#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cy6 n ASP 2 N 0.00 -0.26 -4.58 0.00 8.00 -1.26 -5.03 116.55 113.42 2cy6 n ASP 2 Ca 0.00 0.26 -0.35 0.00 0.71 0.00 0.00 54.79 55.41 2cy6 n ASP 2 Cb 0.00 -1.42 -0.11 0.00 -0.02 0.00 0.00 41.12 39.58 2cy6 n ASP 2 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2cy6 s THR 3 N -2.57 4.67 -0.08 -3.53 2.01 -1.26 -5.00 115.64 109.87 2cy6 s THR 3 Ca 0.67 -0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.64 2cy6 s THR 3 Cb -0.24 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.15 2cy6 s THR 3 CO 0.60 0.42 -0.19 -0.63 -0.69 0.00 0.00 174.62 174.13 2cy6 s ILE 4 N 0.74 1.65 -0.07 1.82 -1.09 -1.26 -2.96 121.20 120.03 2cy6 s ILE 4 Ca 0.03 -0.79 0.05 0.00 -2.23 0.00 0.00 60.65 57.72 2cy6 s ILE 4 Cb -0.13 -1.45 -0.01 0.00 -1.58 0.00 0.00 42.46 39.29 2cy6 s ILE 4 CO 0.02 0.47 -0.25 -0.69 -1.23 0.00 0.00 174.94 173.26 2cy6 s VAL 5 N 0.42 2.08 0.02 2.92 1.01 -0.51 0.14 120.40 126.48 2cy6 s VAL 5 Ca -0.15 -1.05 -0.14 0.00 0.00 0.00 0.00 61.98 60.64 2cy6 s VAL 5 Cb -0.16 -1.76 0.02 0.00 0.00 0.00 0.00 36.38 34.48 2cy6 s VAL 5 CO 0.06 0.57 0.30 0.00 0.00 0.00 0.00 175.10 176.03 2cy6 s ALA 6 N -0.02 -0.71 -0.29 5.51 0.00 0.53 -0.29 121.76 126.49 2cy6 s ALA 6 Ca -0.08 0.13 -0.05 0.00 0.00 0.00 0.00 51.96 51.96 2cy6 s ALA 6 Cb -0.15 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2cy6 s ALA 6 CO 0.05 -0.34 0.05 0.08 0.00 0.00 0.00 175.76 175.60 2cy6 s VAL 7 N -2.00 3.66 -0.11 0.00 1.01 0.90 -0.13 120.40 123.72 2cy6 s VAL 7 Ca -0.09 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 2cy6 s VAL 7 Cb -0.03 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 2cy6 s VAL 7 CO 0.00 0.08 0.14 -1.83 0.00 0.00 0.00 175.10 173.49 2cy6 s GLU 8 N 1.44 3.42 -0.53 2.72 -1.05 0.96 -1.56 118.70 124.10 2cy6 s GLU 8 Ca 0.01 -0.16 -0.08 0.00 -0.15 0.00 0.00 54.97 54.59 2cy6 s GLU 8 Cb -0.17 -3.16 0.14 0.00 -0.44 0.00 0.00 34.13 30.49 2cy6 s GLU 8 CO 0.01 0.77 0.40 -0.51 0.95 0.00 0.00 175.26 176.87 2cy6 s LEU 9 N -1.08 5.71 -0.36 1.83 1.02 0.20 -0.50 118.68 125.49 2cy6 s LEU 9 Ca 0.16 -2.16 -0.10 0.00 0.02 0.00 0.00 54.13 52.05 2cy6 s LEU 9 Cb -0.12 -2.00 0.03 0.00 0.02 0.00 0.00 46.19 44.12 2cy6 s LEU 9 CO 0.05 -0.62 0.19 -0.62 0.02 0.00 0.00 176.35 175.37 2cy6 s ASP 10 N 2.25 5.67 0.07 2.29 -1.08 0.11 -1.38 116.67 124.59 2cy6 s ASP 10 Ca 0.09 -0.97 0.24 0.00 -0.52 0.00 0.00 52.55 51.39 2cy6 s ASP 10 Cb -0.23 -2.00 0.27 0.00 -1.46 0.00 0.00 42.92 39.49 2cy6 s ASP 10 CO -0.02 -0.36 1.23 0.35 0.52 0.00 0.00 175.17 176.89 2cy6 n THR 11 N 4.97 0.21 -4.04 1.71 -2.24 -0.40 -0.91 114.28 113.58 2cy6 n THR 11 Ca -0.12 -0.20 -0.31 0.00 -2.27 0.00 0.00 64.05 61.15 2cy6 n THR 11 Cb 0.46 0.09 -0.15 0.00 -2.10 0.00 0.00 70.33 68.63 2cy6 n THR 11 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2cy6 s TYR 12 N -3.14 2.91 -0.43 4.78 5.04 -1.23 -4.56 117.35 120.73 2cy6 s TYR 12 Ca 0.06 -2.04 -0.28 0.00 -2.44 0.00 0.00 57.07 52.37 2cy6 s TYR 12 Cb 0.15 -1.81 -0.00 0.00 0.35 0.00 0.00 41.96 40.64 2cy6 s TYR 12 CO 0.75 -0.83 1.61 -1.25 -1.34 0.00 0.00 175.55 174.49 2cy6 s PRO 13 N 1.22 3.32 -1.10 4.97 0.05 -1.26 -4.91 135.00 137.29 2cy6 s PRO 13 Ca -0.06 1.00 -0.11 0.00 0.05 0.00 0.00 61.00 61.88 2cy6 s PRO 13 Cb -0.19 -4.15 0.25 0.00 0.05 0.00 0.00 34.50 30.47 2cy6 s PRO 13 CO -0.06 -1.88 1.14 -0.80 0.05 0.00 0.00 177.00 175.44 2cy6 s ASN 14 N 5.33 7.22 0.54 6.66 -0.87 -1.26 -4.88 114.94 127.68 2cy6 s ASN 14 Ca 0.67 -3.39 0.30 0.00 -1.57 0.00 0.00 52.86 48.88 2cy6 s ASN 14 Cb -0.16 -2.25 1.56 0.00 -0.02 0.00 0.00 41.25 40.38 2cy6 s ASN 14 CO 0.30 -0.40 2.10 0.71 -2.57 0.00 0.00 177.10 177.23 2cy6 h THR 15 N 3.97 0.42 0.00 1.60 1.35 -1.82 -0.67 112.91 117.76 2cy6 h THR 15 Ca 0.20 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2cy6 h THR 15 Cb 0.89 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2cy6 h THR 15 CO 1.03 0.09 0.00 -0.90 -0.25 0.00 0.00 175.52 175.49 2cy6 n ASP 16 N -3.49 0.51 -0.51 5.36 5.75 -1.26 -2.69 116.55 120.22 2cy6 n ASP 16 Ca -0.02 0.62 0.06 0.00 -0.01 0.00 0.00 54.79 55.44 2cy6 n ASP 16 Cb 0.23 -0.73 0.19 0.00 -1.03 0.00 0.00 41.12 39.78 2cy6 n ASP 16 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 2cy6 n ILE 17 N -2.05 2.15 -0.13 2.12 -5.35 -0.29 -4.98 119.36 110.83 2cy6 n ILE 17 Ca 0.03 -2.94 0.00 0.00 -0.27 0.00 0.00 62.75 59.57 2cy6 n ILE 17 Cb 0.24 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 37.89 2cy6 n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cy6 n GLY 18 N -1.19 0.59 3.74 3.28 0.00 -1.09 -4.67 105.19 105.85 2cy6 n GLY 18 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2cy6 n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cy6 s ASP 19 N -2.80 4.99 1.13 1.61 1.01 -1.04 -4.90 116.67 116.67 2cy6 s ASP 19 Ca 0.00 2.65 -0.16 0.00 0.71 0.00 0.00 52.55 55.76 2cy6 s ASP 19 Cb 0.00 -2.62 0.25 0.00 1.01 0.00 0.00 42.92 41.56 2cy6 s ASP 19 CO 0.00 -1.75 1.08 -2.16 0.21 0.00 0.00 175.17 172.56 2cy6 s PRO 20 N -3.15 -0.60 -0.18 8.23 0.04 -1.26 -4.24 135.00 133.84 2cy6 s PRO 20 Ca 0.77 0.28 0.06 0.00 0.04 0.00 0.00 61.00 62.15 2cy6 s PRO 20 Cb -0.38 -1.64 0.42 0.00 0.04 0.00 0.00 34.50 32.95 2cy6 s PRO 20 CO 0.42 -3.37 1.32 -1.13 0.04 0.00 0.00 177.00 174.28 2cy6 n SER 21 N -4.58 3.55 -3.93 6.66 3.41 -1.26 -4.55 113.62 112.91 2cy6 n SER 21 Ca 0.08 -2.66 -0.09 0.00 -0.26 0.00 0.00 58.87 55.94 2cy6 n SER 21 Cb 0.58 -0.64 -0.08 0.00 -0.26 0.00 0.00 64.21 63.82 2cy6 n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2cy6 s TYR 22 N -1.92 0.32 0.49 7.33 -0.85 -1.26 -4.95 117.35 116.52 2cy6 s TYR 22 Ca 0.31 -0.74 -0.24 0.00 -0.52 0.00 0.00 57.07 55.88 2cy6 s TYR 22 Cb 0.24 -0.12 -0.07 0.00 0.38 0.00 0.00 41.96 42.40 2cy6 s TYR 22 CO 0.08 -0.59 1.40 -2.30 -1.52 0.00 0.00 175.55 172.62 2cy6 n PRO 23 N -0.10 2.02 -3.54 -3.49 -0.02 -1.26 -4.36 135.00 124.26 2cy6 n PRO 23 Ca -0.12 0.73 -0.11 0.00 -2.02 0.00 0.00 63.50 61.98 2cy6 n PRO 23 Cb 0.63 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 2cy6 n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2cy6 s HIS 24 N -1.23 -0.37 0.05 6.00 -3.43 -0.09 -0.40 115.29 115.82 2cy6 s HIS 24 Ca 0.65 0.10 0.02 0.00 -0.80 0.00 0.00 55.06 55.03 2cy6 s HIS 24 Cb -0.44 0.42 -0.04 0.00 -1.43 0.00 0.00 32.58 31.10 2cy6 s HIS 24 CO 0.54 -0.79 0.10 0.96 -2.00 0.00 0.00 174.74 173.54 2cy6 s ILE 25 N -3.78 4.69 0.08 -5.38 -4.36 0.03 0.07 121.20 112.54 2cy6 s ILE 25 Ca 0.02 -0.62 -0.11 0.00 -0.26 0.00 0.00 60.65 59.68 2cy6 s ILE 25 Cb 0.00 -3.23 0.01 0.00 1.25 0.00 0.00 42.46 40.49 2cy6 s ILE 25 CO -0.12 0.19 0.25 -0.83 0.24 0.00 0.00 174.94 174.67 2cy6 s GLY 26 N -2.23 -0.02 -0.22 6.27 0.00 0.34 -0.52 107.32 110.95 2cy6 s GLY 26 Ca 0.28 -0.35 -0.07 0.00 0.00 0.00 0.00 44.72 44.58 2cy6 s GLY 26 CO 0.21 -0.56 0.07 -0.42 0.00 0.00 0.00 173.10 172.40 2cy6 s ILE 27 N -3.43 4.58 -0.23 0.90 1.01 -0.04 -0.03 121.20 123.96 2cy6 s ILE 27 Ca 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 60.65 60.56 2cy6 s ILE 27 Cb 0.02 -3.10 0.03 0.00 0.01 0.00 0.00 42.46 39.42 2cy6 s ILE 27 CO -0.09 0.40 -0.09 -1.81 0.00 0.00 0.00 174.94 173.35 2cy6 s ASP 28 N 0.98 4.10 -0.34 3.58 1.01 0.81 -0.65 116.67 126.16 2cy6 s ASP 28 Ca 0.04 -0.85 0.02 0.00 0.71 0.00 0.00 52.55 52.47 2cy6 s ASP 28 Cb -0.14 -1.62 0.10 0.00 1.01 0.00 0.00 42.92 42.27 2cy6 s ASP 28 CO 0.03 -0.10 0.06 -0.63 0.21 0.00 0.00 175.17 174.74 2cy6 s ILE 29 N 1.31 2.48 -0.38 0.77 -1.09 -1.26 -0.35 121.20 122.67 2cy6 s ILE 29 Ca 0.01 -2.21 0.00 0.00 -2.23 0.00 0.00 60.65 56.22 2cy6 s ILE 29 Cb -0.16 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.96 2cy6 s ILE 29 CO -0.06 -0.56 0.00 0.29 -1.23 0.00 0.00 174.94 173.38 2cy6 n LYS 30 N 4.34 -1.00 -3.58 2.79 5.02 0.12 -4.93 118.16 120.92 2cy6 n LYS 30 Ca 0.01 0.47 -0.16 0.00 -2.02 0.00 0.00 58.31 56.62 2cy6 n LYS 30 Cb 0.42 -4.34 -0.06 0.00 -0.02 0.00 0.00 35.03 31.02 2cy6 n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2cy6 s SER 31 N -2.28 -0.68 0.59 4.39 0.15 -1.26 -4.95 113.70 109.67 2cy6 s SER 31 Ca 0.00 1.04 0.37 0.00 0.70 0.00 0.00 55.95 58.07 2cy6 s SER 31 Cb 0.00 0.97 1.80 0.00 -1.71 0.00 0.00 66.02 67.07 2cy6 s SER 31 CO 0.00 -0.42 2.15 1.62 1.20 0.00 0.00 173.24 177.79 2cy6 h VAL 32 N 3.46 0.07 -2.60 4.45 3.04 -1.88 -3.38 116.25 119.41 2cy6 h VAL 32 Ca -0.28 -0.32 -0.58 0.00 -1.01 0.00 0.00 66.70 64.51 2cy6 h VAL 32 Cb 1.15 1.29 -0.11 0.00 -2.01 0.00 0.00 31.29 31.62 2cy6 h VAL 32 CO 0.22 0.02 0.79 -0.13 -1.01 0.00 0.00 177.57 177.46 2cy6 s ARG 33 N -3.92 3.18 0.32 4.17 0.52 -1.26 -4.95 118.95 117.02 2cy6 s ARG 33 Ca -0.02 -0.47 -0.29 0.00 -0.52 0.00 0.00 55.73 54.43 2cy6 s ARG 33 Cb 0.11 -4.18 -0.12 0.00 0.52 0.00 0.00 34.95 31.28 2cy6 s ARG 33 CO 0.50 -1.93 1.43 0.43 0.02 0.00 0.00 175.30 175.75 2cy6 n SER 34 N 8.45 3.29 0.22 0.23 7.64 -1.26 -4.82 113.62 127.37 2cy6 n SER 34 Ca 0.00 1.19 0.08 0.00 1.01 0.00 0.00 58.87 61.15 2cy6 n SER 34 Cb 0.47 -1.54 0.51 0.00 -1.01 0.00 0.00 64.21 62.64 2cy6 n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2cy6 h LYS 35 N 3.47 0.00 -2.64 1.43 1.79 -1.21 -3.44 116.57 115.96 2cy6 h LYS 35 Ca -0.47 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.89 2cy6 h LYS 35 Cb 1.26 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.67 2cy6 h LYS 35 CO 0.69 0.25 -0.18 0.21 -1.08 0.00 0.00 179.45 179.35 2cy6 s LYS 36 N -4.03 0.55 0.17 3.15 2.47 -1.23 -5.00 119.74 115.81 2cy6 s LYS 36 Ca -0.02 0.59 0.00 0.00 -1.56 0.00 0.00 55.97 54.99 2cy6 s LYS 36 Cb 0.13 0.27 -0.04 0.00 -1.46 0.00 0.00 37.83 36.72 2cy6 s LYS 36 CO 0.65 -0.07 0.05 0.95 0.16 0.00 0.00 175.35 177.09 2cy6 s THR 37 N 0.15 0.35 0.01 3.43 -4.23 -1.26 -0.86 115.64 113.23 2cy6 s THR 37 Ca -0.01 -1.95 -0.08 0.00 -1.18 0.00 0.00 61.69 58.47 2cy6 s THR 37 Cb -0.03 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.63 2cy6 s THR 37 CO 0.01 -0.38 0.15 0.00 -0.54 0.00 0.00 174.62 173.86 2cy6 s ALA 38 N -3.89 -0.31 0.12 3.99 0.00 0.32 -4.96 121.76 117.03 2cy6 s ALA 38 Ca 0.27 -0.20 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 2cy6 s ALA 38 Cb 0.07 0.15 -0.09 0.00 0.00 0.00 0.00 23.12 23.26 2cy6 s ALA 38 CO 0.05 -0.25 1.47 0.21 0.00 0.00 0.00 175.76 177.24 2cy6 s LYS 39 N -1.73 4.27 -0.08 0.00 2.20 -1.26 -0.79 119.74 122.36 2cy6 s LYS 39 Ca -0.12 2.18 0.01 0.00 -0.36 0.00 0.00 55.97 57.69 2cy6 s LYS 39 Cb -0.06 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 33.02 2cy6 s LYS 39 CO 0.00 -0.53 -0.09 -0.46 -0.36 0.00 0.00 175.35 173.91 2cy6 s TRP 40 N 1.31 1.34 -0.70 4.03 -0.00 0.46 -4.72 118.94 120.66 2cy6 s TRP 40 Ca 0.67 -0.53 -0.19 0.00 -0.00 0.00 0.00 56.10 56.05 2cy6 s TRP 40 Cb -0.39 -1.05 0.12 0.00 -0.00 0.00 0.00 33.47 32.16 2cy6 s TRP 40 CO 0.30 -0.33 0.82 1.21 -0.00 0.00 0.00 176.95 178.96 2cy6 s ASN 41 N 1.02 6.35 0.12 5.86 2.47 -1.26 -3.92 114.94 125.57 2cy6 s ASN 41 Ca -0.08 -1.69 -0.31 0.00 0.42 0.00 0.00 52.86 51.20 2cy6 s ASN 41 Cb -0.15 -2.32 -0.08 0.00 -1.45 0.00 0.00 41.25 37.25 2cy6 s ASN 41 CO -0.00 -1.06 1.40 -0.32 -3.72 0.00 0.00 177.10 173.40 2cy6 s MET 42 N 2.47 4.31 -0.46 0.43 -2.45 -1.26 -4.96 119.30 117.39 2cy6 s MET 42 Ca 0.18 2.09 -0.14 0.00 -1.25 0.00 0.00 55.69 56.57 2cy6 s MET 42 Cb -0.18 -3.25 0.07 0.00 1.25 0.00 0.00 34.83 32.72 2cy6 s MET 42 CO 0.01 -0.45 0.36 -0.65 1.05 0.00 0.00 175.02 175.34 2cy6 s GLN 43 N 1.14 2.90 0.11 4.11 -0.21 -1.26 -5.02 119.66 121.44 2cy6 s GLN 43 Ca 0.65 -1.35 -0.31 0.00 0.02 0.00 0.00 55.36 54.38 2cy6 s GLN 43 Cb -0.37 -4.05 -0.10 0.00 1.00 0.00 0.00 33.01 29.49 2cy6 s GLN 43 CO 0.30 -0.99 1.83 1.21 -2.12 0.00 0.00 175.29 175.52 2cy6 s ASN 44 N 2.43 6.44 0.00 5.90 3.84 -1.26 -1.13 114.94 131.16 2cy6 s ASN 44 Ca 0.04 2.73 0.00 0.00 0.21 0.00 0.00 52.86 55.84 2cy6 s ASN 44 Cb -0.24 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 37.90 2cy6 s ASN 44 CO 0.06 -1.00 0.00 0.61 -2.79 0.00 0.00 177.10 173.98 2cy6 n GLY 45 N 4.25 0.44 3.84 1.21 0.00 0.66 -4.97 105.19 110.62 2cy6 n GLY 45 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 2cy6 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cy6 s LYS 46 N -0.47 3.08 -0.32 1.61 -0.14 -0.28 -4.95 119.74 118.28 2cy6 s LYS 46 Ca 0.00 -0.71 -0.24 0.00 -1.36 0.00 0.00 55.97 53.67 2cy6 s LYS 46 Cb 0.00 -2.79 0.00 0.00 -1.68 0.00 0.00 37.83 33.36 2cy6 s LYS 46 CO 0.00 0.53 0.81 0.08 -0.76 0.00 0.00 175.35 176.01 2cy6 s VAL 47 N -1.62 4.76 0.38 3.17 1.01 -1.26 -4.13 120.40 122.71 2cy6 s VAL 47 Ca 0.32 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.53 2cy6 s VAL 47 Cb -0.11 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.08 2cy6 s VAL 47 CO 0.25 -0.30 0.55 -0.83 0.00 0.00 0.00 175.10 174.77 2cy6 s GLY 48 N 1.65 1.58 -0.03 4.51 0.00 0.31 -4.19 107.32 111.17 2cy6 s GLY 48 Ca 0.33 -1.31 0.02 0.00 0.00 0.00 0.00 44.72 43.76 2cy6 s GLY 48 CO 0.13 -1.19 -0.07 -1.59 0.00 0.00 0.00 173.10 170.38 2cy6 s THR 49 N -2.32 0.64 -0.13 0.90 2.01 0.78 -1.51 115.64 116.02 2cy6 s THR 49 Ca 0.46 -0.27 0.03 0.00 0.31 0.00 0.00 61.69 62.22 2cy6 s THR 49 Cb -0.10 -0.59 0.01 0.00 0.01 0.00 0.00 72.50 71.83 2cy6 s THR 49 CO 0.34 0.21 -0.21 0.00 -0.69 0.00 0.00 174.62 174.26 2cy6 s ALA 50 N 0.30 2.27 -0.06 7.40 0.00 0.47 0.21 121.76 132.35 2cy6 s ALA 50 Ca -0.04 -1.06 0.05 0.00 0.00 0.00 0.00 51.96 50.91 2cy6 s ALA 50 Cb -0.09 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.03 2cy6 s ALA 50 CO 0.00 0.05 -0.20 -1.01 0.00 0.00 0.00 175.76 174.60 2cy6 s HIS 51 N 0.70 2.57 -0.05 0.00 3.76 0.03 -0.66 115.29 121.63 2cy6 s HIS 51 Ca -0.10 -0.48 0.02 0.00 -0.15 0.00 0.00 55.06 54.36 2cy6 s HIS 51 Cb -0.16 -1.63 0.01 0.00 1.11 0.00 0.00 32.58 31.91 2cy6 s HIS 51 CO 0.01 -0.05 -0.11 0.42 -0.85 0.00 0.00 174.74 174.15 2cy6 s ILE 52 N -0.35 1.00 -0.02 0.60 1.09 0.13 -1.14 121.20 122.53 2cy6 s ILE 52 Ca 0.02 -0.44 0.00 0.00 -1.10 0.00 0.00 60.65 59.14 2cy6 s ILE 52 Cb -0.12 -0.91 0.02 0.00 -1.06 0.00 0.00 42.46 40.39 2cy6 s ILE 52 CO 0.02 0.32 0.00 -0.63 -0.10 0.00 0.00 174.94 174.55 2cy6 s ILE 53 N 0.47 0.11 -0.05 2.92 1.01 0.16 -0.66 121.20 125.15 2cy6 s ILE 53 Ca -0.09 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 2cy6 s ILE 53 Cb -0.13 -0.18 0.02 0.00 0.01 0.00 0.00 42.46 42.18 2cy6 s ILE 53 CO 0.02 0.10 0.24 -0.47 0.00 0.00 0.00 174.94 174.83 2cy6 s TYR 54 N 0.68 -0.18 0.04 3.97 6.14 -0.30 -0.52 117.35 127.18 2cy6 s TYR 54 Ca -0.06 0.39 -0.03 0.00 0.64 0.00 0.00 57.07 58.00 2cy6 s TYR 54 Cb -0.09 0.06 -0.02 0.00 0.42 0.00 0.00 41.96 42.33 2cy6 s TYR 54 CO -0.01 -0.23 0.04 0.54 0.64 0.00 0.00 175.55 176.52 2cy6 s ASN 55 N -0.57 0.27 0.00 4.32 2.20 -1.26 -0.68 114.94 119.22 2cy6 s ASN 55 Ca -0.07 -0.65 0.23 0.00 -0.94 0.00 0.00 52.86 51.44 2cy6 s ASN 55 Cb -0.04 0.20 1.26 0.00 -2.00 0.00 0.00 41.25 40.66 2cy6 s ASN 55 CO 0.02 -0.49 1.75 -1.54 -2.94 0.00 0.00 177.10 173.89 2cy6 n SER 56 N 0.76 0.00 -0.10 3.54 3.41 0.14 -0.80 113.62 120.58 2cy6 n SER 56 Ca -0.19 -0.37 -0.15 0.00 -0.26 0.00 0.00 58.87 57.91 2cy6 n SER 56 Cb 0.58 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.33 2cy6 n SER 56 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2cy6 n VAL 57 N -1.15 1.49 0.20 -3.33 0.31 -1.26 -4.29 118.33 110.30 2cy6 n VAL 57 Ca 0.14 0.02 0.05 0.00 -0.01 0.00 0.00 64.34 64.54 2cy6 n VAL 57 Cb 0.13 -2.21 0.41 0.00 -0.91 0.00 0.00 33.84 31.27 2cy6 n VAL 57 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2cy6 h GLY 58 N -1.00 0.00 -6.16 2.92 0.00 -1.98 -3.47 103.07 93.38 2cy6 h GLY 58 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.68 2cy6 h GLY 58 CO -0.13 0.00 -0.84 0.28 0.00 0.00 0.00 176.54 175.85 2cy6 n LYS 59 N -3.80 -4.61 -3.75 4.80 5.02 0.02 -4.92 118.16 110.94 2cy6 n LYS 59 Ca -0.01 0.58 -0.25 0.00 -2.02 0.00 0.00 58.31 56.61 2cy6 n LYS 59 Cb 0.42 -5.06 -0.17 0.00 -0.02 0.00 0.00 35.03 30.20 2cy6 n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2cy6 s ARG 60 N -6.08 0.58 -0.22 1.97 3.52 -1.25 -1.57 118.95 115.89 2cy6 s ARG 60 Ca 0.00 -0.09 -0.27 0.00 -0.13 0.00 0.00 55.73 55.23 2cy6 s ARG 60 Cb -0.00 -1.44 0.00 0.00 -1.56 0.00 0.00 34.95 31.95 2cy6 s ARG 60 CO 0.83 -0.45 0.95 -1.17 -0.81 0.00 0.00 175.30 174.65 2cy6 s LEU 61 N 1.95 4.11 0.09 -0.88 2.96 0.11 -4.29 118.68 122.72 2cy6 s LEU 61 Ca 0.03 1.26 0.09 0.00 -0.22 0.00 0.00 54.13 55.29 2cy6 s LEU 61 Cb -0.14 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 2cy6 s LEU 61 CO -0.06 -0.58 -0.24 -0.44 -1.32 0.00 0.00 176.35 173.71 2cy6 s SER 62 N 1.23 2.90 -0.02 3.68 0.01 0.33 -0.15 113.70 121.69 2cy6 s SER 62 Ca 0.41 -0.67 -0.10 0.00 1.31 0.00 0.00 55.95 56.91 2cy6 s SER 62 Cb -0.15 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 65.88 2cy6 s SER 62 CO 0.08 0.15 0.20 0.00 0.41 0.00 0.00 173.24 174.08 2cy6 s ALA 63 N -1.01 -0.50 0.02 1.44 0.00 0.13 -0.66 121.76 121.18 2cy6 s ALA 63 Ca 0.10 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.21 2cy6 s ALA 63 Cb -0.10 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 2cy6 s ALA 63 CO 0.04 -0.21 -0.06 0.08 0.00 0.00 0.00 175.76 175.61 2cy6 s VAL 64 N -1.13 0.47 -0.06 0.00 1.01 -0.29 -1.02 120.40 119.39 2cy6 s VAL 64 Ca -0.12 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.22 2cy6 s VAL 64 Cb -0.06 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.86 2cy6 s VAL 64 CO 0.02 -0.14 -0.10 -0.69 0.00 0.00 0.00 175.10 174.19 2cy6 s VAL 65 N -0.76 0.99 0.12 2.92 1.01 0.67 -0.79 120.40 124.56 2cy6 s VAL 65 Ca -0.04 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2cy6 s VAL 65 Cb -0.06 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2cy6 s VAL 65 CO 0.00 0.33 0.04 -0.94 0.00 0.00 0.00 175.10 174.52 2cy6 s SER 66 N 0.80 0.45 0.26 3.32 1.04 0.13 -1.06 113.70 118.65 2cy6 s SER 66 Ca -0.12 -1.18 0.06 0.00 0.48 0.00 0.00 55.95 55.19 2cy6 s SER 66 Cb -0.15 0.26 -0.06 0.00 0.10 0.00 0.00 66.02 66.17 2cy6 s SER 66 CO 0.02 -0.69 -0.05 -0.31 0.98 0.00 0.00 173.24 173.19 2cy6 s TYR 67 N -3.98 1.82 0.58 5.02 2.02 -0.30 -0.15 117.35 122.35 2cy6 s TYR 67 Ca 0.22 -0.75 0.27 0.00 -0.37 0.00 0.00 57.07 56.43 2cy6 s TYR 67 Cb 0.07 -1.03 1.63 0.00 -0.40 0.00 0.00 41.96 42.23 2cy6 s TYR 67 CO 0.00 0.19 2.14 -1.35 -1.57 0.00 0.00 175.55 174.97 2cy6 h PRO 68 N 2.36 0.00 0.00 -1.71 0.11 -1.89 -1.52 132.00 129.35 2cy6 h PRO 68 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2cy6 h PRO 68 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2cy6 h PRO 68 CO 0.66 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.72 2cy6 n ASN 69 N -3.96 0.14 0.00 -2.05 2.04 -1.26 -4.85 115.26 105.32 2cy6 n ASN 69 Ca 0.00 0.53 0.00 0.00 -0.44 0.00 0.00 54.58 54.67 2cy6 n ASN 69 Cb 0.25 -0.56 0.00 0.00 -2.53 0.00 0.00 39.78 36.94 2cy6 n ASN 69 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2cy6 n GLY 70 N 0.48 1.04 3.77 4.83 0.00 -0.57 -5.08 105.19 109.65 2cy6 n GLY 70 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2cy6 n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cy6 s ASP 71 N -1.92 6.33 -0.16 1.61 2.15 -1.25 -4.78 116.67 118.65 2cy6 s ASP 71 Ca 0.00 2.56 -0.12 0.00 0.43 0.00 0.00 52.55 55.42 2cy6 s ASP 71 Cb 0.00 -2.63 0.05 0.00 -0.30 0.00 0.00 42.92 40.04 2cy6 s ASP 71 CO 0.00 -0.83 0.40 -0.55 -0.17 0.00 0.00 175.17 174.03 2cy6 s SER 72 N -0.88 -0.46 0.06 -0.34 0.15 -1.26 -1.15 113.70 109.82 2cy6 s SER 72 Ca 0.58 0.84 0.08 0.00 0.70 0.00 0.00 55.95 58.15 2cy6 s SER 72 Cb -0.36 0.79 -0.03 0.00 -1.71 0.00 0.00 66.02 64.72 2cy6 s SER 72 CO 0.45 -0.16 -0.21 0.00 1.20 0.00 0.00 173.24 174.52 2cy6 s ALA 73 N 0.76 1.83 0.06 5.45 0.00 -0.22 -4.97 121.76 124.67 2cy6 s ALA 73 Ca -0.04 -1.12 0.05 0.00 0.00 0.00 0.00 51.96 50.85 2cy6 s ALA 73 Cb -0.05 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2cy6 s ALA 73 CO -0.06 0.40 -0.15 0.99 0.00 0.00 0.00 175.76 176.95 2cy6 s THR 74 N -0.87 1.17 -0.05 0.00 2.01 -1.26 -0.24 115.64 116.40 2cy6 s THR 74 Ca 0.08 -1.17 -0.04 0.00 0.31 0.00 0.00 61.69 60.87 2cy6 s THR 74 Cb -0.09 -1.09 0.02 0.00 0.01 0.00 0.00 72.50 71.35 2cy6 s THR 74 CO 0.02 -0.09 0.13 0.54 -0.69 0.00 0.00 174.62 174.53 2cy6 s VAL 75 N -1.05 -0.02 0.02 3.82 0.11 -0.19 -4.68 120.40 118.42 2cy6 s VAL 75 Ca 0.01 0.06 0.04 0.00 -2.93 0.00 0.00 61.98 59.15 2cy6 s VAL 75 Cb -0.09 -0.20 -0.02 0.00 -1.53 0.00 0.00 36.38 34.54 2cy6 s VAL 75 CO 0.02 0.02 -0.11 -0.44 -3.33 0.00 0.00 175.10 171.26 2cy6 s SER 76 N 0.43 1.29 -0.04 3.54 0.01 -1.26 -0.69 113.70 116.98 2cy6 s SER 76 Ca -0.03 -0.37 -0.01 0.00 1.31 0.00 0.00 55.95 56.85 2cy6 s SER 76 Cb -0.04 -0.08 0.03 0.00 0.21 0.00 0.00 66.02 66.14 2cy6 s SER 76 CO -0.02 0.02 0.08 -0.47 0.41 0.00 0.00 173.24 173.26 2cy6 s TYR 77 N -0.72 -0.06 -0.30 2.43 5.04 0.79 -4.95 117.35 119.58 2cy6 s TYR 77 Ca 0.00 0.28 -0.27 0.00 -2.44 0.00 0.00 57.07 54.64 2cy6 s TYR 77 Cb -0.07 -0.15 0.01 0.00 0.35 0.00 0.00 41.96 42.10 2cy6 s TYR 77 CO 0.01 -0.12 0.99 -0.51 -1.34 0.00 0.00 175.55 174.58 2cy6 s ASP 78 N 1.04 6.88 -0.12 4.32 1.01 -1.26 -0.72 116.67 127.83 2cy6 s ASP 78 Ca -0.08 0.99 -0.25 0.00 0.71 0.00 0.00 52.55 53.91 2cy6 s ASP 78 Cb -0.11 -2.51 0.06 0.00 1.01 0.00 0.00 42.92 41.37 2cy6 s ASP 78 CO -0.04 -0.78 0.61 0.54 0.21 0.00 0.00 175.17 175.71 2cy6 s VAL 79 N 3.40 0.01 -0.71 -1.27 0.11 -0.61 -4.98 120.40 116.34 2cy6 s VAL 79 Ca 0.42 -0.07 -0.15 0.00 -2.93 0.00 0.00 61.98 59.25 2cy6 s VAL 79 Cb -0.13 -0.90 0.18 0.00 -1.53 0.00 0.00 36.38 34.00 2cy6 s VAL 79 CO 0.13 -0.04 0.66 -0.62 -3.33 0.00 0.00 175.10 171.91 2cy6 s ASP 80 N -0.63 6.53 0.64 3.54 -1.08 -1.26 -4.19 116.67 120.22 2cy6 s ASP 80 Ca -0.07 -2.32 0.42 0.00 -0.52 0.00 0.00 52.55 50.06 2cy6 s ASP 80 Cb -0.02 -2.21 2.16 0.00 -1.46 0.00 0.00 42.92 41.38 2cy6 s ASP 80 CO 0.06 -0.69 2.27 -0.07 0.52 0.00 0.00 175.17 177.26 2cy6 h LEU 81 N 8.25 0.00 -1.56 -1.34 3.38 -1.96 0.67 115.31 122.76 2cy6 h LEU 81 Ca -0.06 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.03 2cy6 h LEU 81 Cb 1.06 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.77 2cy6 h LEU 81 CO 0.87 0.00 0.47 0.44 0.09 0.00 0.00 178.44 180.31 2cy6 h ASP 82 N 0.00 0.43 -0.02 -0.43 3.32 -1.91 0.36 116.42 118.16 2cy6 h ASP 82 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2cy6 h ASP 82 Cb 0.14 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2cy6 h ASP 82 CO 0.00 0.24 0.00 0.59 -1.72 0.00 0.00 179.24 178.35 2cy6 n ASN 83 N -4.48 0.53 0.00 6.45 3.02 0.23 -4.49 115.26 116.52 2cy6 n ASN 83 Ca 0.13 -1.29 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 2cy6 n ASN 83 Cb 0.44 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 2cy6 n ASN 83 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 2cy6 n VAL 84 N -0.53 0.00 -3.01 2.41 3.14 -0.61 -5.07 118.33 114.66 2cy6 n VAL 84 Ca 0.20 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.25 2cy6 n VAL 84 Cb 0.18 -0.99 -0.06 0.00 -1.06 0.00 0.00 33.84 31.90 2cy6 n VAL 84 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2cy6 s LEU 85 N -5.39 4.05 0.77 6.55 1.43 0.02 -4.98 118.68 121.12 2cy6 s LEU 85 Ca 0.00 1.46 -0.11 0.00 -1.03 0.00 0.00 54.13 54.44 2cy6 s LEU 85 Cb 0.00 -4.21 0.06 0.00 0.03 0.00 0.00 46.19 42.07 2cy6 s LEU 85 CO 0.00 -0.24 1.11 -2.16 0.23 0.00 0.00 176.35 175.29 2cy6 s PRO 86 N -2.95 2.18 0.23 1.29 0.04 -1.26 -4.81 135.00 129.71 2cy6 s PRO 86 Ca 0.56 1.28 -0.08 0.00 0.04 0.00 0.00 61.00 62.81 2cy6 s PRO 86 Cb -0.11 -1.88 0.24 0.00 0.04 0.00 0.00 34.50 32.80 2cy6 s PRO 86 CO 0.16 -1.72 1.87 1.49 0.04 0.00 0.00 177.00 178.84 2cy6 h GLU 87 N -0.99 0.99 -6.11 4.56 4.81 -1.95 -3.40 114.58 112.49 2cy6 h GLU 87 Ca -0.44 -0.06 -0.68 0.00 -0.13 0.00 0.00 59.36 58.05 2cy6 h GLU 87 Cb 1.24 -0.22 -0.18 0.00 0.63 0.00 0.00 28.75 30.22 2cy6 h GLU 87 CO 0.50 0.66 -0.68 -1.58 -0.73 0.00 0.00 179.01 177.18 2cy6 s TRP 88 N -6.10 2.99 0.24 0.92 0.52 -1.26 -0.37 118.94 115.88 2cy6 s TRP 88 Ca -0.13 0.06 0.01 0.00 0.02 0.00 0.00 56.10 56.07 2cy6 s TRP 88 Cb 0.17 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.72 2cy6 s TRP 88 CO 0.79 0.37 0.15 0.14 0.02 0.00 0.00 176.95 178.42 2cy6 s VAL 89 N -0.84 0.12 0.17 4.03 -7.23 0.20 -4.23 120.40 112.62 2cy6 s VAL 89 Ca 0.13 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.40 2cy6 s VAL 89 Cb -0.11 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2cy6 s VAL 89 CO 0.02 0.00 -0.22 -0.13 -0.31 0.00 0.00 175.10 174.46 2cy6 s ARG 90 N -3.98 1.41 0.08 4.82 0.52 0.43 -0.06 118.95 122.18 2cy6 s ARG 90 Ca 0.39 -1.45 0.09 0.00 -0.52 0.00 0.00 55.73 54.23 2cy6 s ARG 90 Cb 0.06 -1.67 -0.04 0.00 0.52 0.00 0.00 34.95 33.83 2cy6 s ARG 90 CO 0.16 0.36 -0.22 0.14 0.02 0.00 0.00 175.30 175.75 2cy6 s VAL 91 N -1.70 2.52 0.34 3.52 -7.23 -1.26 -0.67 120.40 115.92 2cy6 s VAL 91 Ca 0.18 -1.46 -0.17 0.00 -1.81 0.00 0.00 61.98 58.71 2cy6 s VAL 91 Cb -0.08 -2.09 0.06 0.00 0.56 0.00 0.00 36.38 34.84 2cy6 s VAL 91 CO 0.08 0.22 0.83 -0.83 -0.31 0.00 0.00 175.10 175.09 2cy6 s GLY 92 N -1.74 0.29 0.06 2.32 0.00 0.20 -1.11 107.32 107.35 2cy6 s GLY 92 Ca 0.15 -0.64 0.09 0.00 0.00 0.00 0.00 44.72 44.32 2cy6 s GLY 92 CO 0.06 0.16 -0.26 1.08 0.00 0.00 0.00 173.10 174.14 2cy6 s LEU 93 N -3.11 2.23 0.03 0.66 1.43 0.97 -0.23 118.68 120.65 2cy6 s LEU 93 Ca 0.16 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2cy6 s LEU 93 Cb -0.05 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.86 2cy6 s LEU 93 CO 0.10 0.24 -0.05 -0.55 0.23 0.00 0.00 176.35 176.32 2cy6 s SER 94 N -1.42 0.56 0.11 2.29 0.15 0.49 -0.22 113.70 115.66 2cy6 s SER 94 Ca 0.12 -0.56 -0.18 0.00 0.70 0.00 0.00 55.95 56.03 2cy6 s SER 94 Cb -0.10 0.08 0.04 0.00 -1.71 0.00 0.00 66.02 64.33 2cy6 s SER 94 CO 0.03 -0.28 0.43 0.00 1.20 0.00 0.00 173.24 174.63 2cy6 s ALA 95 N -1.61 -1.05 0.06 5.45 0.00 0.04 -0.41 121.76 124.24 2cy6 s ALA 95 Ca -0.11 0.12 -0.05 0.00 0.00 0.00 0.00 51.96 51.92 2cy6 s ALA 95 Cb -0.09 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 2cy6 s ALA 95 CO -0.01 -0.61 0.10 -1.54 0.00 0.00 0.00 175.76 173.69 2cy6 s SER 96 N -2.60 0.23 0.29 0.00 1.04 -1.08 -1.65 113.70 109.93 2cy6 s SER 96 Ca 0.01 -0.67 0.06 0.00 0.48 0.00 0.00 55.95 55.83 2cy6 s SER 96 Cb 0.01 0.25 -0.06 0.00 0.10 0.00 0.00 66.02 66.33 2cy6 s SER 96 CO -0.10 -0.60 -0.04 0.42 0.98 0.00 0.00 173.24 173.90 2cy6 s THR 97 N -3.28 1.62 0.00 2.02 -4.23 0.83 -0.21 115.64 112.39 2cy6 s THR 97 Ca 0.01 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2cy6 s THR 97 Cb 0.03 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2cy6 s THR 97 CO -0.08 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.35 2cy6 n GLY 98 N -0.61 3.40 0.11 3.99 0.00 -1.26 0.01 105.19 110.83 2cy6 n GLY 98 Ca -0.05 -0.40 -0.03 0.00 0.00 0.00 0.00 46.02 45.54 2cy6 n GLY 98 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cy6 h LEU 99 N 0.00 0.00 -9.75 0.99 4.07 -1.96 0.12 115.31 108.78 2cy6 h LEU 99 Ca 0.00 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.43 2cy6 h LEU 99 Cb 0.00 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 41.67 2cy6 h LEU 99 CO 0.00 0.75 -0.57 -0.31 -1.08 0.00 0.00 178.44 177.22 2cy6 s TYR 100 N -3.29 2.87 0.25 1.13 2.02 -1.26 -4.97 117.35 114.10 2cy6 s TYR 100 Ca -0.00 -0.20 -0.06 0.00 -0.37 0.00 0.00 57.07 56.43 2cy6 s TYR 100 Cb 0.12 -1.36 -0.02 0.00 -0.40 0.00 0.00 41.96 40.30 2cy6 s TYR 100 CO 0.78 0.52 0.35 -1.59 -1.57 0.00 0.00 175.55 174.05 2cy6 s LYS 101 N -3.78 1.50 -0.16 -0.62 -2.85 -1.21 -4.34 119.74 108.27 2cy6 s LYS 101 Ca 0.33 -1.49 -0.32 0.00 -1.00 0.00 0.00 55.97 53.49 2cy6 s LYS 101 Cb -0.06 0.39 0.14 0.00 -2.06 0.00 0.00 37.83 36.24 2cy6 s LYS 101 CO 0.23 -0.59 1.13 -1.83 0.10 0.00 0.00 175.35 174.39 2cy6 s GLU 102 N -3.87 0.43 0.37 1.78 -1.05 -1.05 -3.43 118.70 111.86 2cy6 s GLU 102 Ca 0.30 -0.07 -0.25 0.00 -0.15 0.00 0.00 54.97 54.80 2cy6 s GLU 102 Cb 0.02 0.20 -0.09 0.00 -0.44 0.00 0.00 34.13 33.82 2cy6 s GLU 102 CO 0.13 -0.17 1.05 0.95 0.95 0.00 0.00 175.26 178.17 2cy6 s THR 103 N -2.04 3.71 -0.56 1.83 -4.23 0.10 -4.69 115.64 109.75 2cy6 s THR 103 Ca 0.06 1.40 0.07 0.00 -1.18 0.00 0.00 61.69 62.03 2cy6 s THR 103 Cb -0.01 -3.77 0.27 0.00 1.34 0.00 0.00 72.50 70.33 2cy6 s THR 103 CO -0.05 0.10 0.73 0.59 -0.54 0.00 0.00 174.62 175.45 2cy6 n ASN 104 N 0.24 2.95 -4.71 3.99 4.13 -1.26 -3.67 115.26 116.93 2cy6 n ASN 104 Ca 0.03 -3.30 -0.37 0.00 1.68 0.00 0.00 54.58 52.63 2cy6 n ASN 104 Cb 0.49 -0.65 -0.07 0.00 -1.54 0.00 0.00 39.78 38.01 2cy6 n ASN 104 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2cy6 s THR 105 N -2.47 5.26 -0.20 3.41 2.01 -1.07 -1.06 115.64 121.52 2cy6 s THR 105 Ca 0.40 0.68 -0.06 0.00 0.31 0.00 0.00 61.69 63.02 2cy6 s THR 105 Cb 0.18 -3.70 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 2cy6 s THR 105 CO -0.05 0.35 0.03 -0.63 -0.69 0.00 0.00 174.62 173.63 2cy6 s ILE 106 N 0.67 4.34 -0.11 1.82 -1.09 0.12 -0.37 121.20 126.57 2cy6 s ILE 106 Ca 0.19 -0.18 0.20 0.00 -2.23 0.00 0.00 60.65 58.63 2cy6 s ILE 106 Cb -0.14 -2.97 -0.27 0.00 -1.58 0.00 0.00 42.46 37.51 2cy6 s ILE 106 CO 0.06 0.43 0.42 0.18 -1.23 0.00 0.00 174.94 174.80 2cy6 n LEU 107 N 4.03 0.14 -3.51 2.97 4.32 0.01 0.02 117.00 124.98 2cy6 n LEU 107 Ca -0.17 0.06 -0.15 0.00 -0.02 0.00 0.00 56.01 55.74 2cy6 n LEU 107 Cb 0.52 0.17 -0.05 0.00 -1.62 0.00 0.00 43.42 42.44 2cy6 n LEU 107 CO 0.33 0.17 0.52 -0.94 -1.22 0.00 0.00 177.39 176.24 2cy6 s SER 108 N -5.02 -0.56 -0.24 -1.43 1.04 -1.22 -4.34 113.70 101.93 2cy6 s SER 108 Ca -0.08 0.45 -0.10 0.00 0.48 0.00 0.00 55.95 56.71 2cy6 s SER 108 Cb 0.11 0.49 0.10 0.00 0.10 0.00 0.00 66.02 66.82 2cy6 s SER 108 CO 0.87 -0.63 0.55 0.86 0.98 0.00 0.00 173.24 175.86 2cy6 s TRP 109 N -1.85 -1.01 0.18 5.02 -0.00 0.61 -0.84 118.94 121.05 2cy6 s TRP 109 Ca -0.05 1.88 0.09 0.00 -0.00 0.00 0.00 56.10 58.01 2cy6 s TRP 109 Cb -0.00 0.53 -0.04 0.00 -0.00 0.00 0.00 33.47 33.96 2cy6 s TRP 109 CO 0.02 -0.53 -0.18 -1.54 -0.00 0.00 0.00 176.95 174.71 2cy6 s SER 110 N 2.36 2.76 -0.17 5.86 1.04 0.26 0.28 113.70 126.08 2cy6 s SER 110 Ca -0.06 -0.88 -0.15 0.00 0.48 0.00 0.00 55.95 55.33 2cy6 s SER 110 Cb -0.10 -0.17 0.05 0.00 0.10 0.00 0.00 66.02 65.90 2cy6 s SER 110 CO -0.16 -0.03 0.46 0.12 0.98 0.00 0.00 173.24 174.60 2cy6 s PHE 111 N -2.13 -0.53 -0.05 5.02 5.36 0.04 -1.36 117.98 124.34 2cy6 s PHE 111 Ca 0.17 1.26 -0.00 0.00 -0.96 0.00 0.00 56.93 57.40 2cy6 s PHE 111 Cb -0.05 0.19 0.03 0.00 -0.34 0.00 0.00 43.02 42.84 2cy6 s PHE 111 CO 0.07 -0.26 -0.01 0.99 -1.46 0.00 0.00 175.22 174.56 2cy6 s THR 112 N 0.38 0.31 0.13 0.12 2.01 -0.06 -0.57 115.64 117.96 2cy6 s THR 112 Ca -0.01 0.06 0.10 0.00 0.31 0.00 0.00 61.69 62.15 2cy6 s THR 112 Cb -0.04 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 72.02 2cy6 s THR 112 CO -0.01 0.20 -0.24 -0.94 -0.69 0.00 0.00 174.62 172.94 2cy6 s SER 113 N 1.35 3.02 -0.06 3.53 1.04 -0.11 -0.59 113.70 121.87 2cy6 s SER 113 Ca -0.05 -0.74 -0.05 0.00 0.48 0.00 0.00 55.95 55.59 2cy6 s SER 113 Cb -0.13 -0.19 0.02 0.00 0.10 0.00 0.00 66.02 65.82 2cy6 s SER 113 CO -0.02 0.12 0.16 -0.54 0.98 0.00 0.00 173.24 173.94 2cy6 s LYS 114 N -2.10 0.16 -0.25 4.02 1.02 -0.52 -0.90 119.74 121.17 2cy6 s LYS 114 Ca 0.12 0.28 -0.01 0.00 0.02 0.00 0.00 55.97 56.38 2cy6 s LYS 114 Cb -0.10 0.00 0.03 0.00 -0.52 0.00 0.00 37.83 37.25 2cy6 s LYS 114 CO 0.06 -0.07 -0.08 -0.51 -0.92 0.00 0.00 175.35 173.83 2cy6 s LEU 115 N 0.46 3.18 0.14 3.17 1.43 0.11 -1.09 118.68 126.08 2cy6 s LEU 115 Ca -0.03 -0.95 0.06 0.00 -1.03 0.00 0.00 54.13 52.18 2cy6 s LEU 115 Cb -0.05 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 2cy6 s LEU 115 CO -0.02 -0.13 -0.00 -0.54 0.23 0.00 0.00 176.35 175.88 2cy6 s LYS 116 N 1.29 2.46 0.37 1.70 1.02 0.20 -1.30 119.74 125.47 2cy6 s LYS 116 Ca -0.01 -0.98 0.04 0.00 0.02 0.00 0.00 55.97 55.04 2cy6 s LYS 116 Cb -0.17 -2.44 -0.05 0.00 -0.52 0.00 0.00 37.83 34.65 2cy6 s LYS 116 CO -0.05 0.49 0.07 0.45 -0.92 0.00 0.00 175.35 175.39 2cy6 s SER 117 N -2.64 2.72 0.00 2.83 0.15 -1.14 0.31 113.70 115.92 2cy6 s SER 117 Ca 0.26 -1.47 0.00 0.00 0.70 0.00 0.00 55.95 55.44 2cy6 s SER 117 Cb -0.10 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.30 2cy6 s SER 117 CO 0.18 -0.70 0.00 -0.46 1.20 0.00 0.00 173.24 173.47 2cy6 n ASN 118 N -0.90 0.00 0.00 5.45 2.04 -1.26 -3.69 115.26 116.90 2cy6 n ASN 118 Ca -0.05 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.09 2cy6 n ASN 118 Cb 0.66 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.91 2cy6 n ASN 118 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 2cy6 n SER 119 N 0.24 0.00 0.00 0.53 7.64 -1.26 -5.15 113.62 115.62 2cy6 n SER 119 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2cy6 n SER 119 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2cy6 n SER 119 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2cy6 n THR 120 N -0.54 0.00 -1.00 0.44 -1.04 -1.24 -4.99 114.28 105.91 2cy6 n THR 120 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2cy6 n THR 120 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2cy6 n THR 120 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2cy6 n HIS 121 N 0.00 0.00 -1.72 -1.42 8.25 -1.26 -4.89 115.22 114.18 2cy6 n HIS 121 Ca 0.00 -0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 2cy6 n HIS 121 Cb 0.00 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 2cy6 n HIS 121 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2cy6 s GLU 122 N -0.00 3.70 -0.12 -0.41 -1.05 -1.26 -4.93 118.70 114.63 2cy6 s GLU 122 Ca 0.00 2.24 -0.14 0.00 -0.15 0.00 0.00 54.97 56.93 2cy6 s GLU 122 Cb 0.00 -4.22 0.04 0.00 -0.44 0.00 0.00 34.13 29.50 2cy6 s GLU 122 CO 0.00 -1.45 0.38 0.99 0.95 0.00 0.00 175.26 176.12 2cy6 s THR 123 N 6.06 0.01 -0.10 1.83 2.01 -1.26 -2.88 115.64 121.31 2cy6 s THR 123 Ca 0.90 -0.07 -0.11 0.00 0.31 0.00 0.00 61.69 62.73 2cy6 s THR 123 Cb -0.36 -0.56 -0.05 0.00 0.01 0.00 0.00 72.50 71.55 2cy6 s THR 123 CO 0.37 -0.04 0.25 0.20 -0.69 0.00 0.00 174.62 174.71 2cy6 s ASN 124 N -0.05 6.51 -0.10 3.53 -0.87 -0.42 -4.98 114.94 118.56 2cy6 s ASN 124 Ca -0.02 0.61 -0.11 0.00 -1.57 0.00 0.00 52.86 51.77 2cy6 s ASN 124 Cb -0.03 -2.15 0.03 0.00 -0.02 0.00 0.00 41.25 39.08 2cy6 s ASN 124 CO 0.01 0.31 0.29 0.00 -2.57 0.00 0.00 177.10 175.15 2cy6 s ALA 125 N -0.67 -0.73 -0.09 0.60 0.00 -1.26 0.08 121.76 119.69 2cy6 s ALA 125 Ca 0.17 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.92 2cy6 s ALA 125 Cb -0.13 -0.40 -0.00 0.00 0.00 0.00 0.00 23.12 22.58 2cy6 s ALA 125 CO 0.06 -0.16 -0.24 -1.17 0.00 0.00 0.00 175.76 174.26 2cy6 s LEU 126 N -0.07 2.12 -0.05 0.00 2.96 -0.08 -4.99 118.68 118.56 2cy6 s LEU 126 Ca -0.02 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.36 2cy6 s LEU 126 Cb -0.03 -1.41 0.02 0.00 0.50 0.00 0.00 46.19 45.27 2cy6 s LEU 126 CO 0.01 0.18 -0.04 -2.28 -1.32 0.00 0.00 176.35 172.90 2cy6 s HIS 127 N 0.21 0.76 0.11 5.38 5.65 -1.26 -0.94 115.29 125.19 2cy6 s HIS 127 Ca -0.15 -0.22 0.05 0.00 0.25 0.00 0.00 55.06 55.00 2cy6 s HIS 127 Cb -0.17 -0.70 -0.04 0.00 -1.18 0.00 0.00 32.58 30.49 2cy6 s HIS 127 CO 0.07 -0.22 -0.13 -0.59 -0.65 0.00 0.00 174.74 173.23 2cy6 s PHE 128 N 1.08 1.27 -0.05 3.88 -0.12 0.27 -5.00 117.98 119.31 2cy6 s PHE 128 Ca -0.08 -0.57 -0.03 0.00 -0.05 0.00 0.00 56.93 56.20 2cy6 s PHE 128 Cb -0.14 -0.68 0.02 0.00 -0.63 0.00 0.00 43.02 41.60 2cy6 s PHE 128 CO -0.01 0.09 0.12 0.54 -0.05 0.00 0.00 175.22 175.91 2cy6 s VAL 129 N -2.08 -0.03 -0.25 -2.49 0.11 -1.26 -0.78 120.40 113.62 2cy6 s VAL 129 Ca 0.06 0.09 0.02 0.00 -2.93 0.00 0.00 61.98 59.23 2cy6 s VAL 129 Cb -0.05 -0.19 0.05 0.00 -1.53 0.00 0.00 36.38 34.66 2cy6 s VAL 129 CO 0.02 0.04 -0.12 -0.36 -3.33 0.00 0.00 175.10 171.35 2cy6 s PHE 130 N 0.61 3.18 -0.62 1.54 0.08 0.14 -4.92 117.98 117.99 2cy6 s PHE 130 Ca -0.05 -2.17 0.21 0.00 0.12 0.00 0.00 56.93 55.04 2cy6 s PHE 130 Cb -0.06 -1.94 -0.26 0.00 -0.57 0.00 0.00 43.02 40.18 2cy6 s PHE 130 CO -0.03 -0.86 0.73 0.09 -0.10 0.00 0.00 175.22 175.05 2cy6 n ASN 131 N 4.48 0.66 -3.81 1.36 3.02 -1.26 -0.29 115.26 119.42 2cy6 n ASN 131 Ca -0.15 -0.62 -0.13 0.00 -0.03 0.00 0.00 54.58 53.65 2cy6 n ASN 131 Cb 0.44 1.36 -0.14 0.00 -0.61 0.00 0.00 39.78 40.83 2cy6 n ASN 131 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2cy6 s GLN 132 N -3.14 0.08 -0.06 3.52 -1.52 -1.26 -4.64 119.66 112.63 2cy6 s GLN 132 Ca 0.02 0.18 -0.03 0.00 -1.95 0.00 0.00 55.36 53.58 2cy6 s GLN 132 Cb 0.15 -0.04 -0.04 0.00 -0.22 0.00 0.00 33.01 32.86 2cy6 s GLN 132 CO 0.86 -0.06 0.10 -0.06 -0.25 0.00 0.00 175.29 175.88 2cy6 s PHE 133 N 0.41 3.41 0.33 0.91 0.40 0.55 -5.00 117.98 118.99 2cy6 s PHE 133 Ca -0.03 0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 56.61 2cy6 s PHE 133 Cb -0.04 -1.83 -0.04 0.00 0.51 0.00 0.00 43.02 41.61 2cy6 s PHE 133 CO -0.02 0.61 0.58 -1.12 0.70 0.00 0.00 175.22 175.98 2cy6 s SER 134 N -1.37 6.37 0.31 1.36 0.01 -1.26 -3.87 113.70 115.23 2cy6 s SER 134 Ca 0.19 0.64 0.07 0.00 1.31 0.00 0.00 55.95 58.16 2cy6 s SER 134 Cb -0.12 -2.11 0.79 0.00 0.21 0.00 0.00 66.02 64.78 2cy6 s SER 134 CO 0.09 -0.28 1.75 0.50 0.41 0.00 0.00 173.24 175.71 2cy6 h LYS 135 N 1.16 0.62 -2.79 12.44 3.11 -1.72 -3.14 116.57 126.24 2cy6 h LYS 135 Ca -0.48 -0.04 -0.63 0.00 -2.81 0.00 0.00 60.65 56.69 2cy6 h LYS 135 Cb 1.20 -0.14 -0.41 0.00 -1.00 0.00 0.00 32.23 31.88 2cy6 h LYS 135 CO 0.64 0.41 -0.48 -3.47 -2.81 0.00 0.00 179.45 173.74 2cy6 n ASP 136 N -4.86 3.55 -4.50 4.20 2.03 -1.26 -4.67 116.55 111.05 2cy6 n ASP 136 Ca 0.24 -3.30 -0.43 0.00 0.52 0.00 0.00 54.79 51.83 2cy6 n ASP 136 Cb 0.65 -0.78 -0.03 0.00 -0.72 0.00 0.00 41.12 40.24 2cy6 n ASP 136 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2cy6 s GLN 137 N -1.87 3.55 0.36 -0.67 2.00 -1.18 -4.84 119.66 117.00 2cy6 s GLN 137 Ca 0.31 -1.41 0.27 0.00 -2.00 0.00 0.00 55.36 52.53 2cy6 s GLN 137 Cb 0.03 -5.01 1.03 0.00 0.80 0.00 0.00 33.01 29.85 2cy6 s GLN 137 CO -0.10 -1.95 1.80 0.87 -0.50 0.00 0.00 175.29 175.40 2cy6 h LYS 138 N 9.29 0.00 -0.39 1.67 1.57 -1.94 -2.04 116.57 124.72 2cy6 h LYS 138 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2cy6 h LYS 138 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2cy6 h LYS 138 CO 1.24 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.72 2cy6 n ASP 139 N -2.57 2.37 -4.47 0.86 5.75 -1.26 -4.81 116.55 112.42 2cy6 n ASP 139 Ca 0.02 -1.94 -0.33 0.00 -0.01 0.00 0.00 54.79 52.53 2cy6 n ASP 139 Cb 0.30 -0.26 -0.13 0.00 -1.03 0.00 0.00 41.12 40.00 2cy6 n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2cy6 s LEU 140 N -1.15 2.85 -0.42 -2.12 1.43 -0.77 -1.01 118.68 117.49 2cy6 s LEU 140 Ca 0.31 -0.20 -0.19 0.00 -1.03 0.00 0.00 54.13 53.03 2cy6 s LEU 140 Cb 0.17 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.80 2cy6 s LEU 140 CO 0.23 0.28 0.55 -0.63 0.23 0.00 0.00 176.35 177.01 2cy6 s ILE 141 N -0.36 4.95 -0.05 -0.59 1.01 0.56 -4.89 121.20 121.82 2cy6 s ILE 141 Ca 0.04 -0.06 -0.23 0.00 0.00 0.00 0.00 60.65 60.40 2cy6 s ILE 141 Cb -0.12 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 2cy6 s ILE 141 CO 0.02 -0.50 0.69 -0.76 0.00 0.00 0.00 174.94 174.40 2cy6 s LEU 142 N 2.51 4.33 0.18 2.97 1.43 -1.26 -0.66 118.68 128.18 2cy6 s LEU 142 Ca 0.18 1.20 0.11 0.00 -1.03 0.00 0.00 54.13 54.58 2cy6 s LEU 142 Cb -0.15 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 2cy6 s LEU 142 CO 0.16 -0.09 -0.23 -1.10 0.23 0.00 0.00 176.35 175.33 2cy6 s GLN 143 N 0.66 1.44 5.96 1.70 -0.21 0.10 -4.96 119.66 124.36 2cy6 s GLN 143 Ca 0.37 -1.48 0.00 0.00 0.02 0.00 0.00 55.36 54.27 2cy6 s GLN 143 Cb -0.18 -1.71 0.00 0.00 1.00 0.00 0.00 33.01 32.12 2cy6 s GLN 143 CO 0.18 0.37 0.00 0.41 -2.12 0.00 0.00 175.29 174.13 2cy6 n GLY 144 N 0.31 3.50 0.22 3.09 0.00 -1.26 -1.83 105.19 109.22 2cy6 n GLY 144 Ca -0.13 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.04 2cy6 n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2cy6 n ASP 145 N 5.01 0.67 -4.77 1.61 10.43 0.23 -4.92 116.55 124.82 2cy6 n ASP 145 Ca 0.00 -1.31 -0.40 0.00 2.57 0.00 0.00 54.79 55.65 2cy6 n ASP 145 Cb 0.00 -0.01 -0.03 0.00 1.84 0.00 0.00 41.12 42.92 2cy6 n ASP 145 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2cy6 s ALA 146 N -1.98 3.45 0.05 2.24 0.00 -0.80 -4.35 121.76 120.37 2cy6 s ALA 146 Ca 0.40 1.13 -0.01 0.00 0.00 0.00 0.00 51.96 53.47 2cy6 s ALA 146 Cb 0.20 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2cy6 s ALA 146 CO 0.32 -0.48 -0.02 0.95 0.00 0.00 0.00 175.76 176.54 2cy6 s THR 147 N -1.16 0.20 0.06 0.00 -4.23 -0.19 -4.67 115.64 105.64 2cy6 s THR 147 Ca 0.48 -1.62 0.06 0.00 -1.18 0.00 0.00 61.69 59.43 2cy6 s THR 147 Cb -0.37 -1.29 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 2cy6 s THR 147 CO 0.48 -0.89 -0.10 0.42 -0.54 0.00 0.00 174.62 173.99 2cy6 s THR 148 N -3.49 3.35 0.51 3.99 -4.23 -1.26 -0.26 115.64 114.25 2cy6 s THR 148 Ca 0.03 -1.09 0.03 0.00 -1.18 0.00 0.00 61.69 59.48 2cy6 s THR 148 Cb 0.05 -2.50 -0.00 0.00 1.34 0.00 0.00 72.50 71.38 2cy6 s THR 148 CO -0.08 0.25 0.13 -0.83 -0.54 0.00 0.00 174.62 173.54 2cy6 s GLY 149 N -1.81 2.78 0.28 3.99 0.00 -0.56 -4.27 107.32 107.72 2cy6 s GLY 149 Ca 0.19 -0.80 0.24 0.00 0.00 0.00 0.00 44.72 44.34 2cy6 s GLY 149 CO 0.10 -2.10 1.53 -0.91 0.00 0.00 0.00 173.10 171.72 2cy6 h THR 150 N 1.19 0.00 0.00 0.90 1.35 -1.89 -3.10 112.91 111.36 2cy6 h THR 150 Ca -0.42 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.70 2cy6 h THR 150 Cb 1.31 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2cy6 h THR 150 CO 0.69 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.06 2cy6 n ASP 151 N -2.61 0.00 0.00 5.36 5.68 -1.26 -4.84 116.55 118.88 2cy6 n ASP 151 Ca 0.04 -0.94 0.00 0.00 -0.50 0.00 0.00 54.79 53.39 2cy6 n ASP 151 Cb 0.49 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 2cy6 n ASP 151 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cy6 n GLY 152 N 0.62 0.48 3.73 6.12 0.00 -1.21 -4.96 105.19 109.98 2cy6 n GLY 152 Ca 0.17 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 2cy6 n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cy6 s ASN 153 N -2.15 4.73 -0.30 1.61 0.01 -1.26 -0.33 114.94 117.25 2cy6 s ASN 153 Ca 0.00 -0.73 -0.08 0.00 -0.71 0.00 0.00 52.86 51.34 2cy6 s ASN 153 Cb 0.00 -0.77 -0.00 0.00 0.41 0.00 0.00 41.25 40.88 2cy6 s ASN 153 CO 0.00 -0.27 0.11 -0.22 -1.51 0.00 0.00 177.10 175.22 2cy6 s LEU 154 N -3.84 3.92 -0.45 0.60 2.96 0.10 -1.50 118.68 120.47 2cy6 s LEU 154 Ca 0.37 -0.54 -0.17 0.00 -0.22 0.00 0.00 54.13 53.57 2cy6 s LEU 154 Cb -0.03 -1.95 0.05 0.00 0.50 0.00 0.00 46.19 44.76 2cy6 s LEU 154 CO 0.23 -0.17 0.43 -1.61 -1.32 0.00 0.00 176.35 173.91 2cy6 s GLU 155 N 1.57 3.04 0.15 1.98 0.41 0.64 0.12 118.70 126.61 2cy6 s GLU 155 Ca 0.04 -1.04 -0.04 0.00 -0.41 0.00 0.00 54.97 53.53 2cy6 s GLU 155 Cb -0.17 -4.05 -0.01 0.00 -1.78 0.00 0.00 34.13 28.12 2cy6 s GLU 155 CO 0.04 -0.96 1.39 -0.07 -0.49 0.00 0.00 175.26 175.17 2cy6 h LEU 156 N 8.99 0.56 -9.67 1.80 3.38 -1.35 -0.49 115.31 118.53 2cy6 h LEU 156 Ca -0.27 -0.39 -0.58 0.00 0.09 0.00 0.00 57.88 56.73 2cy6 h LEU 156 Cb 1.11 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.59 2cy6 h LEU 156 CO 0.84 1.15 -0.59 0.42 0.09 0.00 0.00 178.44 180.35 2cy6 s THR 157 N -3.56 2.54 0.25 0.22 -4.23 -1.26 -2.52 115.64 107.08 2cy6 s THR 157 Ca -0.06 -1.91 -0.30 0.00 -1.18 0.00 0.00 61.69 58.24 2cy6 s THR 157 Cb 0.10 -2.86 -0.09 0.00 1.34 0.00 0.00 72.50 70.99 2cy6 s THR 157 CO 0.86 -0.15 1.21 -0.60 -0.54 0.00 0.00 174.62 175.40 2cy6 s ARG 158 N -3.75 4.49 -0.07 3.99 6.06 -1.26 -4.78 118.95 123.62 2cy6 s ARG 158 Ca 0.36 1.96 0.04 0.00 -2.50 0.00 0.00 55.73 55.59 2cy6 s ARG 158 Cb 0.01 -3.18 0.00 0.00 0.06 0.00 0.00 34.95 31.85 2cy6 s ARG 158 CO 0.20 -0.05 -0.18 0.08 -2.50 0.00 0.00 175.30 172.85 2cy6 s VAL 159 N -0.58 1.52 0.86 7.11 1.01 -1.26 -1.24 120.40 127.82 2cy6 s VAL 159 Ca 0.50 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 2cy6 s VAL 159 Cb -0.35 -1.33 0.11 0.00 0.00 0.00 0.00 36.38 34.81 2cy6 s VAL 159 CO 0.42 0.44 1.14 -0.94 0.00 0.00 0.00 175.10 176.16 2cy6 s SER 160 N 0.32 4.02 0.40 3.32 1.04 0.12 -4.88 113.70 118.03 2cy6 s SER 160 Ca -0.11 0.96 0.07 0.00 0.48 0.00 0.00 55.95 57.35 2cy6 s SER 160 Cb -0.15 -1.55 0.83 0.00 0.10 0.00 0.00 66.02 65.26 2cy6 s SER 160 CO 0.05 -2.23 2.04 0.77 0.98 0.00 0.00 173.24 174.84 2cy6 h SER 161 N -1.28 0.52 0.25 7.02 4.64 -2.02 0.96 113.55 123.64 2cy6 h SER 161 Ca -0.49 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2cy6 h SER 161 Cb 1.32 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2cy6 h SER 161 CO 0.63 0.36 0.00 -0.46 -0.87 0.00 0.00 176.83 176.49 2cy6 n ASN 162 N -4.47 0.00 0.00 4.97 6.94 -1.26 -4.83 115.26 116.61 2cy6 n ASN 162 Ca 0.05 0.01 0.00 0.00 -0.02 0.00 0.00 54.58 54.62 2cy6 n ASN 162 Cb 0.10 -0.25 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 2cy6 n ASN 162 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2cy6 n GLY 163 N -0.02 0.47 3.74 4.83 0.00 0.33 -5.07 105.19 109.47 2cy6 n GLY 163 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2cy6 n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cy6 s SER 164 N -2.82 7.36 0.70 1.61 0.01 -1.25 -4.71 113.70 114.60 2cy6 s SER 164 Ca 0.00 1.63 -0.16 0.00 1.31 0.00 0.00 55.95 58.73 2cy6 s SER 164 Cb 0.00 -2.53 0.02 0.00 0.21 0.00 0.00 66.02 63.72 2cy6 s SER 164 CO 0.00 -0.03 1.21 -2.16 0.41 0.00 0.00 173.24 172.67 2cy6 s PRO 165 N -0.02 2.35 0.17 12.44 0.04 -1.26 0.13 135.00 148.86 2cy6 s PRO 165 Ca 0.43 1.79 0.08 0.00 0.04 0.00 0.00 61.00 63.34 2cy6 s PRO 165 Cb -0.22 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 2cy6 s PRO 165 CO 0.27 -1.68 -0.05 -0.65 0.04 0.00 0.00 177.00 174.92 2cy6 s GLN 166 N -3.76 2.23 0.86 4.56 -1.52 -0.37 -4.81 119.66 116.84 2cy6 s GLN 166 Ca 0.75 -1.17 -0.11 0.00 -1.95 0.00 0.00 55.36 52.89 2cy6 s GLN 166 Cb -0.30 -2.26 0.16 0.00 -0.22 0.00 0.00 33.01 30.39 2cy6 s GLN 166 CO 0.42 0.45 1.19 0.20 -0.25 0.00 0.00 175.29 177.31 2cy6 s GLY 167 N -2.83 1.76 -1.57 3.09 0.00 -1.26 -4.39 107.32 102.11 2cy6 s GLY 167 Ca 0.26 -1.29 -0.03 0.00 0.00 0.00 0.00 44.72 43.65 2cy6 s GLY 167 CO 0.17 -0.63 0.16 -1.14 0.00 0.00 0.00 173.10 171.66 2cy6 n SER 168 N -3.40 0.29 -4.40 1.64 3.41 0.43 -4.84 113.62 106.74 2cy6 n SER 168 Ca 0.14 -1.22 -0.30 0.00 -0.26 0.00 0.00 58.87 57.23 2cy6 n SER 168 Cb 0.60 -1.87 -0.13 0.00 -0.26 0.00 0.00 64.21 62.55 2cy6 n SER 168 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2cy6 s SER 169 N -4.22 3.45 -0.07 4.04 0.15 -1.15 -4.94 113.70 110.96 2cy6 s SER 169 Ca 0.12 -0.60 -0.07 0.00 0.70 0.00 0.00 55.95 56.11 2cy6 s SER 169 Cb -0.07 -0.38 0.02 0.00 -1.71 0.00 0.00 66.02 63.88 2cy6 s SER 169 CO 0.98 0.22 0.20 0.54 1.20 0.00 0.00 173.24 176.39 2cy6 s VAL 170 N -0.95 0.01 0.03 4.45 0.11 -1.26 -0.12 120.40 122.67 2cy6 s VAL 170 Ca 0.14 -0.07 -0.27 0.00 -2.93 0.00 0.00 61.98 58.85 2cy6 s VAL 170 Cb -0.10 -0.31 0.09 0.00 -1.53 0.00 0.00 36.38 34.52 2cy6 s VAL 170 CO 0.05 -0.04 0.74 -0.83 -3.33 0.00 0.00 175.10 171.69 2cy6 s GLY 171 N -0.05 -0.53 0.10 6.54 0.00 -0.66 0.78 107.32 113.50 2cy6 s GLY 171 Ca -0.02 1.00 -0.03 0.00 0.00 0.00 0.00 44.72 45.68 2cy6 s GLY 171 CO 0.00 0.50 0.07 0.50 0.00 0.00 0.00 173.10 174.18 2cy6 s ARG 172 N -2.67 0.82 -0.06 2.90 0.52 -0.76 -0.78 118.95 118.92 2cy6 s ARG 172 Ca -0.01 -1.24 -0.00 0.00 -0.52 0.00 0.00 55.73 53.96 2cy6 s ARG 172 Cb -0.01 0.26 0.02 0.00 0.52 0.00 0.00 34.95 35.75 2cy6 s ARG 172 CO -0.05 -0.22 -0.03 0.00 0.02 0.00 0.00 175.30 175.02 2cy6 s ALA 173 N -3.96 0.73 0.05 2.13 0.00 0.70 0.03 121.76 121.44 2cy6 s ALA 173 Ca 0.13 -0.12 0.06 0.00 0.00 0.00 0.00 51.96 52.03 2cy6 s ALA 173 Cb 0.07 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 2cy6 s ALA 173 CO -0.05 -0.25 -0.13 -0.51 0.00 0.00 0.00 175.76 174.82 2cy6 s LEU 174 N 1.46 2.85 0.47 0.00 1.02 0.16 -0.02 118.68 124.62 2cy6 s LEU 174 Ca -0.03 -0.35 -0.23 0.00 0.02 0.00 0.00 54.13 53.54 2cy6 s LEU 174 Cb -0.13 -1.67 -0.07 0.00 0.02 0.00 0.00 46.19 44.34 2cy6 s LEU 174 CO -0.03 0.24 1.20 0.12 0.02 0.00 0.00 176.35 177.90 2cy6 s PHE 175 N -1.02 2.79 0.12 0.29 5.36 -0.27 -0.32 117.98 124.93 2cy6 s PHE 175 Ca 0.17 1.50 -0.15 0.00 -0.96 0.00 0.00 56.93 57.49 2cy6 s PHE 175 Cb -0.11 -3.46 -0.02 0.00 -0.34 0.00 0.00 43.02 39.09 2cy6 s PHE 175 CO 0.08 -1.74 1.58 -0.92 -1.46 0.00 0.00 175.22 172.75 2cy6 h TYR 176 N 2.04 0.74 -3.70 10.12 5.03 -1.42 -3.43 116.97 126.35 2cy6 h TYR 176 Ca -0.50 -0.12 -0.50 0.00 2.58 0.00 0.00 58.73 60.19 2cy6 h TYR 176 Cb 1.25 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 39.32 2cy6 h TYR 176 CO 0.52 0.75 0.31 0.00 -1.32 0.00 0.00 178.16 178.42 2cy6 s ALA 177 N -5.05 3.36 0.78 1.82 0.00 -1.26 -4.99 121.76 116.42 2cy6 s ALA 177 Ca -0.13 0.55 -0.14 0.00 0.00 0.00 0.00 51.96 52.24 2cy6 s ALA 177 Cb 0.10 -3.14 0.07 0.00 0.00 0.00 0.00 23.12 20.14 2cy6 s ALA 177 CO 0.79 0.23 1.20 -2.14 0.00 0.00 0.00 175.76 175.83 2cy6 s PRO 178 N -1.21 1.84 -0.06 0.00 0.02 -1.26 -4.77 135.00 129.55 2cy6 s PRO 178 Ca 0.40 1.71 0.05 0.00 0.02 0.00 0.00 61.00 63.18 2cy6 s PRO 178 Cb -0.25 -1.80 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 2cy6 s PRO 178 CO 0.30 -2.06 -0.22 0.08 -0.33 0.00 0.00 177.00 174.78 2cy6 s VAL 179 N -2.15 2.32 -0.76 3.83 1.01 0.91 -4.94 120.40 120.62 2cy6 s VAL 179 Ca 0.73 -0.97 -0.23 0.00 0.00 0.00 0.00 61.98 61.51 2cy6 s VAL 179 Cb -0.28 -1.87 0.07 0.00 0.00 0.00 0.00 36.38 34.31 2cy6 s VAL 179 CO 0.49 0.57 1.11 -2.28 0.00 0.00 0.00 175.10 174.99 2cy6 s HIS 180 N -0.19 2.66 -0.08 5.22 2.46 -1.26 -0.63 115.29 123.47 2cy6 s HIS 180 Ca -0.02 -0.63 0.14 0.00 0.47 0.00 0.00 55.06 55.02 2cy6 s HIS 180 Cb -0.14 -4.40 -0.16 0.00 -0.13 0.00 0.00 32.58 27.75 2cy6 s HIS 180 CO 0.03 -1.74 0.84 0.97 -2.47 0.00 0.00 174.74 172.37 2cy6 h ILE 181 N 6.05 0.72 -4.05 0.89 6.09 -0.99 -3.46 117.51 122.77 2cy6 h ILE 181 Ca -0.16 -2.36 -0.12 0.00 -1.37 0.00 0.00 64.86 60.86 2cy6 h ILE 181 Cb 1.05 2.25 -0.14 0.00 0.47 0.00 0.00 36.82 40.45 2cy6 h ILE 181 CO 1.22 0.41 -0.49 -1.66 -3.07 0.00 0.00 178.15 174.56 2cy6 s TRP 182 N -2.79 0.44 -0.24 2.19 1.48 -1.22 -4.72 118.94 114.08 2cy6 s TRP 182 Ca -0.03 -0.87 -0.15 0.00 -1.06 0.00 0.00 56.10 53.99 2cy6 s TRP 182 Cb 0.08 -0.22 0.07 0.00 -1.16 0.00 0.00 33.47 32.24 2cy6 s TRP 182 CO 0.81 -0.54 0.59 -2.00 -4.06 0.00 0.00 176.95 171.75 2cy6 s GLU 183 N -3.94 0.61 0.50 3.25 -6.30 -1.26 -4.80 118.70 106.76 2cy6 s GLU 183 Ca 0.12 1.03 0.20 0.00 -2.50 0.00 0.00 54.97 53.81 2cy6 s GLU 183 Cb 0.06 0.12 1.28 0.00 0.00 0.00 0.00 34.13 35.59 2cy6 s GLU 183 CO -0.06 -0.14 2.09 0.77 0.02 0.00 0.00 175.26 177.94 2cy6 h SER 184 N 6.77 0.00 0.86 -1.70 0.02 -2.01 -0.30 113.55 117.18 2cy6 h SER 184 Ca -0.32 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.60 2cy6 h SER 184 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 2cy6 h SER 184 CO 0.20 0.10 -0.14 -1.28 -1.14 0.00 0.00 176.83 174.57 2cy6 h SER 185 N 0.00 0.00 -3.71 3.07 0.87 -1.98 -3.46 113.55 108.35 2cy6 h SER 185 Ca -0.00 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.06 2cy6 h SER 185 Cb 0.19 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 2cy6 h SER 185 CO 0.01 0.14 0.21 0.00 -0.53 0.00 0.00 176.83 176.66 2cy6 s ALA 186 N -3.74 3.32 0.01 6.23 0.00 -0.13 -4.51 121.76 122.95 2cy6 s ALA 186 Ca 0.00 0.32 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 2cy6 s ALA 186 Cb 0.10 -2.98 -0.32 0.00 0.00 0.00 0.00 23.12 19.92 2cy6 s ALA 186 CO 0.60 0.26 0.91 0.28 0.00 0.00 0.00 175.76 177.81 2cy6 h VAL 187 N 2.68 1.20 -3.59 0.00 2.07 -0.46 -3.45 116.25 114.70 2cy6 h VAL 187 Ca -0.47 -2.71 -0.45 0.00 0.82 0.00 0.00 66.70 63.88 2cy6 h VAL 187 Cb 1.19 2.92 -0.33 0.00 -1.52 0.00 0.00 31.29 33.55 2cy6 h VAL 187 CO 0.65 0.84 -0.79 -0.69 0.02 0.00 0.00 177.57 177.59 2cy6 s VAL 188 N -2.60 0.84 -0.11 2.57 1.01 -0.94 -4.83 120.40 116.33 2cy6 s VAL 188 Ca -0.10 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2cy6 s VAL 188 Cb 0.05 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.67 2cy6 s VAL 188 CO 0.90 0.28 -0.17 0.00 0.00 0.00 0.00 175.10 176.11 2cy6 s ALA 189 N 0.55 1.80 0.05 5.51 0.00 -1.26 0.60 121.76 129.01 2cy6 s ALA 189 Ca -0.09 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.09 2cy6 s ALA 189 Cb -0.13 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 2cy6 s ALA 189 CO 0.02 -0.04 -0.08 -1.54 0.00 0.00 0.00 175.76 174.12 2cy6 s SER 190 N 0.90 0.89 0.06 0.00 1.04 -0.25 0.27 113.70 116.61 2cy6 s SER 190 Ca -0.08 -0.62 -0.04 0.00 0.48 0.00 0.00 55.95 55.69 2cy6 s SER 190 Cb -0.15 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.99 2cy6 s SER 190 CO -0.01 -0.25 0.06 0.72 0.98 0.00 0.00 173.24 174.75 2cy6 s PHE 191 N -1.73 0.32 0.02 5.02 -0.12 0.14 -1.44 117.98 120.19 2cy6 s PHE 191 Ca -0.07 -0.76 -0.06 0.00 -0.05 0.00 0.00 56.93 56.00 2cy6 s PHE 191 Cb -0.08 -0.22 -0.01 0.00 -0.63 0.00 0.00 43.02 42.08 2cy6 s PHE 191 CO -0.00 -0.41 0.10 0.16 -0.05 0.00 0.00 175.22 175.01 2cy6 s ASP 192 N -2.62 0.14 -0.07 1.98 -4.77 0.24 -1.15 116.67 110.42 2cy6 s ASP 192 Ca 0.02 -0.43 -0.11 0.00 -3.30 0.00 0.00 52.55 48.74 2cy6 s ASP 192 Cb 0.04 0.21 0.02 0.00 -1.09 0.00 0.00 42.92 42.10 2cy6 s ASP 192 CO -0.08 -0.44 0.27 0.00 0.70 0.00 0.00 175.17 175.61 2cy6 s ALA 193 N -2.11 -0.68 -0.01 2.11 0.00 0.16 -0.88 121.76 120.36 2cy6 s ALA 193 Ca -0.09 0.57 0.02 0.00 0.00 0.00 0.00 51.96 52.45 2cy6 s ALA 193 Cb -0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 2cy6 s ALA 193 CO -0.02 -0.18 -0.06 0.99 0.00 0.00 0.00 175.76 176.49 2cy6 s THR 194 N -0.41 0.50 0.02 0.00 2.01 -0.46 0.23 115.64 117.53 2cy6 s THR 194 Ca -0.05 -0.25 -0.08 0.00 0.31 0.00 0.00 61.69 61.62 2cy6 s THR 194 Cb -0.03 -0.43 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 2cy6 s THR 194 CO 0.01 0.15 0.15 0.72 -0.69 0.00 0.00 174.62 174.96 2cy6 s PHE 195 N -0.04 0.08 0.08 4.92 -0.12 0.16 -0.58 117.98 122.48 2cy6 s PHE 195 Ca 0.01 -0.26 0.07 0.00 -0.05 0.00 0.00 56.93 56.70 2cy6 s PHE 195 Cb -0.04 -0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 2cy6 s PHE 195 CO -0.00 -0.35 -0.13 0.95 -0.05 0.00 0.00 175.22 175.64 2cy6 s THR 196 N -2.00 3.14 0.06 -4.49 -4.23 -0.02 -0.39 115.64 107.70 2cy6 s THR 196 Ca -0.10 -1.24 -0.11 0.00 -1.18 0.00 0.00 61.69 59.06 2cy6 s THR 196 Cb -0.04 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.39 2cy6 s THR 196 CO -0.01 0.20 0.24 0.72 -0.54 0.00 0.00 174.62 175.22 2cy6 s PHE 197 N -1.10 0.02 -0.21 3.99 -0.71 -0.57 -0.81 117.98 118.59 2cy6 s PHE 197 Ca 0.18 -0.27 -0.04 0.00 -1.04 0.00 0.00 56.93 55.76 2cy6 s PHE 197 Cb -0.11 0.01 0.07 0.00 -1.21 0.00 0.00 43.02 41.79 2cy6 s PHE 197 CO 0.10 -0.49 0.09 -1.17 -1.34 0.00 0.00 175.22 172.41 2cy6 s LEU 198 N -2.30 0.61 -0.35 -1.99 2.96 0.50 -0.53 118.68 117.58 2cy6 s LEU 198 Ca -0.02 -0.88 -0.12 0.00 -0.22 0.00 0.00 54.13 52.89 2cy6 s LEU 198 Cb 0.01 -0.35 0.00 0.00 0.50 0.00 0.00 46.19 46.35 2cy6 s LEU 198 CO -0.06 -0.37 0.21 -0.63 -1.32 0.00 0.00 176.35 174.18 2cy6 s ILE 199 N 2.06 4.87 -0.02 6.68 1.01 -1.26 -2.60 121.20 131.95 2cy6 s ILE 199 Ca 0.04 -0.54 0.08 0.00 0.00 0.00 0.00 60.65 60.23 2cy6 s ILE 199 Cb -0.16 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.70 2cy6 s ILE 199 CO -0.18 -0.10 -0.26 -0.75 0.00 0.00 0.00 174.94 173.66 2cy6 s LYS 200 N 1.63 2.13 -0.03 2.79 2.20 -1.24 -0.24 119.74 126.99 2cy6 s LYS 200 Ca 0.04 -0.93 -0.06 0.00 -0.36 0.00 0.00 55.97 54.67 2cy6 s LYS 200 Cb -0.18 -2.05 0.01 0.00 -1.51 0.00 0.00 37.83 34.10 2cy6 s LYS 200 CO 0.08 0.56 0.14 0.45 -0.36 0.00 0.00 175.35 176.22 2cy6 s SER 201 N -0.60 -0.06 -0.06 1.43 0.15 -1.26 0.00 113.70 113.30 2cy6 s SER 201 Ca 0.10 0.04 0.11 0.00 0.70 0.00 0.00 55.95 56.89 2cy6 s SER 201 Cb -0.10 0.26 0.30 0.00 -1.71 0.00 0.00 66.02 64.76 2cy6 s SER 201 CO -0.01 -0.22 1.23 -1.54 1.20 0.00 0.00 173.24 173.91 2cy6 n SER 202 N 2.20 2.90 -4.73 5.45 3.41 -1.26 -4.94 113.62 116.65 2cy6 n SER 202 Ca -0.18 -2.42 -0.30 0.00 -0.26 0.00 0.00 58.87 55.71 2cy6 n SER 202 Cb 0.57 -0.29 0.13 0.00 -0.26 0.00 0.00 64.21 64.36 2cy6 n SER 202 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2cy6 s ASP 203 N -1.50 3.72 0.36 4.04 1.11 -1.26 -4.91 116.67 118.22 2cy6 s ASP 203 Ca 0.24 1.63 0.15 0.00 0.18 0.00 0.00 52.55 54.76 2cy6 s ASP 203 Cb 0.17 -2.31 1.04 0.00 1.07 0.00 0.00 42.92 42.90 2cy6 s ASP 203 CO 0.09 -2.51 1.72 0.28 1.18 0.00 0.00 175.17 175.93 2cy6 h SER 204 N -1.46 0.53 -3.78 0.27 0.02 -1.96 -3.39 113.55 103.79 2cy6 h SER 204 Ca -0.47 0.13 -0.13 0.00 -0.84 0.00 0.00 61.79 60.47 2cy6 h SER 204 Cb 1.27 0.05 -0.25 0.00 0.14 0.00 0.00 62.40 63.61 2cy6 h SER 204 CO 0.53 0.03 -0.28 -2.28 -1.14 0.00 0.00 176.83 173.69 2cy6 s HIS 205 N -5.62 -0.44 0.67 3.45 5.65 -1.26 -5.15 115.29 112.59 2cy6 s HIS 205 Ca -0.10 1.05 -0.15 0.00 0.25 0.00 0.00 55.06 56.11 2cy6 s HIS 205 Cb 0.27 0.16 0.00 0.00 -1.18 0.00 0.00 32.58 31.83 2cy6 s HIS 205 CO 0.80 -0.22 1.11 -1.25 -0.65 0.00 0.00 174.74 174.53 2cy6 s PRO 206 N 0.38 2.74 0.00 2.88 0.04 -1.26 -4.09 135.00 135.70 2cy6 s PRO 206 Ca -0.01 1.39 -0.28 0.00 0.04 0.00 0.00 61.00 62.14 2cy6 s PRO 206 Cb -0.04 -1.94 0.10 0.00 0.04 0.00 0.00 34.50 32.66 2cy6 s PRO 206 CO -0.01 -1.29 0.84 0.00 0.04 0.00 0.00 177.00 176.57 2cy6 s ALA 207 N -2.35 -1.79 -0.03 8.56 0.00 -1.22 -4.28 121.76 120.64 2cy6 s ALA 207 Ca 0.67 1.01 0.12 0.00 0.00 0.00 0.00 51.96 53.76 2cy6 s ALA 207 Cb -0.21 0.34 -0.18 0.00 0.00 0.00 0.00 23.12 23.07 2cy6 s ALA 207 CO 0.42 -0.64 0.23 -0.25 0.00 0.00 0.00 175.76 175.53 2cy6 n ASP 208 N -0.08 2.22 0.00 0.00 9.92 0.70 -2.53 116.55 126.78 2cy6 n ASP 208 Ca -0.11 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.15 2cy6 n ASP 208 Cb 0.62 1.45 0.00 0.00 -0.64 0.00 0.00 41.12 42.54 2cy6 n ASP 208 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2cy6 n GLY 209 N 1.88 1.00 3.10 0.44 0.00 -1.22 -1.28 105.19 109.10 2cy6 n GLY 209 Ca -0.05 -1.97 -0.22 0.00 0.00 0.00 0.00 46.02 43.78 2cy6 n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cy6 s ILE 210 N -1.20 1.06 -0.02 -0.61 1.01 -0.48 -2.65 121.20 118.31 2cy6 s ILE 210 Ca 0.00 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.14 2cy6 s ILE 210 Cb 0.00 -0.89 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 2cy6 s ILE 210 CO 0.00 0.30 -0.20 0.00 0.00 0.00 0.00 174.94 175.04 2cy6 s ALA 211 N -0.29 1.69 0.03 9.38 0.00 0.45 0.62 121.76 133.64 2cy6 s ALA 211 Ca 0.05 -0.86 -0.23 0.00 0.00 0.00 0.00 51.96 50.91 2cy6 s ALA 211 Cb -0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 2cy6 s ALA 211 CO -0.00 0.40 0.69 0.12 0.00 0.00 0.00 175.76 176.97 2cy6 s PHE 212 N -0.41 3.72 0.10 0.00 5.36 -0.60 -0.38 117.98 125.77 2cy6 s PHE 212 Ca 0.06 1.36 -0.03 0.00 -0.96 0.00 0.00 56.93 57.36 2cy6 s PHE 212 Cb -0.08 -2.73 -0.03 0.00 -0.34 0.00 0.00 43.02 39.84 2cy6 s PHE 212 CO -0.00 0.31 0.07 -0.59 -1.46 0.00 0.00 175.22 173.55 2cy6 s PHE 213 N -0.13 0.59 -0.04 10.12 -0.71 0.67 -0.07 117.98 128.42 2cy6 s PHE 213 Ca 0.35 -1.03 0.03 0.00 -1.04 0.00 0.00 56.93 55.24 2cy6 s PHE 213 Cb -0.20 -0.34 0.00 0.00 -1.21 0.00 0.00 43.02 41.28 2cy6 s PHE 213 CO 0.21 -0.50 -0.12 0.42 -1.34 0.00 0.00 175.22 173.88 2cy6 s ILE 214 N -3.97 1.06 0.13 -4.49 1.01 0.60 -0.62 121.20 114.92 2cy6 s ILE 214 Ca 0.15 -0.49 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 2cy6 s ILE 214 Cb 0.07 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.55 2cy6 s ILE 214 CO -0.04 0.32 0.02 -0.94 0.00 0.00 0.00 174.94 174.30 2cy6 s SER 215 N 0.28 0.64 0.36 3.58 1.04 0.15 -1.42 113.70 118.33 2cy6 s SER 215 Ca -0.06 -1.15 -0.23 0.00 0.48 0.00 0.00 55.95 54.99 2cy6 s SER 215 Cb -0.11 0.22 -0.16 0.00 0.10 0.00 0.00 66.02 66.07 2cy6 s SER 215 CO 0.02 -0.65 0.21 -0.46 0.98 0.00 0.00 173.24 173.34 2cy6 n ASN 216 N -0.10 -2.39 -0.03 7.02 0.23 -1.15 -0.43 115.26 118.42 2cy6 n ASN 216 Ca -0.08 0.89 0.06 0.00 -0.53 0.00 0.00 54.58 54.92 2cy6 n ASN 216 Cb 0.63 -0.91 0.44 0.00 -2.08 0.00 0.00 39.78 37.86 2cy6 n ASN 216 CO 0.00 0.00 0.00 0.16 -0.93 0.00 0.00 177.26 176.49 2cy6 h ILE 217 N 0.50 1.05 -0.65 1.53 3.07 -1.83 -1.61 117.51 119.57 2cy6 h ILE 217 Ca -0.35 -0.18 -0.16 0.00 1.55 0.00 0.00 64.86 65.71 2cy6 h ILE 217 Cb 1.44 0.48 -0.10 0.00 -0.27 0.00 0.00 36.82 38.37 2cy6 h ILE 217 CO 0.49 0.10 0.21 -0.90 -1.05 0.00 0.00 178.15 177.00 2cy6 n ASP 218 N -4.47 4.71 -4.74 2.16 5.75 -1.26 -4.68 116.55 114.01 2cy6 n ASP 218 Ca 0.05 -3.05 -0.42 0.00 -0.01 0.00 0.00 54.79 51.36 2cy6 n ASP 218 Cb 0.14 -0.72 -0.01 0.00 -1.03 0.00 0.00 41.12 39.50 2cy6 n ASP 218 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2cy6 n SER 219 N 0.02 3.73 -4.44 -1.12 2.88 -0.61 -5.02 113.62 109.07 2cy6 n SER 219 Ca 0.35 1.16 -0.22 0.00 -1.33 0.00 0.00 58.87 58.83 2cy6 n SER 219 Cb 1.26 -1.58 -0.10 0.00 -0.75 0.00 0.00 64.21 63.04 2cy6 n SER 219 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cy6 s SER 220 N 0.37 2.78 0.03 -3.46 1.04 -1.26 -5.09 113.70 108.11 2cy6 s SER 220 Ca 0.63 -1.23 -0.30 0.00 0.48 0.00 0.00 55.95 55.53 2cy6 s SER 220 Cb -0.51 -0.17 -0.07 0.00 0.10 0.00 0.00 66.02 65.37 2cy6 s SER 220 CO 0.51 -0.38 1.66 -0.63 0.98 0.00 0.00 173.24 175.38 2cy6 s ILE 221 N -3.03 3.22 0.37 -1.02 1.01 -1.26 -4.92 121.20 115.57 2cy6 s ILE 221 Ca 0.31 0.54 -0.28 0.00 0.00 0.00 0.00 60.65 61.22 2cy6 s ILE 221 Cb 0.05 -3.35 -0.11 0.00 0.01 0.00 0.00 42.46 39.06 2cy6 s ILE 221 CO 0.13 -0.02 1.48 -2.84 0.00 0.00 0.00 174.94 173.69 2cy6 s PRO 222 N 3.15 4.12 0.22 2.79 0.02 -1.26 -4.89 135.00 139.15 2cy6 s PRO 222 Ca 0.74 2.56 -0.31 0.00 0.02 0.00 0.00 61.00 64.00 2cy6 s PRO 222 Cb -0.38 -2.97 -0.14 0.00 0.02 0.00 0.00 34.50 31.03 2cy6 s PRO 222 CO 0.32 -0.52 1.29 -1.13 -0.33 0.00 0.00 177.00 176.64 2cy6 n SER 223 N 0.48 2.17 -1.54 2.53 3.41 -1.26 -1.89 113.62 117.52 2cy6 n SER 223 Ca 0.01 1.15 -0.14 0.00 -0.26 0.00 0.00 58.87 59.62 2cy6 n SER 223 Cb 0.39 -1.35 -0.02 0.00 -0.26 0.00 0.00 64.21 62.98 2cy6 n SER 223 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cy6 n GLY 224 N 2.01 0.11 2.22 5.00 0.00 -1.26 -4.84 105.19 108.42 2cy6 n GLY 224 Ca 0.12 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2cy6 n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cy6 n SER 225 N -0.66 5.75 -3.42 1.61 3.41 -0.79 -4.92 113.62 114.60 2cy6 n SER 225 Ca -0.17 -3.61 -0.22 0.00 -0.26 0.00 0.00 58.87 54.62 2cy6 n SER 225 Cb 0.60 -0.91 0.15 0.00 -0.26 0.00 0.00 64.21 63.79 2cy6 n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2cy6 n THR 226 N -0.89 0.00 -2.68 6.66 -2.24 -1.26 -0.15 114.28 113.72 2cy6 n THR 226 Ca 0.58 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2cy6 n THR 226 Cb 1.10 -1.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.70 2cy6 n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cy6 n GLY 227 N -1.43 3.17 0.00 3.38 0.00 0.10 -3.12 105.19 107.28 2cy6 n GLY 227 Ca 0.12 -0.24 0.05 0.00 0.00 0.00 0.00 46.02 45.95 2cy6 n GLY 227 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2cy6 n ARG 228 N 14.00 0.00 0.00 1.61 1.85 -1.26 -1.94 116.66 130.92 2cy6 n ARG 228 Ca 0.00 0.32 0.13 0.00 -1.00 0.00 0.00 57.85 57.30 2cy6 n ARG 228 Cb 0.00 -1.50 0.38 0.00 -1.05 0.00 0.00 32.46 30.29 2cy6 n ARG 228 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2cy6 n LEU 229 N -1.50 0.97 -1.06 2.89 4.77 -1.18 -4.95 117.00 116.93 2cy6 n LEU 229 Ca 0.02 -0.23 -0.14 0.00 -0.03 0.00 0.00 56.01 55.63 2cy6 n LEU 229 Cb 0.12 -0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2cy6 n LEU 229 CO 0.09 0.18 -0.13 0.18 -1.33 0.00 0.00 177.39 176.39 2cy6 n LEU 230 N -0.71 -0.82 -0.04 2.23 4.77 -0.82 -1.10 117.00 120.51 2cy6 n LEU 230 Ca 0.12 0.34 -0.01 0.00 -0.03 0.00 0.00 56.01 56.44 2cy6 n LEU 230 Cb 0.34 -2.45 -0.00 0.00 -2.33 0.00 0.00 43.42 38.98 2cy6 n LEU 230 CO 0.26 -0.91 -0.01 0.61 -1.33 0.00 0.00 177.39 176.01 2cy6 n GLY 231 N -0.52 0.30 0.08 -0.72 0.00 0.79 -3.84 105.19 101.27 2cy6 n GLY 231 Ca -0.14 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 2cy6 n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cy6 n LEU 232 N -0.06 0.07 -4.15 0.99 4.77 -0.26 -4.35 117.00 114.01 2cy6 n LEU 232 Ca -0.01 -0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.79 2cy6 n LEU 232 Cb 0.26 0.39 -0.12 0.00 -2.33 0.00 0.00 43.42 41.61 2cy6 n LEU 232 CO 0.01 0.43 -0.46 -0.36 -1.33 0.00 0.00 177.39 175.68 2cy6 s PHE 233 N -2.41 1.17 -0.28 -1.77 0.08 -1.15 -4.80 117.98 108.83 2cy6 s PHE 233 Ca -0.09 -0.42 0.27 0.00 0.12 0.00 0.00 56.93 56.81 2cy6 s PHE 233 Cb 0.05 -0.67 0.75 0.00 -0.57 0.00 0.00 43.02 42.58 2cy6 s PHE 233 CO 0.68 0.04 1.76 -1.00 -0.10 0.00 0.00 175.22 176.60 2cy6 h PRO 234 N 4.53 0.00 -3.30 0.24 0.13 -1.90 -3.41 132.00 128.29 2cy6 h PRO 234 Ca -0.39 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.68 2cy6 h PRO 234 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 2cy6 h PRO 234 CO 0.41 0.00 0.12 0.16 -0.23 0.00 0.00 178.00 178.47 2cy6 s ASP 235 N -5.84 0.11 -0.24 1.44 1.47 -1.26 -4.88 116.67 107.48 2cy6 s ASP 235 Ca 0.05 -1.07 0.10 0.00 1.18 0.00 0.00 52.55 52.81 2cy6 s ASP 235 Cb 0.07 0.76 0.68 0.00 -0.34 0.00 0.00 42.92 44.09 2cy6 s ASP 235 CO 0.61 -1.47 1.62 0.00 0.68 0.00 0.00 175.17 176.60 2cy6 n ALA 236 N -0.50 3.99 1.16 2.11 0.00 -1.26 -4.67 120.51 121.34 2cy6 n ALA 236 Ca -0.05 -1.81 0.09 0.00 0.00 0.00 0.00 53.44 51.67 2cy6 n ALA 236 Cb 0.60 -1.17 0.55 0.00 0.00 0.00 0.00 19.45 19.44 2cy6 n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59