03 7.35 -4.66 0.00 7.94 -0.35 0.11 117.00 133.41 3cf5 n LEU 94 Ca 0.10 -4.85 -0.41 0.00 -1.11 0.00 0.00 56.01 49.74 3cf5 n LEU 94 Cb 0.47 -1.18 0.01 0.00 0.53 0.00 0.00 43.42 43.25 3cf5 n LEU 94 CO 0.51 1.88 0.75 0.18 -1.11 0.00 0.00 177.39 179.60 3cf5 n LEU 95 N 0.22 3.42 -4.06 -1.96 4.77 -1.20 -3.46 117.00 114.72 3cf5 n LEU 95 Ca 0.52 1.07 -0.32 0.00 -0.03 0.00 0.00 56.01 57.26 3cf5 n LEU 95 Cb 0.31 -1.43 -0.16 0.00 -2.33 0.00 0.00 43.42 39.81 3cf5 n LEU 95 CO 0.50 -1.02 -0.48 -2.28 -1.33 0.00 0.00 177.39 172.78 3cf5 s HIS 96 N -1.23 2.86 0.13 -1.77 5.65 -0.61 -2.43 115.29 117.89 3cf5 s HIS 96 Ca 0.62 -1.90 -0.29 0.00 0.25 0.00 0.00 55.06 53.75 3cf5 s HIS 96 Cb -0.53 -1.84 -0.06 0.00 -1.18 0.00 0.00 32.58 28.97 3cf5 s HIS 96 CO 0.57 -0.82 0.92 0.71 -0.65 0.00 0.00 174.74 175.48 3cf5 s TYR 97 N 1.25 3.84 0.63 3.88 2.02 -1.02 -2.32 117.35 125.63 3cf5 s TYR 97 Ca -0.02 1.77 0.19 0.00 -0.37 0.00 0.00 57.07 58.63 3cf5 s TYR 97 Cb -0.17 -3.00 0.84 0.00 -0.40 0.00 0.00 41.96 39.24 3cf5 s TYR 97 CO -0.08 0.28 1.42 0.00 -1.57 0.00 0.00 175.55 175.59 3cf5 h ALA 98 N 5.27 2.19 -0.99 3.71 0.00 -1.83 0.84 119.26 128.44 3cf5 h ALA 98 Ca -0.44 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 54.61 3cf5 h ALA 98 Cb 1.21 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.93 3cf5 h ALA 98 CO 0.71 -1.04 0.62 -0.44 0.00 0.00 0.00 179.25 179.09 3cf5 h ASP 99 N 0.00 0.83 0.00 0.00 3.32 -1.91 -3.45 116.42 115.21 3cf5 h ASP 99 Ca 0.18 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3cf5 h ASP 99 Cb 1.88 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.33 3cf5 h ASP 99 CO -0.00 0.38 0.00 0.61 -1.72 0.00 0.00 179.24 178.51 3cf5 n GLY 100 N -1.35 1.33 3.88 2.75 0.00 0.29 -5.11 105.19 106.97 3cf5 n GLY 100 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 3cf5 n GLY 100 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cf5 s GLU 101 N 0.00 3.72 0.24 1.61 2.12 -1.25 -4.89 118.70 120.25 3cf5 s GLU 101 Ca 0.00 0.54 0.09 0.00 0.36 0.00 0.00 54.97 55.95 3cf5 s GLU 101 Cb 0.00 -2.29 -0.04 0.00 0.26 0.00 0.00 34.13 32.06 3cf5 s GLU 101 CO 0.00 -0.20 0.03 0.15 -0.54 0.00 0.00 175.26 174.69 3cf5 s LYS 102 N -4.32 2.42 -0.27 4.30 1.02 -1.26 -2.44 119.74 119.19 3cf5 s LYS 102 Ca 0.52 -1.27 -0.10 0.00 0.02 0.00 0.00 55.97 55.14 3cf5 s LYS 102 Cb -0.10 -2.28 0.11 0.00 -0.52 0.00 0.00 37.83 35.04 3cf5 s LYS 102 CO 0.38 0.40 0.60 1.03 -0.92 0.00 0.00 175.35 176.84 3cf5 s ARG 103 N -3.50 0.54 -0.17 1.68 0.52 -1.02 -5.00 118.95 112.01 3cf5 s ARG 103 Ca 0.30 1.30 -0.29 0.00 -0.52 0.00 0.00 55.73 56.52 3cf5 s ARG 103 Cb -0.07 0.59 -0.01 0.00 0.52 0.00 0.00 34.95 35.98 3cf5 s ARG 103 CO 0.20 -0.20 1.25 0.71 0.02 0.00 0.00 175.30 177.28 3cf5 s TYR 104 N 2.54 2.88 -0.01 -0.53 1.51 -1.26 -3.28 117.35 119.19 3cf5 s TYR 104 Ca -0.06 1.04 0.04 0.00 -1.01 0.00 0.00 57.07 57.07 3cf5 s TYR 104 Cb -0.11 -3.49 -0.03 0.00 -0.11 0.00 0.00 41.96 38.22 3cf5 s TYR 104 CO -0.18 -1.62 -0.12 0.42 -1.11 0.00 0.00 175.55 172.94 3cf5 s ILE 105 N 3.49 3.25 0.71 2.71 1.01 0.29 -2.28 121.20 130.39 3cf5 s ILE 105 Ca 0.54 -0.82 -0.16 0.00 0.00 0.00 0.00 60.65 60.21 3cf5 s ILE 105 Cb -0.21 -2.35 -0.06 0.00 0.01 0.00 0.00 42.46 39.86 3cf5 s ILE 105 CO 0.14 0.47 0.42 0.18 0.00 0.00 0.00 174.94 176.15 3cf5 n LEU 106 N 1.89 0.18 -4.20 2.97 4.77 -1.26 0.27 117.00 121.63 3cf5 n LEU 106 Ca -0.16 0.59 -0.35 0.00 -0.03 0.00 0.00 56.01 56.05 3cf5 n LEU 106 Cb 0.52 -1.16 -0.14 0.00 -2.33 0.00 0.00 43.42 40.31 3cf5 n LEU 106 CO 0.27 -3.36 -0.36 0.00 -1.33 0.00 0.00 177.39 172.61 3cf5 s ALA 107 N -1.91 2.81 0.50 -1.18 0.00 -1.13 -4.19 121.76 116.67 3cf5 s ALA 107 Ca 0.64 -1.66 -0.18 0.00 0.00 0.00 0.00 51.96 50.75 3cf5 s ALA 107 Cb -0.36 -1.90 -0.08 0.00 0.00 0.00 0.00 23.12 20.78 3cf5 s ALA 107 CO 0.59 -1.13 1.01 -1.25 0.00 0.00 0.00 175.76 174.98 3cf5 s PRO 108 N 1.30 3.84 -0.83 0.00 0.04 -1.26 -4.37 135.00 133.72 3cf5 s PRO 108 Ca -0.03 1.16 -0.24 0.00 0.04 0.00 0.00 61.00 61.93 3cf5 s PRO 108 Cb -0.19 -2.11 -0.17 0.00 0.04 0.00 0.00 34.50 32.07 3cf5 s PRO 108 CO -0.01 -0.38 2.36 -1.91 0.04 0.00 0.00 177.00 177.10 3cf5 n GLU 109 N -1.28 0.46 0.00 4.56 4.07 0.59 -3.00 120.64 126.04 3cf5 n GLU 109 Ca 0.08 -0.81 0.00 0.00 -0.06 0.00 0.00 57.16 56.36 3cf5 n GLU 109 Cb 0.53 -3.40 0.00 0.00 -0.06 0.00 0.00 31.44 28.51 3cf5 n GLU 109 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3cf5 n GLY 110 N 6.60 1.39 3.61 8.31 0.00 -1.26 -4.78 105.19 119.07 3cf5 n GLY 110 Ca 0.48 -0.05 -0.46 0.00 0.00 0.00 0.00 46.02 46.00 3cf5 n GLY 110 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cf5 n LEU 111 N 0.00 2.17 -4.50 0.99 4.77 -1.16 -5.00 117.00 114.27 3cf5 n LEU 111 Ca 0.00 1.16 -0.25 0.00 -0.03 0.00 0.00 56.01 56.90 3cf5 n LEU 111 Cb 0.00 -1.32 -0.10 0.00 -2.33 0.00 0.00 43.42 39.67 3cf5 n LEU 111 CO 0.00 -1.08 -0.41 0.42 -1.33 0.00 0.00 177.39 174.99 3cf5 s THR 112 N -0.56 2.22 0.16 -5.08 -4.23 -1.26 -5.00 115.64 101.90 3cf5 s THR 112 Ca 0.65 -2.25 -0.31 0.00 -1.18 0.00 0.00 61.69 58.60 3cf5 s THR 112 Cb -0.72 -2.50 -0.09 0.00 1.34 0.00 0.00 72.50 70.52 3cf5 s THR 112 CO 0.55 -0.28 1.43 -0.69 -0.54 0.00 0.00 174.62 175.09 3cf5 s VAL 113 N -2.64 3.00 0.00 2.29 1.01 -1.26 -2.77 120.40 120.02 3cf5 s VAL 113 Ca 0.31 0.75 0.00 0.00 0.00 0.00 0.00 61.98 63.04 3cf5 s VAL 113 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.90 3cf5 s VAL 113 CO 0.15 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.94 3cf5 n GLY 114 N 3.16 2.55 3.33 4.51 0.00 -1.12 -5.00 105.19 112.63 3cf5 n GLY 114 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3cf5 n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf5 s ALA 115 N -2.26 -0.54 -0.08 4.61 0.00 -1.12 -4.78 121.76 117.59 3cf5 s ALA 115 Ca 0.00 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.10 3cf5 s ALA 115 Cb 0.00 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 3cf5 s ALA 115 CO 0.00 -4.52 -0.23 0.95 0.00 0.00 0.00 175.76 171.97 3cf5 s THR 116 N -2.38 2.21 -0.01 0.00 -4.23 -1.26 -3.50 115.64 106.48 3cf5 s THR 116 Ca 0.69 -0.99 0.04 0.00 -1.18 0.00 0.00 61.69 60.25 3cf5 s THR 116 Cb -0.11 -1.84 -0.01 0.00 1.34 0.00 0.00 72.50 71.88 3cf5 s THR 116 CO 0.57 0.56 -0.12 -0.69 -0.54 0.00 0.00 174.62 174.40 3cf5 s VAL 117 N 0.09 0.98 0.03 2.29 1.01 0.40 -4.83 120.40 120.37 3cf5 s VAL 117 Ca -0.11 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3cf5 s VAL 117 Cb -0.16 -0.82 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 3cf5 s VAL 117 CO 0.06 0.26 0.04 0.21 0.00 0.00 0.00 175.10 175.67 3cf5 s ASN 118 N -0.34 0.25 0.50 3.32 2.47 -1.26 0.05 114.94 119.93 3cf5 s ASN 118 Ca 0.05 -0.60 0.01 0.00 0.42 0.00 0.00 52.86 52.73 3cf5 s ASN 118 Cb -0.05 0.19 -0.00 0.00 -1.45 0.00 0.00 41.25 39.93 3cf5 s ASN 118 CO -0.00 -0.47 0.05 0.00 -3.72 0.00 0.00 177.10 172.95 3cf5 n ALA 119 N 0.88 0.49 0.00 1.71 0.00 -1.25 -1.56 120.51 120.78 3cf5 n ALA 119 Ca -0.19 -2.31 0.00 0.00 0.00 0.00 0.00 53.44 50.94 3cf5 n ALA 119 Cb 0.58 1.34 0.00 0.00 0.00 0.00 0.00 19.45 21.37 3cf5 n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cf5 n GLY 120 N -1.18 -0.29 0.32 0.00 0.00 -0.77 -0.82 105.19 102.44 3cf5 n GLY 120 Ca -0.17 -1.52 0.17 0.00 0.00 0.00 0.00 46.02 44.49 3cf5 n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cf5 h PRO 121 N 0.00 0.15 -5.84 1.61 0.13 -1.96 -3.28 132.00 122.79 3cf5 h PRO 121 Ca 0.00 -0.01 -0.39 0.00 -0.87 0.00 0.00 66.00 64.74 3cf5 h PRO 121 Cb 0.00 -0.03 -0.06 0.00 0.13 0.00 0.00 31.00 31.04 3cf5 h PRO 121 CO 0.00 0.10 0.96 -1.21 -0.23 0.00 0.00 178.00 177.62 3cf5 s GLU 122 N -5.87 2.81 -0.30 0.86 8.01 -1.26 -4.83 118.70 118.12 3cf5 s GLU 122 Ca -0.12 -0.40 -0.05 0.00 0.01 0.00 0.00 54.97 54.41 3cf5 s GLU 122 Cb 0.28 -5.05 0.17 0.00 -4.31 0.00 0.00 34.13 25.22 3cf5 s GLU 122 CO 0.78 -3.03 0.67 0.00 0.01 0.00 0.00 175.26 173.69 3cf5 s ALA 123 N 8.73 -2.30 -0.59 5.21 0.00 -1.24 -4.86 121.76 126.72 3cf5 s ALA 123 Ca 0.63 1.99 -0.30 0.00 0.00 0.00 0.00 51.96 54.28 3cf5 s ALA 123 Cb -0.06 -2.06 -0.13 0.00 0.00 0.00 0.00 23.12 20.87 3cf5 s ALA 123 CO -0.01 -1.19 2.43 0.39 0.00 0.00 0.00 175.76 177.38 3cf5 n GLU 124 N 5.42 0.75 -1.35 0.00 1.02 -1.26 -4.67 120.64 120.55 3cf5 n GLU 124 Ca -0.05 0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 57.06 3cf5 n GLU 124 Cb 0.51 -2.56 -0.12 0.00 -0.02 0.00 0.00 31.44 29.25 3cf5 n GLU 124 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 3cf5 n PRO 125 N 8.60 0.08 -4.23 3.49 -0.02 -1.26 -4.82 135.00 136.85 3cf5 n PRO 125 Ca 0.47 -0.30 -0.13 0.00 -2.02 0.00 0.00 63.50 61.52 3cf5 n PRO 125 Cb 0.29 -1.68 -0.10 0.00 -0.02 0.00 0.00 33.50 31.99 3cf5 n PRO 125 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3cf5 s LYS 126 N 6.75 1.13 -0.29 -0.52 1.02 -1.26 -5.05 119.74 121.52 3cf5 s LYS 126 Ca 0.76 -1.57 -0.32 0.00 0.02 0.00 0.00 55.97 54.87 3cf5 s LYS 126 Cb -0.38 -0.08 -0.09 0.00 -0.52 0.00 0.00 37.83 36.77 3cf5 s LYS 126 CO 0.27 -0.22 2.21 1.28 -0.92 0.00 0.00 175.35 177.96 3cf5 n LEU 127 N -0.25 2.60 0.00 3.17 4.77 -1.26 -0.23 117.00 125.80 3cf5 n LEU 127 Ca -0.04 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3cf5 n LEU 127 Cb 0.64 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 3cf5 n LEU 127 CO 0.34 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.28 3cf5 n GLY 128 N 6.23 2.36 3.78 -0.72 0.00 -1.21 -4.87 105.19 110.76 3cf5 n GLY 128 Ca 0.37 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.02 3cf5 n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cf5 s ASN 129 N -1.63 6.84 -0.52 1.61 0.01 0.68 -4.28 114.94 117.65 3cf5 s ASN 129 Ca 0.00 2.06 0.02 0.00 -0.71 0.00 0.00 52.86 54.22 3cf5 s ASN 129 Cb 0.00 -2.59 0.13 0.00 0.41 0.00 0.00 41.25 39.20 3cf5 s ASN 129 CO 0.00 -0.43 0.28 0.00 -1.51 0.00 0.00 177.10 175.43 3cf5 s ALA 130 N -1.60 3.32 -0.02 0.60 0.00 -0.60 -1.49 121.76 121.97 3cf5 s ALA 130 Ca 0.56 -3.12 0.07 0.00 0.00 0.00 0.00 51.96 49.47 3cf5 s ALA 130 Cb -0.23 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 20.58 3cf5 s ALA 130 CO 0.29 -1.98 -0.24 -0.48 0.00 0.00 0.00 175.76 173.35 3cf5 s LEU 131 N 0.03 2.04 1.07 0.00 2.34 -0.75 -1.85 118.68 121.56 3cf5 s LEU 131 Ca 0.16 -0.44 -0.12 0.00 0.06 0.00 0.00 54.13 53.78 3cf5 s LEU 131 Cb -0.23 -1.25 0.23 0.00 -0.56 0.00 0.00 46.19 44.37 3cf5 s LEU 131 CO -0.02 0.29 1.05 -0.81 -1.06 0.00 0.00 176.35 175.79 3cf5 n PRO 132 N 2.57 -1.63 0.02 1.48 -0.04 -1.26 -1.98 135.00 134.15 3cf5 n PRO 132 Ca -0.16 -0.43 -0.11 0.00 -0.04 0.00 0.00 63.50 62.76 3cf5 n PRO 132 Cb 0.52 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.68 3cf5 n PRO 132 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3cf5 h LEU 133 N -2.36 -0.04 -0.92 1.53 3.38 -1.66 -2.68 115.31 112.56 3cf5 h LEU 133 Ca -0.54 0.02 0.22 0.00 0.09 0.00 0.00 57.88 57.67 3cf5 h LEU 133 Cb 1.31 0.03 -0.17 0.00 0.09 0.00 0.00 40.66 41.92 3cf5 h LEU 133 CO 0.45 -0.01 -0.06 0.08 0.09 0.00 0.00 178.44 178.99 3cf5 h ARG 134 N 0.01 0.03 -0.00 1.13 0.11 -1.88 1.93 114.38 115.71 3cf5 h ARG 134 Ca 0.03 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.11 3cf5 h ARG 134 Cb 0.04 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.11 3cf5 h ARG 134 CO -0.05 0.02 -0.03 1.19 0.10 0.00 0.00 179.97 181.20 3cf5 n PHE 135 N -5.49 0.00 -2.66 4.08 0.99 -1.13 -4.77 117.46 108.48 3cf5 n PHE 135 Ca 0.18 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.20 3cf5 n PHE 135 Cb 0.60 -0.37 -0.02 0.00 -1.00 0.00 0.00 39.48 38.69 3cf5 n PHE 135 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 3cf5 s VAL 136 N -2.76 4.69 0.41 -4.37 1.01 0.66 -4.98 120.40 115.06 3cf5 s VAL 136 Ca 0.22 2.01 -0.27 0.00 0.00 0.00 0.00 61.98 63.94 3cf5 s VAL 136 Cb 0.20 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.19 3cf5 s VAL 136 CO 0.50 -0.11 1.45 -2.84 0.00 0.00 0.00 175.10 174.10 3cf5 s PRO 137 N 2.77 3.89 0.60 2.72 0.02 -1.26 -4.95 135.00 138.78 3cf5 s PRO 137 Ca 0.46 2.48 -0.19 0.00 0.02 0.00 0.00 61.00 63.77 3cf5 s PRO 137 Cb -0.17 -2.80 -0.04 0.00 0.02 0.00 0.00 34.50 31.51 3cf5 s PRO 137 CO 0.11 -0.67 1.14 0.28 -0.33 0.00 0.00 177.00 177.52 3cf5 n VAL 138 N 0.12 4.12 0.00 3.83 0.31 -1.26 -1.66 118.33 123.80 3cf5 n VAL 138 Ca 0.03 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 3cf5 n VAL 138 Cb 0.41 -1.34 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 3cf5 n VAL 138 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3cf5 n GLY 139 N 1.08 2.36 3.66 2.92 0.00 -0.34 -4.96 105.19 109.91 3cf5 n GLY 139 Ca 0.14 -0.02 -0.57 0.00 0.00 0.00 0.00 46.02 45.57 3cf5 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf5 n ALA 140 N 0.00 -0.87 -2.57 4.61 0.00 -0.66 -4.44 120.51 116.58 3cf5 n ALA 140 Ca 0.00 0.46 -0.43 0.00 0.00 0.00 0.00 53.44 53.47 3cf5 n ALA 140 Cb 0.00 -2.10 -0.06 0.00 0.00 0.00 0.00 19.45 17.29 3cf5 n ALA 140 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3cf5 s VAL 141 N 2.16 4.74 0.38 0.00 1.01 -1.26 -2.17 120.40 125.26 3cf5 s VAL 141 Ca 0.94 0.13 0.04 0.00 0.00 0.00 0.00 61.98 63.09 3cf5 s VAL 141 Cb -1.09 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 30.96 3cf5 s VAL 141 CO 0.60 -0.71 0.07 0.68 0.00 0.00 0.00 175.10 175.74 3cf5 s VAL 142 N 3.03 1.12 0.17 2.92 -7.23 -0.57 -2.02 120.40 117.83 3cf5 s VAL 142 Ca 0.24 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 3cf5 s VAL 142 Cb -0.14 -2.61 -0.01 0.00 0.56 0.00 0.00 36.38 34.17 3cf5 s VAL 142 CO 0.19 0.00 0.12 0.00 -0.31 0.00 0.00 175.10 175.10 3cf5 n HIS 143 N -0.86 -0.28 0.00 2.82 1.44 -0.31 -0.99 115.22 117.05 3cf5 n HIS 143 Ca -0.06 -1.35 0.00 0.00 -2.01 0.00 0.00 57.72 54.31 3cf5 n HIS 143 Cb 0.66 0.11 0.00 0.00 0.12 0.00 0.00 29.99 30.88 3cf5 n HIS 143 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3cf5 n ALA 144 N -1.92 0.00 0.00 1.59 0.00 0.21 -0.89 120.51 119.50 3cf5 n ALA 144 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3cf5 n ALA 144 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 3cf5 n ALA 144 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3cf5 n LEU 145 N 0.00 0.00 0.00 0.00 7.94 -1.20 -1.35 117.00 122.38 3cf5 n LEU 145 Ca 0.00 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.72 3cf5 n LEU 145 Cb 0.00 0.00 0.12 0.00 0.53 0.00 0.00 43.42 44.07 3cf5 n LEU 145 CO 0.00 0.00 0.51 -0.62 -1.11 0.00 0.00 177.39 176.17 3cf5 n GLU 146 N 0.00 -0.55 0.00 1.96 1.02 -1.25 -1.55 120.64 120.28 3cf5 n GLU 146 Ca 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 57.16 55.66 3cf5 n GLU 146 Cb 0.00 -0.76 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 3cf5 n GLU 146 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3cf5 n LEU 147 N 0.00 0.25 -3.56 -4.62 4.77 -1.26 -4.81 117.00 107.78 3cf5 n LEU 147 Ca 0.11 -0.27 -0.14 0.00 -0.03 0.00 0.00 56.01 55.67 3cf5 n LEU 147 Cb 0.38 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 3cf5 n LEU 147 CO 0.27 0.06 0.57 -0.69 -1.33 0.00 0.00 177.39 176.28 3cf5 s VAL 148 N -0.04 0.00 -0.60 4.08 1.01 -1.26 -4.98 120.40 118.62 3cf5 s VAL 148 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 61.98 61.72 3cf5 s VAL 148 Cb 0.00 -1.00 -0.06 0.00 0.00 0.00 0.00 36.38 35.32 3cf5 s VAL 148 CO 0.00 0.00 2.16 -2.84 0.00 0.00 0.00 175.10 174.42 3cf5 s PRO 149 N -0.88 2.28 0.00 2.72 0.02 -1.26 -4.68 135.00 133.20 3cf5 s PRO 149 Ca -0.06 0.88 0.00 0.00 0.02 0.00 0.00 61.00 61.85 3cf5 s PRO 149 Cb -0.01 -4.57 0.00 0.00 0.02 0.00 0.00 34.50 29.94 3cf5 s PRO 149 CO 0.05 -3.19 0.00 0.41 -0.33 0.00 0.00 177.00 173.94 3cf5 n GLY 150 N 6.03 2.58 2.14 0.52 0.00 -1.26 -5.01 105.19 110.19 3cf5 n GLY 150 Ca 0.32 -2.05 -0.04 0.00 0.00 0.00 0.00 46.02 44.25 3cf5 n GLY 150 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3cf5 n LYS 151 N -0.30 -0.33 -0.87 1.61 3.00 -1.26 -4.84 118.16 115.17 3cf5 n LYS 151 Ca 0.00 0.59 0.12 0.00 -0.00 0.00 0.00 58.31 59.02 3cf5 n LYS 151 Cb 0.00 -4.23 -0.03 0.00 0.00 0.00 0.00 35.03 30.77 3cf5 n LYS 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3cf5 n GLY 152 N -2.40 -1.70 3.24 3.14 0.00 -1.26 -4.76 105.19 101.45 3cf5 n GLY 152 Ca -0.04 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.48 3cf5 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf5 n ALA 153 N -1.47 -4.20 -0.09 4.61 0.00 -0.32 -4.53 120.51 114.51 3cf5 n ALA 153 Ca 0.01 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.31 3cf5 n ALA 153 Cb 0.40 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.41 3cf5 n ALA 153 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3cf5 n GLN 154 N -1.00 0.00 -4.74 0.00 6.02 -0.46 -4.85 117.38 112.36 3cf5 n GLN 154 Ca 0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.75 3cf5 n GLN 154 Cb 0.62 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.72 3cf5 n GLN 154 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3cf5 s LEU 155 N 0.00 1.87 -0.43 1.08 1.43 -0.59 -4.88 118.68 117.16 3cf5 s LEU 155 Ca 0.00 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 3cf5 s LEU 155 Cb 0.00 -0.89 0.01 0.00 0.03 0.00 0.00 46.19 45.34 3cf5 s LEU 155 CO 0.00 0.12 0.48 0.00 0.23 0.00 0.00 176.35 177.18 3cf5 n ALA 156 N 3.25 -2.62 -1.37 4.21 0.00 -1.26 -2.62 120.51 120.10 3cf5 n ALA 156 Ca -0.19 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3cf5 n ALA 156 Cb 0.53 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 18.02 3cf5 n ALA 156 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3cf5 n ARG 157 N -0.96 0.00 -1.05 0.00 1.85 -1.26 -0.62 116.66 114.62 3cf5 n ARG 157 Ca 0.04 -0.25 0.00 0.00 -1.00 0.00 0.00 57.85 56.64 3cf5 n ARG 157 Cb 0.42 -0.32 0.00 0.00 -1.05 0.00 0.00 32.46 31.51 3cf5 n ARG 157 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 3cf5 n SER 158 N 0.00 0.55 -4.47 2.89 3.41 -1.26 -4.94 113.62 109.81 3cf5 n SER 158 Ca 0.00 -0.82 -0.37 0.00 -0.26 0.00 0.00 58.87 57.42 3cf5 n SER 158 Cb 0.45 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.24 3cf5 n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cf5 n ALA 159 N -3.00 0.44 -3.13 7.33 0.00 -1.06 -3.73 120.51 117.36 3cf5 n ALA 159 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 53.44 53.02 3cf5 n ALA 159 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.18 3cf5 n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cf5 n GLY 160 N 6.27 -0.79 3.55 0.00 0.00 -1.23 -4.90 105.19 108.09 3cf5 n GLY 160 Ca 0.66 0.24 -0.25 0.00 0.00 0.00 0.00 46.02 46.66 3cf5 n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cf5 s THR 161 N -1.20 1.39 -0.24 2.61 -4.23 -1.00 -4.84 115.64 108.12 3cf5 s THR 161 Ca 0.05 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.53 3cf5 s THR 161 Cb -0.01 -2.75 0.13 0.00 1.34 0.00 0.00 72.50 71.22 3cf5 s THR 161 CO 0.25 0.00 0.35 -0.44 -0.54 0.00 0.00 174.62 174.24 3cf5 s SER 162 N -3.62 0.48 -0.38 3.99 0.01 -1.26 -3.79 113.70 109.13 3cf5 s SER 162 Ca 0.31 0.08 -0.01 0.00 1.31 0.00 0.00 55.95 57.65 3cf5 s SER 162 Cb 0.08 0.98 0.10 0.00 0.21 0.00 0.00 66.02 67.39 3cf5 s SER 162 CO 0.15 -0.31 0.14 -0.69 0.41 0.00 0.00 173.24 172.94 3cf5 s VAL 163 N 2.50 2.97 0.21 3.43 1.01 -0.16 -4.16 120.40 126.19 3cf5 s VAL 163 Ca 0.11 -2.07 -0.01 0.00 0.00 0.00 0.00 61.98 60.01 3cf5 s VAL 163 Cb -0.15 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 3cf5 s VAL 163 CO -0.17 -0.61 0.40 0.00 0.00 0.00 0.00 175.10 174.73 3cf5 s GLN 164 N 1.08 3.53 0.09 2.72 1.03 -1.23 -1.51 119.66 125.38 3cf5 s GLN 164 Ca 0.08 -0.31 -0.29 0.00 0.04 0.00 0.00 55.36 54.88 3cf5 s GLN 164 Cb -0.21 -2.83 -0.06 0.00 0.03 0.00 0.00 33.01 29.94 3cf5 s GLN 164 CO -0.05 0.39 0.91 0.08 -2.54 0.00 0.00 175.29 174.08 3cf5 s VAL 165 N -1.88 4.57 -0.65 3.63 1.01 -0.92 -1.33 120.40 124.83 3cf5 s VAL 165 Ca 0.39 1.96 0.24 0.00 0.00 0.00 0.00 61.98 64.56 3cf5 s VAL 165 Cb -0.11 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 32.01 3cf5 s VAL 165 CO 0.29 0.33 1.25 0.00 0.00 0.00 0.00 175.10 176.97 3cf5 n GLN 166 N 2.82 0.28 0.00 2.72 1.13 -0.88 -1.19 117.38 122.25 3cf5 n GLN 166 Ca 0.01 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 3cf5 n GLN 166 Cb 0.49 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 29.19 3cf5 n GLN 166 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3cf5 n GLY 167 N 1.35 2.61 1.79 1.08 0.00 -1.26 -4.87 105.19 105.88 3cf5 n GLY 167 Ca 0.03 -0.97 -0.21 0.00 0.00 0.00 0.00 46.02 44.87 3cf5 n GLY 167 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3cf5 n LYS 168 N 0.27 0.00 0.00 1.61 4.81 -1.26 -4.28 118.16 119.31 3cf5 n LYS 168 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3cf5 n LYS 168 Cb 0.00 -0.57 0.00 0.00 0.02 0.00 0.00 35.03 34.48 3cf5 n LYS 168 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3cf5 n GLU 169 N 1.05 0.00 0.00 1.64 2.13 -0.22 -4.87 120.64 120.37 3cf5 n GLU 169 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 3cf5 n GLU 169 Cb 0.28 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.99 3cf5 n GLU 169 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3cf5 n SER 170 N 0.00 0.00 -0.05 4.31 2.88 -1.26 -4.84 113.62 114.65 3cf5 n SER 170 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 3cf5 n SER 170 Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 3cf5 n SER 170 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3cf5 n ASP 171 N -0.17 1.26 -4.88 -3.46 8.00 -1.26 -4.96 116.55 111.07 3cf5 n ASP 171 Ca 0.00 0.15 -0.30 0.00 0.71 0.00 0.00 54.79 55.35 3cf5 n ASP 171 Cb 0.00 -0.12 -0.01 0.00 -0.02 0.00 0.00 41.12 40.97 3cf5 n ASP 171 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3cf5 s TYR 172 N -2.55 3.56 -0.01 1.24 1.51 -1.26 -1.52 117.35 118.32 3cf5 s TYR 172 Ca -0.17 1.10 0.05 0.00 -1.01 0.00 0.00 57.07 57.04 3cf5 s TYR 172 Cb 0.07 -2.53 -0.01 0.00 -0.11 0.00 0.00 41.96 39.38 3cf5 s TYR 172 CO 0.76 -0.41 -0.15 0.08 -1.11 0.00 0.00 175.55 174.72 3cf5 s VAL 173 N -2.83 1.20 0.40 0.71 1.01 0.80 -1.06 120.40 120.65 3cf5 s VAL 173 Ca 0.52 -0.65 -0.17 0.00 0.00 0.00 0.00 61.98 61.68 3cf5 s VAL 173 Cb -0.11 -1.00 -0.09 0.00 0.00 0.00 0.00 36.38 35.18 3cf5 s VAL 173 CO 0.44 0.34 0.86 -0.63 0.00 0.00 0.00 175.10 176.11 3cf5 s ILE 174 N -0.34 4.56 0.03 2.22 1.01 -1.26 0.16 121.20 127.59 3cf5 s ILE 174 Ca 0.06 1.14 -0.20 0.00 0.00 0.00 0.00 60.65 61.65 3cf5 s ILE 174 Cb -0.06 -3.64 0.04 0.00 0.01 0.00 0.00 42.46 38.81 3cf5 s ILE 174 CO -0.01 -0.36 0.44 0.68 0.00 0.00 0.00 174.94 175.70 3cf5 s VAL 175 N -2.21 0.05 -0.42 2.92 -7.23 -1.16 -2.08 120.40 110.27 3cf5 s VAL 175 Ca 0.57 -0.38 -0.10 0.00 -1.81 0.00 0.00 61.98 60.27 3cf5 s VAL 175 Cb -0.10 -0.93 0.08 0.00 0.56 0.00 0.00 36.38 35.99 3cf5 s VAL 175 CO 0.20 -0.21 0.26 -0.60 -0.31 0.00 0.00 175.10 174.44 3cf5 s ARG 176 N -2.26 2.64 0.58 4.82 3.52 -0.44 -3.41 118.95 124.40 3cf5 s ARG 176 Ca -0.07 -1.43 -0.16 0.00 -0.13 0.00 0.00 55.73 53.94 3cf5 s ARG 176 Cb -0.01 -3.80 -0.04 0.00 -1.56 0.00 0.00 34.95 29.54 3cf5 s ARG 176 CO -0.01 -0.95 1.05 -0.51 -0.81 0.00 0.00 175.30 174.08 3cf5 s LEU 177 N 1.44 3.52 0.59 -0.88 1.43 -0.85 -3.48 118.68 120.46 3cf5 s LEU 177 Ca 0.03 1.80 0.29 0.00 -1.03 0.00 0.00 54.13 55.22 3cf5 s LEU 177 Cb -0.23 -4.53 1.42 0.00 0.03 0.00 0.00 46.19 42.88 3cf5 s LEU 177 CO 0.03 -1.09 1.82 1.55 0.23 0.00 0.00 176.35 178.88 3cf5 h PRO 178 N 0.53 0.00 -0.00 1.29 0.13 -1.91 0.69 132.00 132.73 3cf5 h PRO 178 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3cf5 h PRO 178 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3cf5 h PRO 178 CO 0.58 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.22 3cf5 n SER 179 N -3.69 0.02 -2.16 1.44 3.41 -1.26 -4.84 113.62 106.53 3cf5 n SER 179 Ca 0.11 -1.86 -0.12 0.00 -0.26 0.00 0.00 58.87 56.74 3cf5 n SER 179 Cb 0.82 -0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.81 3cf5 n SER 179 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cf5 n GLY 180 N 0.57 0.14 3.64 5.00 0.00 0.24 -4.81 105.19 109.98 3cf5 n GLY 180 Ca 0.03 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 3cf5 n GLY 180 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cf5 s GLU 181 N -5.55 2.02 -0.28 1.61 2.12 -1.18 -4.85 118.70 112.60 3cf5 s GLU 181 Ca 0.26 -2.00 0.02 0.00 0.36 0.00 0.00 54.97 53.62 3cf5 s GLU 181 Cb -0.12 -1.76 0.08 0.00 0.26 0.00 0.00 34.13 32.59 3cf5 s GLU 181 CO 0.39 -0.03 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.55 3cf5 s LEU 182 N -3.75 3.34 -0.06 2.70 1.43 0.12 -2.00 118.68 120.45 3cf5 s LEU 182 Ca 0.36 -1.56 0.03 0.00 -1.03 0.00 0.00 54.13 51.93 3cf5 s LEU 182 Cb 0.07 -1.35 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 3cf5 s LEU 182 CO 0.19 -0.29 -0.14 -0.13 0.23 0.00 0.00 176.35 176.22 3cf5 s ARG 183 N 1.22 2.67 -0.14 1.70 1.81 -1.22 0.29 118.95 125.29 3cf5 s ARG 183 Ca 0.00 -0.69 -0.27 0.00 -1.72 0.00 0.00 55.73 53.06 3cf5 s ARG 183 Cb -0.19 -2.43 -0.02 0.00 -0.45 0.00 0.00 34.95 31.86 3cf5 s ARG 183 CO -0.09 0.55 0.88 1.03 -0.68 0.00 0.00 175.30 177.00 3cf5 s ARG 184 N -0.54 4.36 -0.14 3.54 0.52 -1.25 -2.97 118.95 122.47 3cf5 s ARG 184 Ca 0.07 1.14 0.01 0.00 -0.52 0.00 0.00 55.73 56.44 3cf5 s ARG 184 Cb -0.12 -3.55 0.02 0.00 0.52 0.00 0.00 34.95 31.82 3cf5 s ARG 184 CO 0.01 -0.28 -0.18 0.08 0.02 0.00 0.00 175.30 174.95 3cf5 s VAL 185 N 1.96 1.78 -0.11 3.52 1.01 0.43 -4.72 120.40 124.28 3cf5 s VAL 185 Ca 0.42 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 3cf5 s VAL 185 Cb -0.17 -1.62 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 3cf5 s VAL 185 CO 0.15 0.50 1.81 -1.38 0.00 0.00 0.00 175.10 176.18 3cf5 s HIS 186 N 1.14 1.71 0.00 5.22 -3.43 -1.26 0.28 115.29 118.94 3cf5 s HIS 186 Ca -0.01 0.18 0.00 0.00 -0.80 0.00 0.00 55.06 54.43 3cf5 s HIS 186 Cb -0.14 -4.03 0.00 0.00 -1.43 0.00 0.00 32.58 26.98 3cf5 s HIS 186 CO -0.06 -4.06 0.20 -1.13 -2.00 0.00 0.00 174.74 167.68 3cf5 n SER 187 N 8.35 0.56 0.01 7.38 3.41 -0.58 -2.84 113.62 129.91 3cf5 n SER 187 Ca 0.20 -0.62 0.12 0.00 -0.26 0.00 0.00 58.87 58.31 3cf5 n SER 187 Cb 0.43 -0.11 0.18 0.00 -0.26 0.00 0.00 64.21 64.46 3cf5 n SER 187 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3cf5 n GLU 188 N 1.29 0.08 -3.98 4.33 1.02 -1.26 -3.31 120.64 118.81 3cf5 n GLU 188 Ca 0.00 0.01 -0.35 0.00 -0.02 0.00 0.00 57.16 56.80 3cf5 n GLU 188 Cb 0.07 -1.54 -0.11 0.00 -0.02 0.00 0.00 31.44 29.84 3cf5 n GLU 188 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cf5 n TYR 190 N 3.93 -2.18 -3.49 0.00 0.53 -1.26 -2.72 117.16 111.97 3cf5 n TYR 190 Ca -0.16 -0.13 -0.13 0.00 -1.02 0.00 0.00 57.90 56.46 3cf5 n TYR 190 Cb 0.52 -1.47 -0.04 0.00 -1.03 0.00 0.00 39.34 37.32 3cf5 n TYR 190 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3cf5 s ALA 191 N -2.17 -1.75 -0.18 -0.72 0.00 -0.84 -3.81 121.76 112.28 3cf5 s ALA 191 Ca 0.53 1.04 -0.08 0.00 0.00 0.00 0.00 51.96 53.45 3cf5 s ALA 191 Cb -0.11 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 3cf5 s ALA 191 CO 0.53 -0.55 0.09 0.99 0.00 0.00 0.00 175.76 176.82 3cf5 s THR 192 N -2.39 5.04 0.18 0.00 2.01 -0.06 -1.82 115.64 118.60 3cf5 s THR 192 Ca -0.02 0.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.73 3cf5 s THR 192 Cb -0.01 -3.28 -0.08 0.00 0.01 0.00 0.00 72.50 69.14 3cf5 s THR 192 CO -0.03 0.46 1.31 -0.63 -0.69 0.00 0.00 174.62 175.05 3cf5 s ILE 193 N 0.29 3.26 0.00 1.82 -1.09 -0.56 -1.16 121.20 123.76 3cf5 s ILE 193 Ca 0.05 1.02 0.00 0.00 -2.23 0.00 0.00 60.65 59.49 3cf5 s ILE 193 Cb -0.12 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 3cf5 s ILE 193 CO -0.01 0.14 0.00 0.61 -1.23 0.00 0.00 174.94 174.46 3cf5 n GLY 194 N 2.51 -0.28 3.49 6.18 0.00 -0.85 -3.33 105.19 112.90 3cf5 n GLY 194 Ca 0.07 -2.03 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 3cf5 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf5 s ALA 195 N -2.00 -1.46 0.85 4.61 0.00 -1.26 -2.50 121.76 120.00 3cf5 s ALA 195 Ca 0.00 1.71 -0.11 0.00 0.00 0.00 0.00 51.96 53.55 3cf5 s ALA 195 Cb 0.00 -1.00 0.10 0.00 0.00 0.00 0.00 23.12 22.23 3cf5 s ALA 195 CO 0.00 -0.28 1.09 0.14 0.00 0.00 0.00 175.76 176.71 3cf5 s VAL 196 N 0.46 2.86 0.00 0.00 -7.23 -1.25 0.22 120.40 115.45 3cf5 s VAL 196 Ca -0.01 0.28 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 3cf5 s VAL 196 Cb -0.04 -2.84 0.00 0.00 0.56 0.00 0.00 36.38 34.05 3cf5 s VAL 196 CO -0.01 -0.36 0.00 0.61 -0.31 0.00 0.00 175.10 175.02 3cf5 n GLY 197 N -1.44 0.15 3.26 2.32 0.00 -1.26 -2.37 105.19 105.85 3cf5 n GLY 197 Ca 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 3cf5 n GLY 197 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3cf5 n ASN 198 N -1.07 -0.88 0.00 1.61 5.15 -1.26 -3.74 115.26 115.07 3cf5 n ASN 198 Ca 0.00 -0.23 0.00 0.00 -0.60 0.00 0.00 54.58 53.75 3cf5 n ASN 198 Cb 0.00 -0.31 0.00 0.00 -0.53 0.00 0.00 39.78 38.94 3cf5 n ASN 198 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3cf5 n ALA 199 N -1.32 0.00 -3.64 5.20 0.00 -1.26 -4.73 120.51 114.76 3cf5 n ALA 199 Ca -0.04 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.36 3cf5 n ALA 199 Cb 0.12 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.51 3cf5 n ALA 199 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3cf5 s GLU 200 N 0.00 0.35 -1.15 0.00 2.56 -1.25 -4.82 118.70 114.40 3cf5 s GLU 200 Ca 0.00 0.54 -0.23 0.00 0.00 0.00 0.00 54.97 55.29 3cf5 s GLU 200 Cb 0.00 0.10 -0.06 0.00 2.00 0.00 0.00 34.13 36.17 3cf5 s GLU 200 CO 0.00 -0.06 1.91 -1.01 -0.56 0.00 0.00 175.26 175.53 3cf5 s HIS 201 N 0.95 2.02 0.06 5.30 3.76 -1.26 -3.90 115.29 122.23 3cf5 s HIS 201 Ca -0.05 0.26 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 3cf5 s HIS 201 Cb -0.04 -4.10 0.00 0.00 1.11 0.00 0.00 32.58 29.56 3cf5 s HIS 201 CO -0.12 -1.36 0.00 1.17 -0.85 0.00 0.00 174.74 173.58 3cf5 n LYS 202 N 8.40 0.00 -0.00 1.40 3.00 -1.26 -4.78 118.16 124.91 3cf5 n LYS 202 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 3cf5 n LYS 202 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.50 3cf5 n LYS 202 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 3cf5 n ASN 203 N -2.71 0.12 -4.42 3.14 0.23 -1.25 -4.42 115.26 105.96 3cf5 n ASN 203 Ca 0.00 -2.00 -0.44 0.00 -0.53 0.00 0.00 54.58 51.61 3cf5 n ASN 203 Cb 0.00 -0.05 -0.03 0.00 -2.08 0.00 0.00 39.78 37.61 3cf5 n ASN 203 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 3cf5 s ILE 204 N -1.89 4.72 -2.12 1.53 1.01 -1.26 -4.85 121.20 118.34 3cf5 s ILE 204 Ca 0.00 -1.13 0.26 0.00 0.00 0.00 0.00 60.65 59.79 3cf5 s ILE 204 Cb 0.00 -4.64 0.33 0.00 0.01 0.00 0.00 42.46 38.16 3cf5 s ILE 204 CO 0.00 -1.33 1.55 1.33 0.00 0.00 0.00 174.94 176.49 3cf5 n VAL 205 N 5.50 0.00 -1.01 2.92 0.24 -1.26 -4.93 118.33 119.79 3cf5 n VAL 205 Ca 0.05 -0.21 -0.00 0.00 -2.04 0.00 0.00 64.34 62.13 3cf5 n VAL 205 Cb 0.46 0.60 -0.00 0.00 -1.47 0.00 0.00 33.84 33.43 3cf5 n VAL 205 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3cf5 n LEU 206 N -0.17 0.78 0.00 1.34 4.77 -1.26 -4.73 117.00 117.73 3cf5 n LEU 206 Ca 0.14 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3cf5 n LEU 206 Cb 0.38 -2.13 0.00 0.00 -2.33 0.00 0.00 43.42 39.34 3cf5 n LEU 206 CO 0.22 -0.81 0.00 0.61 -1.33 0.00 0.00 177.39 176.08 3cf5 n GLY 207 N 0.23 1.54 3.95 -0.72 0.00 -1.26 -4.46 105.19 104.46 3cf5 n GLY 207 Ca -0.00 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 3cf5 n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf5 s LYS 208 N 0.00 2.64 0.59 1.61 -0.14 -1.26 -4.97 119.74 118.21 3cf5 s LYS 208 Ca 0.00 -0.44 -0.18 0.00 -1.36 0.00 0.00 55.97 53.99 3cf5 s LYS 208 Cb 0.00 -2.38 -0.14 0.00 -1.68 0.00 0.00 37.83 33.62 3cf5 s LYS 208 CO 0.00 -0.74 -0.16 0.00 -0.76 0.00 0.00 175.35 173.69 3cf5 n ALA 209 N -2.47 -3.25 0.00 5.17 0.00 -1.26 -2.73 120.51 115.97 3cf5 n ALA 209 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3cf5 n ALA 209 Cb 0.59 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3cf5 n ALA 209 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cf5 n GLY 210 N 2.57 2.60 0.07 0.00 0.00 -1.26 -4.71 105.19 104.47 3cf5 n GLY 210 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 3cf5 n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3cf5 h ARG 211 N 3.00 0.05 0.00 1.61 2.43 -1.73 -2.03 114.38 117.71 3cf5 h ARG 211 Ca 0.00 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.02 3cf5 h ARG 211 Cb 0.00 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3cf5 h ARG 211 CO 0.00 0.94 -0.36 0.66 -1.51 0.00 0.00 179.97 179.70 3cf5 h SER 212 N 0.01 0.00 -0.34 -3.80 4.64 -1.83 -2.61 113.55 109.62 3cf5 h SER 212 Ca -0.09 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 3cf5 h SER 212 Cb 1.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.93 3cf5 h SER 212 CO 0.13 0.36 0.08 0.03 -0.87 0.00 0.00 176.83 176.56 3cf5 h ARG 213 N 0.00 0.55 0.00 4.77 2.47 -1.56 0.10 114.38 120.71 3cf5 h ARG 213 Ca -0.00 -0.13 0.00 0.00 -1.26 0.00 0.00 59.98 58.58 3cf5 h ARG 213 Cb 0.79 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.04 3cf5 h ARG 213 CO 0.05 0.60 0.63 0.91 0.56 0.00 0.00 179.97 182.72 3cf5 n TRP 214 N -4.62 0.02 0.00 3.04 5.03 -0.98 -2.73 117.44 117.20 3cf5 n TRP 214 Ca -0.01 0.01 0.00 0.00 3.03 0.00 0.00 57.50 60.53 3cf5 n TRP 214 Cb 0.20 -0.04 0.00 0.00 -1.03 0.00 0.00 31.31 30.43 3cf5 n TRP 214 CO 0.00 0.00 0.00 1.28 -0.03 0.00 0.00 177.69 178.94 3cf5 n LEU 215 N -1.52 0.62 -3.75 -0.99 4.32 -0.80 -4.51 117.00 110.37 3cf5 n LEU 215 Ca -0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.87 3cf5 n LEU 215 Cb 0.63 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 42.32 3cf5 n LEU 215 CO 0.00 -0.02 -0.05 -0.83 -1.22 0.00 0.00 177.39 175.27 3cf5 s GLY 216 N -3.96 -0.21 0.23 -0.72 0.00 0.29 -4.28 107.32 98.67 3cf5 s GLY 216 Ca 0.00 0.95 -0.07 0.00 0.00 0.00 0.00 44.72 45.60 3cf5 s GLY 216 CO 0.00 0.95 -0.10 -2.13 0.00 0.00 0.00 173.10 171.82 3cf5 n ARG 217 N 3.37 0.00 -1.54 2.90 0.63 -1.26 -4.26 116.66 116.50 3cf5 n ARG 217 Ca -0.17 0.00 -0.58 0.00 -0.92 0.00 0.00 57.85 56.18 3cf5 n ARG 217 Cb 0.56 -0.38 -0.08 0.00 0.45 0.00 0.00 32.46 33.02 3cf5 n ARG 217 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 3cf5 n LYS 218 N 0.64 0.31 0.00 -0.14 -0.00 -1.26 -4.44 118.16 113.27 3cf5 n LYS 218 Ca 0.02 0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 3cf5 n LYS 218 Cb 0.18 -1.65 0.00 0.00 -0.00 0.00 0.00 35.03 33.56 3cf5 n LYS 218 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3cf5 n PRO 219 N 1.93 -0.97 -0.32 -1.58 -0.02 -1.26 -4.73 135.00 128.04 3cf5 n PRO 219 Ca 0.20 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.57 3cf5 n PRO 219 Cb 0.10 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.59 3cf5 n PRO 219 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 3cf5 n HIS 220 N -2.38 -1.20 -3.59 6.00 1.44 -1.26 -4.97 115.22 109.25 3cf5 n HIS 220 Ca 0.00 0.05 -0.28 0.00 -2.01 0.00 0.00 57.72 55.49 3cf5 n HIS 220 Cb 0.00 -0.44 -0.16 0.00 0.12 0.00 0.00 29.99 29.51 3cf5 n HIS 220 CO 0.00 0.00 0.00 -1.14 -2.81 0.00 0.00 176.34 172.39 3cf5 s GLN 221 N -0.45 0.18 0.12 -1.40 2.00 -1.26 -5.13 119.66 113.72 3cf5 s GLN 221 Ca 0.14 -0.33 -0.34 0.00 -2.00 0.00 0.00 55.36 52.83 3cf5 s GLN 221 Cb -0.09 -1.58 -0.13 0.00 0.80 0.00 0.00 33.01 32.01 3cf5 s GLN 221 CO 0.22 -0.83 1.64 0.54 -0.50 0.00 0.00 175.29 176.36 3cf5 n ARG 222 N 5.23 2.19 0.00 1.67 1.74 -1.26 -4.89 116.66 121.34 3cf5 n ARG 222 Ca -0.07 0.79 0.13 0.00 -0.77 0.00 0.00 57.85 57.93 3cf5 n ARG 222 Cb 0.46 -2.58 0.74 0.00 -1.02 0.00 0.00 32.46 30.06 3cf5 n ARG 222 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3cf5 n GLY 223 N 3.63 -0.81 0.19 -0.13 0.00 -1.26 -1.99 105.19 104.82 3cf5 n GLY 223 Ca 0.18 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.18 3cf5 n GLY 223 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3cf5 n SER 224 N -0.98 0.81 -0.00 1.61 3.41 -1.21 -1.83 113.62 115.43 3cf5 n SER 224 Ca 0.19 -0.74 0.08 0.00 -0.26 0.00 0.00 58.87 58.14 3cf5 n SER 224 Cb 0.09 0.06 -0.11 0.00 -0.26 0.00 0.00 64.21 63.99 3cf5 n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cf5 n ALA 225 N -0.79 3.30 -1.00 7.33 0.00 -0.84 -4.74 120.51 123.76 3cf5 n ALA 225 Ca 0.13 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.14 3cf5 n ALA 225 Cb 0.33 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.19 3cf5 n ALA 225 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3cf5 n MET 226 N -1.78 1.00 -4.48 0.00 2.81 -1.22 -4.92 117.12 108.53 3cf5 n MET 226 Ca -0.00 0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.61 3cf5 n MET 226 Cb 0.36 0.00 -0.13 0.00 -0.71 0.00 0.00 33.22 32.74 3cf5 n MET 226 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3cf5 s ASN 227 N -1.12 2.94 0.15 7.83 0.01 -1.26 -2.76 114.94 120.73 3cf5 s ASN 227 Ca 0.00 -0.67 -0.18 0.00 -0.71 0.00 0.00 52.86 51.30 3cf5 s ASN 227 Cb 0.00 -0.21 0.08 0.00 0.41 0.00 0.00 41.25 41.54 3cf5 s ASN 227 CO 0.00 0.16 1.18 -2.65 -1.51 0.00 0.00 177.10 174.27 3cf5 n PRO 228 N 1.24 -0.25 -0.05 -0.60 -0.02 -1.26 0.20 135.00 134.26 3cf5 n PRO 228 Ca -0.18 1.16 -0.08 0.00 -2.02 0.00 0.00 63.50 62.39 3cf5 n PRO 228 Cb 0.53 -1.72 -0.05 0.00 -0.02 0.00 0.00 33.50 32.23 3cf5 n PRO 228 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3cf5 h VAL 229 N 0.00 0.00 -0.63 -1.45 2.07 -1.96 -2.94 116.25 111.33 3cf5 h VAL 229 Ca 0.20 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.85 3cf5 h VAL 229 Cb 0.39 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.04 3cf5 h VAL 229 CO -0.74 0.00 -0.21 0.44 0.02 0.00 0.00 177.57 177.08 3cf5 h ASP 230 N -0.25 -0.76 -2.56 0.57 3.32 0.19 -3.45 116.42 113.47 3cf5 h ASP 230 Ca 0.03 0.21 0.15 0.00 0.02 0.00 0.00 57.03 57.43 3cf5 h ASP 230 Cb 0.34 0.45 -0.30 0.00 0.22 0.00 0.00 39.33 40.04 3cf5 h ASP 230 CO -0.30 -0.25 0.73 -2.28 -1.72 0.00 0.00 179.24 175.43 3cf5 s HIS 231 N -6.17 -0.20 0.01 4.55 5.65 0.05 -4.92 115.29 114.26 3cf5 s HIS 231 Ca -0.14 0.49 0.01 0.00 0.25 0.00 0.00 55.06 55.66 3cf5 s HIS 231 Cb 0.19 0.44 0.04 0.00 -1.18 0.00 0.00 32.58 32.07 3cf5 s HIS 231 CO 0.73 -0.10 0.05 -2.30 -0.65 0.00 0.00 174.74 172.47 3cf5 n PRO 232 N 1.75 -0.00 -0.27 2.88 -0.02 -1.26 0.52 135.00 138.59 3cf5 n PRO 232 Ca -0.11 0.05 0.05 0.00 -2.02 0.00 0.00 63.50 61.46 3cf5 n PRO 232 Cb 0.57 -0.08 0.17 0.00 -0.02 0.00 0.00 33.50 34.13 3cf5 n PRO 232 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3cf5 n HIS 233 N -3.09 0.66 -2.13 6.00 8.25 -1.26 -4.95 115.22 118.70 3cf5 n HIS 233 Ca 0.01 -0.27 -0.07 0.00 -0.26 0.00 0.00 57.72 57.14 3cf5 n HIS 233 Cb 0.04 -0.11 0.04 0.00 1.12 0.00 0.00 29.99 31.08 3cf5 n HIS 233 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cf5 n GLY 234 N 0.76 0.35 7.00 -1.41 0.00 0.18 -3.29 105.19 108.79 3cf5 n GLY 234 Ca 0.12 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.22 3cf5 n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf5 n GLY 235 N 2.87 -0.22 0.00 -0.02 0.00 -1.11 -4.47 105.19 102.24 3cf5 n GLY 235 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.13 3cf5 n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf5 n GLY 236 N 0.00 -0.01 2.73 -0.02 0.00 -1.26 -4.72 105.19 101.91 3cf5 n GLY 236 Ca 0.00 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 3cf5 n GLY 236 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cf5 n GLU 237 N 1.38 3.69 0.00 1.61 2.13 -1.26 -4.74 120.64 123.45 3cf5 n GLU 237 Ca 0.00 -3.28 0.00 0.00 0.66 0.00 0.00 57.16 54.54 3cf5 n GLU 237 Cb 0.00 -2.92 0.00 0.00 0.27 0.00 0.00 31.44 28.79 3cf5 n GLU 237 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cf5 n GLY 238 N 2.84 -0.11 2.88 8.31 0.00 -1.26 -5.07 105.19 112.79 3cf5 n GLY 238 Ca 0.48 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 46.08 3cf5 n GLY 238 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cf5 s ARG 239 N 0.00 1.18 0.89 1.61 0.52 -1.26 -5.07 118.95 116.82 3cf5 s ARG 239 Ca 0.00 -1.37 -0.12 0.00 -0.52 0.00 0.00 55.73 53.72 3cf5 s ARG 239 Cb 0.00 -2.58 0.19 0.00 0.52 0.00 0.00 34.95 33.08 3cf5 s ARG 239 CO 0.00 -0.89 0.43 0.25 0.02 0.00 0.00 175.30 175.11 3cf5 n THR 240 N 4.58 0.00 0.00 0.02 -2.24 -1.26 -5.05 114.28 110.33 3cf5 n THR 240 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3cf5 n THR 240 Cb 0.42 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 3cf5 n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cf5 n GLY 241 N -2.03 0.00 3.94 3.38 0.00 -1.26 -5.13 105.19 104.08 3cf5 n GLY 241 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 3cf5 n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf5 s ALA 242 N 0.00 4.52 0.00 4.61 0.00 -1.26 -4.87 121.76 124.76 3cf5 s ALA 242 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.53 3cf5 s ALA 242 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.23 3cf5 s ALA 242 CO 0.00 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.62 3cf5 n GLY 243 N -1.89 0.00 2.94 0.00 0.00 -1.26 -4.75 105.19 100.23 3cf5 n GLY 243 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 3cf5 n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf5 n ARG 244 N 0.00 -2.13 -4.00 1.61 3.00 -1.26 -5.00 116.66 108.88 3cf5 n ARG 244 Ca 0.00 1.90 -0.09 0.00 -0.01 0.00 0.00 57.85 59.65 3cf5 n ARG 244 Cb 0.00 -2.89 -0.05 0.00 0.00 0.00 0.00 32.46 29.52 3cf5 n ARG 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 3cf5 s VAL 245 N -0.92 0.00 0.71 1.55 -7.23 -1.26 -4.24 120.40 109.00 3cf5 s VAL 245 Ca -0.05 -1.41 0.01 0.00 -1.81 0.00 0.00 61.98 58.72 3cf5 s VAL 245 Cb 0.00 -2.23 0.13 0.00 0.56 0.00 0.00 36.38 34.84 3cf5 s VAL 245 CO 0.36 0.00 0.97 -2.16 -0.31 0.00 0.00 175.10 173.96 3cf5 s PRO 246 N -3.97 1.72 0.21 4.82 0.04 -1.26 -4.80 135.00 131.77 3cf5 s PRO 246 Ca 0.23 -1.24 -0.08 0.00 0.04 0.00 0.00 61.00 59.94 3cf5 s PRO 246 Cb -0.01 -2.38 0.32 0.00 0.04 0.00 0.00 34.50 32.47 3cf5 s PRO 246 CO 0.09 -1.40 1.22 1.33 0.04 0.00 0.00 177.00 178.29 3cf5 n VAL 247 N -2.76 -0.35 -4.18 -0.36 0.24 -1.26 -3.64 118.33 106.02 3cf5 n VAL 247 Ca 0.16 1.81 -0.34 0.00 -2.04 0.00 0.00 64.34 63.92 3cf5 n VAL 247 Cb 0.61 -2.47 -0.11 0.00 -1.47 0.00 0.00 33.84 30.39 3cf5 n VAL 247 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3cf5 s THR 248 N -5.93 4.32 -0.87 3.34 -4.23 -1.26 -4.46 115.64 106.56 3cf5 s THR 248 Ca -0.12 -0.20 -0.30 0.00 -1.18 0.00 0.00 61.69 59.89 3cf5 s THR 248 Cb 0.20 -2.93 -0.19 0.00 1.34 0.00 0.00 72.50 70.92 3cf5 s THR 248 CO 0.60 0.47 2.62 -0.81 -0.54 0.00 0.00 174.62 176.96 3cf5 n PRO 249 N 3.61 0.24 0.00 3.99 -0.04 -1.24 -4.59 135.00 136.96 3cf5 n PRO 249 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 3cf5 n PRO 249 Cb 0.52 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 3cf5 n PRO 249 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 3cf5 n TRP 250 N 11.56 0.00 0.00 0.54 -0.00 -1.26 -4.96 117.44 123.32 3cf5 n TRP 250 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 58.09 3cf5 n TRP 250 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.45 3cf5 n TRP 250 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3cf5 n GLY 251 N -0.08 2.22 0.27 5.87 0.00 -1.26 -4.92 105.19 107.29 3cf5 n GLY 251 Ca 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.30 3cf5 n GLY 251 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cf5 n LYS 252 N 1.90 0.00 -1.50 1.61 4.01 -1.26 -4.70 118.16 118.22 3cf5 n LYS 252 Ca 0.00 0.00 -0.59 0.00 -0.51 0.00 0.00 58.31 57.21 3cf5 n LYS 252 Cb 0.00 -0.06 -0.08 0.00 -0.51 0.00 0.00 35.03 34.37 3cf5 n LYS 252 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 3cf5 n PRO 253 N -1.69 0.00 -4.36 1.97 -0.04 -1.26 -2.01 135.00 127.60 3cf5 n PRO 253 Ca 0.00 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 3cf5 n PRO 253 Cb 0.00 -1.37 -0.09 0.00 -0.04 0.00 0.00 33.50 32.01 3cf5 n PRO 253 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3cf5 n THR 254 N 2.68 -0.84 -4.05 0.52 -2.24 -1.26 -4.97 114.28 104.12 3cf5 n THR 254 Ca 0.24 -0.33 -0.33 0.00 -2.27 0.00 0.00 64.05 61.37 3cf5 n THR 254 Cb -0.00 -1.00 -0.15 0.00 -2.10 0.00 0.00 70.33 67.08 3cf5 n THR 254 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3cf5 s LYS 255 N -7.27 2.46 0.43 -0.78 2.20 -0.85 -5.10 119.74 110.83 3cf5 s LYS 255 Ca 0.29 -1.21 -0.24 0.00 -0.36 0.00 0.00 55.97 54.45 3cf5 s LYS 255 Cb -0.17 -2.87 -0.08 0.00 -1.51 0.00 0.00 37.83 33.21 3cf5 s LYS 255 CO 1.00 -0.49 1.20 0.20 -0.36 0.00 0.00 175.35 176.90 3cf5 s GLY 256 N 1.17 2.85 -0.08 5.54 0.00 -1.26 -4.95 107.32 110.59 3cf5 s GLY 256 Ca -0.05 1.03 -0.01 0.00 0.00 0.00 0.00 44.72 45.69 3cf5 s GLY 256 CO -0.06 1.53 -0.08 1.04 0.00 0.00 0.00 173.10 175.54 3cf5 n LEU 257 N -0.20 2.40 -3.90 0.66 4.77 -1.26 -5.04 117.00 114.42 3cf5 n LEU 257 Ca 0.06 -0.01 -0.35 0.00 -0.03 0.00 0.00 56.01 55.68 3cf5 n LEU 257 Cb 0.46 -0.25 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3cf5 n LEU 257 CO 0.51 0.51 -0.98 1.17 -1.33 0.00 0.00 177.39 177.27 3cf5 n LYS 258 N -2.87 0.00 -2.34 3.23 4.81 -1.26 -4.98 118.16 114.74 3cf5 n LYS 258 Ca -0.14 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.23 3cf5 n LYS 258 Cb 0.63 -0.95 -0.01 0.00 0.02 0.00 0.00 35.03 34.73 3cf5 n LYS 258 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3cf5 n THR 259 N -1.96 0.00 -2.91 3.15 -2.24 -1.26 -5.09 114.28 103.97 3cf5 n THR 259 Ca 0.02 -0.53 -0.43 0.00 -2.27 0.00 0.00 64.05 60.84 3cf5 n THR 259 Cb 0.49 -0.13 -0.04 0.00 -2.10 0.00 0.00 70.33 68.55 3cf5 n THR 259 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3cf5 s ARG 260 N -2.47 3.18 0.00 -0.78 1.81 -1.26 -4.94 118.95 114.49 3cf5 s ARG 260 Ca 0.03 -0.69 0.00 0.00 -1.72 0.00 0.00 55.73 53.35 3cf5 s ARG 260 Cb -0.00 -4.15 0.00 0.00 -0.45 0.00 0.00 34.95 30.34 3cf5 s ARG 260 CO 0.02 -1.60 0.00 2.89 -0.68 0.00 0.00 175.30 175.93 3cf5 n ARG 261 N 7.31 0.00 0.10 3.54 1.85 -1.26 -5.08 116.66 123.12 3cf5 n ARG 261 Ca -0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.77 3cf5 n ARG 261 Cb 0.46 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.85 3cf5 n ARG 261 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 3cf5 h LYS 262 N 0.00 -0.30 -1.09 2.89 1.57 -2.03 -3.26 116.57 114.36 3cf5 h LYS 262 Ca 0.00 0.02 0.35 0.00 -1.87 0.00 0.00 60.65 59.16 3cf5 h LYS 262 Cb 0.00 0.07 -0.14 0.00 0.08 0.00 0.00 32.23 32.24 3cf5 h LYS 262 CO 0.00 -0.20 0.65 0.00 -0.57 0.00 0.00 179.45 179.33 3cf5 h ARG 263 N -0.79 0.23 -0.68 3.15 2.47 -1.99 0.74 114.38 117.51 3cf5 h ARG 263 Ca -0.03 -0.01 0.16 0.00 -1.26 0.00 0.00 59.98 58.83 3cf5 h ARG 263 Cb 0.24 -0.05 -0.13 0.00 -1.65 0.00 0.00 29.97 28.38 3cf5 h ARG 263 CO 0.05 0.15 -0.09 1.17 0.56 0.00 0.00 179.97 181.82 3cf5 n LYS 264 N -4.93 -0.06 0.12 0.04 3.00 -1.23 0.81 118.16 115.90 3cf5 n LYS 264 Ca 0.33 1.04 -0.24 0.00 -0.00 0.00 0.00 58.31 59.44 3cf5 n LYS 264 Cb 1.12 -1.60 -0.16 0.00 0.00 0.00 0.00 35.03 34.39 3cf5 n LYS 264 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 3cf5 h THR 265 N 0.00 1.14 0.00 3.15 1.35 -1.03 -3.25 112.91 114.27 3cf5 h THR 265 Ca 0.36 -2.62 0.00 0.00 -0.55 0.00 0.00 66.41 63.60 3cf5 h THR 265 Cb 0.65 2.93 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 3cf5 h THR 265 CO -0.67 0.83 0.00 -0.24 -0.25 0.00 0.00 175.52 175.19 3cf5 n SER 266 N -3.67 3.09 -3.83 5.36 2.88 0.24 -4.66 113.62 113.04 3cf5 n SER 266 Ca -0.20 -1.76 -0.12 0.00 -1.33 0.00 0.00 58.87 55.46 3cf5 n SER 266 Cb 1.10 -0.62 -0.13 0.00 -0.75 0.00 0.00 64.21 63.80 3cf5 n SER 266 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3cf5 s ASP 267 N 1.67 -0.11 -0.20 -3.46 -1.08 -0.78 -3.84 116.67 108.87 3cf5 s ASP 267 Ca 0.00 0.22 -0.01 0.00 -0.52 0.00 0.00 52.55 52.23 3cf5 s ASP 267 Cb 0.00 0.21 0.06 0.00 -1.46 0.00 0.00 42.92 41.73 3cf5 s ASP 267 CO 0.00 -0.05 -0.01 -0.13 0.52 0.00 0.00 175.17 175.50 3cf5 s ARG 268 N 0.16 1.10 -0.14 4.34 1.81 0.85 -4.98 118.95 122.10 3cf5 s ARG 268 Ca -0.01 -0.64 -0.00 0.00 -1.72 0.00 0.00 55.73 53.36 3cf5 s ARG 268 Cb -0.02 -2.27 0.00 0.00 -0.45 0.00 0.00 34.95 32.21 3cf5 s ARG 268 CO -0.00 -0.60 0.00 1.19 -0.68 0.00 0.00 175.30 175.21 3cf5 n PHE 269 N 4.89 -1.87 -0.00 -0.53 3.72 -1.26 0.11 117.46 122.51 3cf5 n PHE 269 Ca -0.10 0.84 -0.00 0.00 -0.05 0.00 0.00 57.45 58.14 3cf5 n PHE 269 Cb 0.46 -2.67 -0.00 0.00 -0.94 0.00 0.00 39.48 36.33 3cf5 n PHE 269 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 176.76 175.87 3cf5 h ILE 270 N 1.44 0.00 -0.52 4.37 3.07 -1.94 -3.28 117.51 120.65 3cf5 h ILE 270 Ca -0.01 -0.08 -0.40 0.00 1.55 0.00 0.00 64.86 65.92 3cf5 h ILE 270 Cb 0.02 0.00 0.03 0.00 -0.27 0.00 0.00 36.82 36.60 3cf5 h ILE 270 CO 0.04 0.00 -0.02 0.52 -1.05 0.00 0.00 178.15 177.64 3cf5 n VAL 271 N -2.24 0.18 -0.39 0.16 0.31 -1.26 -4.80 118.33 110.29 3cf5 n VAL 271 Ca -0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 3cf5 n VAL 271 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 3cf5 n VAL 271 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86