#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ciy n THR 29 N 0.00 0.34 -3.51 0.00 -1.04 -0.47 -4.91 114.28 104.69 3ciy n THR 29 Ca 0.00 -0.19 -0.23 0.00 -2.04 0.00 0.00 64.05 61.60 3ciy n THR 29 Cb 0.00 -0.37 -0.04 0.00 -1.82 0.00 0.00 70.33 68.09 3ciy n THR 29 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3ciy n VAL 30 N -1.97 0.00 -1.53 12.58 0.31 -1.26 -4.79 118.33 121.67 3ciy n VAL 30 Ca 0.05 0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 63.94 3ciy n VAL 30 Cb 0.40 -0.27 -0.01 0.00 -0.91 0.00 0.00 33.84 33.06 3ciy n VAL 30 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3ciy n ARG 31 N -3.20 0.94 -1.43 5.55 5.12 -1.20 -4.68 116.66 117.76 3ciy n ARG 31 Ca 0.06 0.33 -0.62 0.00 -1.93 0.00 0.00 57.85 55.70 3ciy n ARG 31 Cb 0.44 -1.65 -0.11 0.00 -1.16 0.00 0.00 32.46 29.99 3ciy n ARG 31 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3ciy n TYR 32 N -0.18 1.38 0.00 -1.55 4.02 -1.26 -2.66 117.16 116.92 3ciy n TYR 32 Ca 0.11 0.91 0.00 0.00 -0.01 0.00 0.00 57.90 58.91 3ciy n TYR 32 Cb 0.34 -2.22 0.00 0.00 -0.02 0.00 0.00 39.34 37.44 3ciy n TYR 32 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3ciy n ASN 33 N 5.93 0.00 -4.62 7.72 2.85 -1.26 -4.87 115.26 121.01 3ciy n ASN 33 Ca 0.44 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 54.49 3ciy n ASN 33 Cb -0.05 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.94 3ciy n ASN 33 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 3ciy s VAL 34 N 0.00 4.58 -0.14 3.44 -7.23 -1.09 -3.39 120.40 116.58 3ciy s VAL 34 Ca 0.00 1.42 -0.29 0.00 -1.81 0.00 0.00 61.98 61.29 3ciy s VAL 34 Cb 0.00 -4.34 -0.03 0.00 0.56 0.00 0.00 36.38 32.58 3ciy s VAL 34 CO 0.00 -0.47 1.38 0.00 -0.31 0.00 0.00 175.10 175.70 3ciy s ALA 35 N 3.47 3.63 -0.37 1.32 0.00 0.18 -3.24 121.76 126.75 3ciy s ALA 35 Ca 0.40 0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.97 3ciy s ALA 35 Cb -0.12 -3.67 0.11 0.00 0.00 0.00 0.00 23.12 19.44 3ciy s ALA 35 CO 0.16 -1.28 0.10 0.34 0.00 0.00 0.00 175.76 175.09 3ciy s ASP 36 N 2.45 4.53 -0.68 0.00 -1.08 -1.26 0.15 116.67 120.77 3ciy s ASP 36 Ca 0.60 -2.27 -0.11 0.00 -0.52 0.00 0.00 52.55 50.25 3ciy s ASP 36 Cb -0.25 -1.50 0.18 0.00 -1.46 0.00 0.00 42.92 39.89 3ciy s ASP 36 CO 0.19 -0.35 0.59 0.00 0.52 0.00 0.00 175.17 176.12 3ciy n SER 38 N 4.19 0.00 -3.33 0.00 7.64 -1.26 -4.43 113.62 116.43 3ciy n SER 38 Ca 0.05 0.71 -0.08 0.00 1.01 0.00 0.00 58.87 60.56 3ciy n SER 38 Cb 0.43 -0.21 -0.07 0.00 -1.01 0.00 0.00 64.21 63.35 3ciy n SER 38 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3ciy s HIS 39 N -1.83 -0.91 0.00 1.43 3.76 -1.26 -4.42 115.29 112.06 3ciy s HIS 39 Ca 0.00 0.93 0.00 0.00 -0.15 0.00 0.00 55.06 55.84 3ciy s HIS 39 Cb 0.00 0.08 0.00 0.00 1.11 0.00 0.00 32.58 33.77 3ciy s HIS 39 CO 0.00 -0.74 0.19 1.28 -0.85 0.00 0.00 174.74 174.62 3ciy n LEU 40 N 5.37 0.38 -2.75 0.89 4.32 -1.25 -4.96 117.00 118.99 3ciy n LEU 40 Ca -0.03 -0.67 -0.20 0.00 -0.02 0.00 0.00 56.01 55.09 3ciy n LEU 40 Cb 0.50 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.31 3ciy n LEU 40 CO 0.06 0.09 -0.12 1.17 -1.22 0.00 0.00 177.39 177.37 3ciy n LYS 41 N -0.58 -3.19 -1.74 3.23 0.00 -1.26 -4.87 118.16 109.75 3ciy n LYS 41 Ca 0.00 0.85 -0.39 0.00 0.00 0.00 0.00 58.31 58.77 3ciy n LYS 41 Cb 0.00 -5.58 0.04 0.00 0.00 0.00 0.00 35.03 29.49 3ciy n LYS 41 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 3ciy n LEU 42 N -3.45 5.38 -0.04 3.14 0.00 -1.26 -4.80 117.00 115.96 3ciy n LEU 42 Ca -0.15 0.99 -0.03 0.00 0.00 0.00 0.00 56.01 56.81 3ciy n LEU 42 Cb 0.63 -1.57 -0.01 0.00 0.00 0.00 0.00 43.42 42.47 3ciy n LEU 42 CO 0.37 -0.59 -0.23 0.35 0.00 0.00 0.00 177.39 177.28 3ciy n THR 43 N -0.96 0.73 -4.16 1.96 -2.24 -1.26 -3.41 114.28 104.94 3ciy n THR 43 Ca 0.10 0.35 -0.24 0.00 -2.27 0.00 0.00 64.05 61.98 3ciy n THR 43 Cb 0.44 -1.95 -0.07 0.00 -2.10 0.00 0.00 70.33 66.65 3ciy n THR 43 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3ciy s HIS 44 N -1.73 2.62 -0.47 4.78 3.76 -1.26 -4.63 115.29 118.35 3ciy s HIS 44 Ca -0.10 -0.53 -0.28 0.00 -0.15 0.00 0.00 55.06 54.01 3ciy s HIS 44 Cb 0.01 -1.83 0.00 0.00 1.11 0.00 0.00 32.58 31.88 3ciy s HIS 44 CO 0.14 0.26 1.56 -1.50 -0.85 0.00 0.00 174.74 174.35 3ciy s ILE 45 N -2.56 3.70 0.66 0.60 -1.16 -1.26 -4.98 121.20 116.20 3ciy s ILE 45 Ca 0.39 0.65 -0.15 0.00 -0.51 0.00 0.00 60.65 61.04 3ciy s ILE 45 Cb 0.02 -4.12 0.00 0.00 0.61 0.00 0.00 42.46 38.98 3ciy s ILE 45 CO 0.22 -0.83 1.10 -2.16 -2.81 0.00 0.00 174.94 170.47 3ciy s PRO 46 N 5.56 2.80 -0.41 3.50 0.04 -1.26 -5.02 135.00 140.20 3ciy s PRO 46 Ca 0.63 1.36 0.09 0.00 0.04 0.00 0.00 61.00 63.12 3ciy s PRO 46 Cb -0.15 -1.95 0.37 0.00 0.04 0.00 0.00 34.50 32.81 3ciy s PRO 46 CO 0.29 -1.24 1.16 -0.40 0.04 0.00 0.00 177.00 176.84 3ciy n ASP 47 N -2.47 -1.42 -0.03 6.66 5.68 -1.26 -4.97 116.55 118.73 3ciy n ASP 47 Ca 0.10 -3.02 -0.02 0.00 -0.50 0.00 0.00 54.79 51.35 3ciy n ASP 47 Cb 0.52 1.03 -0.06 0.00 -1.14 0.00 0.00 41.12 41.47 3ciy n ASP 47 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3ciy n ASP 48 N -0.08 3.04 -2.14 -1.12 3.85 -1.26 -5.05 116.55 113.79 3ciy n ASP 48 Ca 0.05 0.00 -0.02 0.00 -0.71 0.00 0.00 54.79 54.11 3ciy n ASP 48 Cb 0.77 0.84 0.01 0.00 -1.35 0.00 0.00 41.12 41.39 3ciy n ASP 48 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3ciy n LEU 49 N -2.19 0.00 -4.63 -2.12 7.99 -1.26 -5.02 117.00 109.77 3ciy n LEU 49 Ca -0.11 -0.11 -0.37 0.00 -0.01 0.00 0.00 56.01 55.41 3ciy n LEU 49 Cb 0.65 -0.06 0.06 0.00 -0.11 0.00 0.00 43.42 43.96 3ciy n LEU 49 CO 0.17 -0.56 0.59 -2.65 -1.51 0.00 0.00 177.39 173.44 3ciy n PRO 50 N -1.18 0.83 0.00 3.23 -0.02 -1.26 -4.94 135.00 131.67 3ciy n PRO 50 Ca 0.01 0.33 0.05 0.00 -2.02 0.00 0.00 63.50 61.87 3ciy n PRO 50 Cb 0.04 -2.23 0.03 0.00 -0.02 0.00 0.00 33.50 31.32 3ciy n PRO 50 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3ciy n SER 51 N -1.16 1.72 -4.20 2.55 7.64 -1.26 -4.70 113.62 114.21 3ciy n SER 51 Ca 0.14 -1.36 -0.40 0.00 1.01 0.00 0.00 58.87 58.27 3ciy n SER 51 Cb 0.48 0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.70 3ciy n SER 51 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3ciy n ASN 52 N 0.44 4.76 -3.43 6.43 5.15 -1.26 -4.75 115.26 122.60 3ciy n ASN 52 Ca 0.05 -3.10 -0.10 0.00 -0.60 0.00 0.00 54.58 50.83 3ciy n ASN 52 Cb 0.23 -1.18 -0.02 0.00 -0.53 0.00 0.00 39.78 38.28 3ciy n ASN 52 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3ciy s ILE 53 N -1.38 0.00 0.00 -1.44 -0.00 -1.26 -4.79 121.20 112.33 3ciy s ILE 53 Ca 0.29 -1.26 0.00 0.00 -0.00 0.00 0.00 60.65 59.68 3ciy s ILE 53 Cb -0.08 -2.50 0.00 0.00 -0.00 0.00 0.00 42.46 39.88 3ciy s ILE 53 CO -0.11 0.00 0.41 0.35 -0.00 0.00 0.00 174.94 175.59 3ciy n THR 54 N -0.49 0.16 -3.63 8.37 -2.24 -1.22 -3.63 114.28 111.60 3ciy n THR 54 Ca -0.04 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.34 3ciy n THR 54 Cb 0.61 1.27 -0.07 0.00 -2.10 0.00 0.00 70.33 70.03 3ciy n THR 54 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3ciy s VAL 55 N -0.16 0.02 -0.11 2.28 1.01 -1.25 0.22 120.40 122.40 3ciy s VAL 55 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 3ciy s VAL 55 Cb 0.00 -0.84 0.06 0.00 0.00 0.00 0.00 36.38 35.60 3ciy s VAL 55 CO 0.00 -0.08 0.23 -0.22 0.00 0.00 0.00 175.10 175.03 3ciy s LEU 56 N -0.88 -0.05 -0.29 3.92 1.98 -1.11 0.47 118.68 122.72 3ciy s LEU 56 Ca -0.09 0.51 -0.14 0.00 -2.89 0.00 0.00 54.13 51.52 3ciy s LEU 56 Cb -0.03 0.61 -0.03 0.00 0.66 0.00 0.00 46.19 47.40 3ciy s LEU 56 CO 0.06 -0.22 0.33 0.21 -1.89 0.00 0.00 176.35 174.84 3ciy s ASN 57 N 2.07 6.18 0.00 3.68 3.84 0.40 -1.07 114.94 130.04 3ciy s ASN 57 Ca -0.01 0.06 0.01 0.00 0.21 0.00 0.00 52.86 53.14 3ciy s ASN 57 Cb -0.12 -2.19 0.00 0.00 -0.55 0.00 0.00 41.25 38.40 3ciy s ASN 57 CO -0.08 -0.20 0.34 0.18 -2.79 0.00 0.00 177.10 174.55 3ciy n LEU 58 N 5.29 0.68 -4.60 3.21 4.77 0.17 -2.68 117.00 123.84 3ciy n LEU 58 Ca -0.10 -0.79 -0.38 0.00 -0.03 0.00 0.00 56.01 54.71 3ciy n LEU 58 Cb 0.51 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 3ciy n LEU 58 CO 0.37 0.16 0.49 0.41 -1.33 0.00 0.00 177.39 177.50 3ciy n THR 59 N -0.38 3.34 -2.71 -5.08 -1.04 0.61 -3.74 114.28 105.27 3ciy n THR 59 Ca 0.01 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.05 61.43 3ciy n THR 59 Cb 0.03 -1.10 0.05 0.00 -1.82 0.00 0.00 70.33 67.49 3ciy n THR 59 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3ciy n HIS 60 N -1.55 -1.19 -3.75 -1.42 8.25 -1.24 -4.56 115.22 109.76 3ciy n HIS 60 Ca 0.13 0.50 -0.10 0.00 -0.26 0.00 0.00 57.72 57.99 3ciy n HIS 60 Cb 0.46 -3.61 -0.05 0.00 1.12 0.00 0.00 29.99 27.91 3ciy n HIS 60 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3ciy s ASN 61 N -3.65 -0.12 -0.41 0.41 -0.87 -1.25 -3.97 114.94 105.09 3ciy s ASN 61 Ca 0.04 -0.50 -0.25 0.00 -1.57 0.00 0.00 52.86 50.58 3ciy s ASN 61 Cb -0.00 0.46 0.02 0.00 -0.02 0.00 0.00 41.25 41.70 3ciy s ASN 61 CO 0.39 -0.86 0.87 -1.10 -2.57 0.00 0.00 177.10 173.83 3ciy s GLN 62 N -3.85 3.66 -0.16 -0.60 -0.21 -1.22 -4.45 119.66 112.83 3ciy s GLN 62 Ca 0.06 0.28 0.01 0.00 0.02 0.00 0.00 55.36 55.74 3ciy s GLN 62 Cb 0.02 -3.86 0.01 0.00 1.00 0.00 0.00 33.01 30.18 3ciy s GLN 62 CO -0.09 -1.04 -0.19 -0.51 -2.12 0.00 0.00 175.29 171.34 3ciy s LEU 63 N 3.45 2.21 0.03 2.90 1.02 -1.26 -4.51 118.68 122.52 3ciy s LEU 63 Ca 0.35 -0.59 -0.20 0.00 0.02 0.00 0.00 54.13 53.70 3ciy s LEU 63 Cb -0.12 -1.49 -0.11 0.00 0.02 0.00 0.00 46.19 44.49 3ciy s LEU 63 CO 0.21 0.04 1.31 -0.09 0.02 0.00 0.00 176.35 177.84 3ciy h ARG 64 N 7.61 -0.69 -2.56 1.70 2.43 -1.82 -3.27 114.38 117.77 3ciy h ARG 64 Ca -0.38 0.05 0.14 0.00 -0.81 0.00 0.00 59.98 58.97 3ciy h ARG 64 Cb 1.17 0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 30.82 3ciy h ARG 64 CO 0.59 -0.46 0.42 -0.98 -1.51 0.00 0.00 179.97 178.04 3ciy s ARG 65 N -4.60 1.43 -0.48 0.20 3.03 -1.26 -3.94 118.95 113.33 3ciy s ARG 65 Ca -0.11 -0.82 -0.19 0.00 2.03 0.00 0.00 55.73 56.64 3ciy s ARG 65 Cb 0.01 0.47 0.05 0.00 -1.03 0.00 0.00 34.95 34.45 3ciy s ARG 65 CO 0.32 -0.66 0.57 -0.51 -1.13 0.00 0.00 175.30 173.89 3ciy s LEU 66 N -3.01 4.98 -0.42 -1.89 1.43 -1.26 -4.96 118.68 113.54 3ciy s LEU 66 Ca 0.14 -0.87 -0.26 0.00 -1.03 0.00 0.00 54.13 52.10 3ciy s LEU 66 Cb -0.03 -2.43 -0.06 0.00 0.03 0.00 0.00 46.19 43.69 3ciy s LEU 66 CO 0.05 -0.80 2.37 -2.84 0.23 0.00 0.00 176.35 175.35 3ciy s PRO 67 N 2.46 2.33 0.27 1.29 0.02 -1.26 -4.81 135.00 135.30 3ciy s PRO 67 Ca 0.14 1.57 0.19 0.00 0.02 0.00 0.00 61.00 62.91 3ciy s PRO 67 Cb -0.19 -4.54 1.00 0.00 0.02 0.00 0.00 34.50 30.79 3ciy s PRO 67 CO 0.12 -3.01 1.57 -0.35 -0.33 0.00 0.00 177.00 175.00 3ciy n PRO 68 N 8.95 0.12 -0.00 5.54 -0.04 -1.26 -2.25 135.00 146.06 3ciy n PRO 68 Ca 0.35 0.61 0.05 0.00 -0.04 0.00 0.00 63.50 64.47 3ciy n PRO 68 Cb 0.53 -1.89 -0.07 0.00 -0.04 0.00 0.00 33.50 32.02 3ciy n PRO 68 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3ciy n THR 69 N -2.15 0.00 1.55 0.52 -2.24 -1.26 -4.20 114.28 106.50 3ciy n THR 69 Ca -0.01 -0.25 0.02 0.00 -2.27 0.00 0.00 64.05 61.54 3ciy n THR 69 Cb 0.04 0.62 0.10 0.00 -2.10 0.00 0.00 70.33 68.99 3ciy n THR 69 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3ciy n ASN 70 N -1.58 0.00 -2.48 3.42 4.13 -0.96 -3.64 115.26 114.16 3ciy n ASN 70 Ca -0.00 -1.44 -0.33 0.00 1.68 0.00 0.00 54.58 54.49 3ciy n ASN 70 Cb 0.23 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 38.52 3ciy n ASN 70 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 3ciy n PHE 71 N -0.57 3.10 -0.08 3.10 3.72 -1.26 -4.44 117.46 121.04 3ciy n PHE 71 Ca 0.03 -2.68 -0.09 0.00 -0.05 0.00 0.00 57.45 54.66 3ciy n PHE 71 Cb 0.01 -0.94 -0.10 0.00 -0.94 0.00 0.00 39.48 37.51 3ciy n PHE 71 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3ciy n THR 72 N -0.69 1.01 0.49 4.37 -1.04 -1.24 -4.29 114.28 112.89 3ciy n THR 72 Ca 0.53 -0.55 0.11 0.00 -2.04 0.00 0.00 64.05 62.10 3ciy n THR 72 Cb 0.59 -0.79 0.45 0.00 -1.82 0.00 0.00 70.33 68.76 3ciy n THR 72 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3ciy n ARG 73 N -2.70 0.16 -3.67 -2.82 0.63 -1.26 -3.76 116.66 103.24 3ciy n ARG 73 Ca -0.27 0.33 -0.28 0.00 -0.92 0.00 0.00 57.85 56.71 3ciy n ARG 73 Cb 0.93 -1.78 -0.12 0.00 0.45 0.00 0.00 32.46 31.95 3ciy n ARG 73 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3ciy s TYR 74 N -3.20 2.20 -1.05 -0.14 1.51 -1.26 -4.71 117.35 110.69 3ciy s TYR 74 Ca 0.06 -2.67 0.16 0.00 -1.01 0.00 0.00 57.07 53.61 3ciy s TYR 74 Cb 0.10 -1.84 0.56 0.00 -0.11 0.00 0.00 41.96 40.67 3ciy s TYR 74 CO 0.42 -0.72 1.47 0.45 -1.11 0.00 0.00 175.55 176.06 3ciy n SER 75 N 2.84 3.96 -0.02 2.29 2.88 -1.25 -4.43 113.62 119.88 3ciy n SER 75 Ca 0.19 -2.33 0.02 0.00 -1.33 0.00 0.00 58.87 55.41 3ciy n SER 75 Cb 0.39 -0.45 -0.09 0.00 -0.75 0.00 0.00 64.21 63.30 3ciy n SER 75 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ciy n GLN 76 N 0.77 1.01 -1.64 -1.46 1.13 -1.26 -4.81 117.38 111.12 3ciy n GLN 76 Ca 0.21 -0.07 -0.52 0.00 -1.94 0.00 0.00 57.00 54.67 3ciy n GLN 76 Cb 0.71 -1.29 -0.06 0.00 0.11 0.00 0.00 30.24 29.72 3ciy n GLN 76 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3ciy n LEU 77 N -2.09 2.22 -0.03 1.08 4.77 -1.24 -4.45 117.00 117.25 3ciy n LEU 77 Ca -0.08 1.09 -0.12 0.00 -0.03 0.00 0.00 56.01 56.88 3ciy n LEU 77 Cb 0.51 -1.23 -0.14 0.00 -2.33 0.00 0.00 43.42 40.22 3ciy n LEU 77 CO 0.25 -0.69 -0.70 0.00 -1.33 0.00 0.00 177.39 174.93 3ciy n ALA 78 N 3.73 1.38 -2.79 -1.18 0.00 0.58 -4.22 120.51 118.01 3ciy n ALA 78 Ca 0.21 -0.82 -0.10 0.00 0.00 0.00 0.00 53.44 52.72 3ciy n ALA 78 Cb 0.20 -0.70 -0.07 0.00 0.00 0.00 0.00 19.45 18.88 3ciy n ALA 78 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3ciy s ILE 79 N -2.57 0.11 -0.05 0.00 -4.36 -1.10 0.54 121.20 113.77 3ciy s ILE 79 Ca -0.10 -0.91 -0.02 0.00 -0.26 0.00 0.00 60.65 59.36 3ciy s ILE 79 Cb 0.07 -1.13 0.03 0.00 1.25 0.00 0.00 42.46 42.69 3ciy s ILE 79 CO 0.81 -0.50 0.08 -1.48 0.24 0.00 0.00 174.94 174.09 3ciy s LEU 80 N -2.49 0.36 -1.14 0.37 2.34 -0.63 -2.74 118.68 114.75 3ciy s LEU 80 Ca 0.00 0.15 -0.20 0.00 0.06 0.00 0.00 54.13 54.14 3ciy s LEU 80 Cb 0.02 0.01 0.07 0.00 -0.56 0.00 0.00 46.19 45.73 3ciy s LEU 80 CO -0.08 -0.21 1.55 -0.62 -1.06 0.00 0.00 176.35 175.93 3ciy s ASP 81 N 1.86 6.69 -0.58 1.48 -1.08 -0.23 -2.71 116.67 122.08 3ciy s ASP 81 Ca 0.00 -2.00 0.06 0.00 -0.52 0.00 0.00 52.55 50.09 3ciy s ASP 81 Cb -0.12 -2.55 0.24 0.00 -1.46 0.00 0.00 42.92 39.03 3ciy s ASP 81 CO -0.04 -1.29 0.67 0.00 0.52 0.00 0.00 175.17 175.03 3ciy n ALA 82 N 8.32 3.63 -2.35 3.66 0.00 -1.08 0.42 120.51 133.12 3ciy n ALA 82 Ca 0.39 -4.41 -0.19 0.00 0.00 0.00 0.00 53.44 49.23 3ciy n ALA 82 Cb 0.48 -0.89 -0.09 0.00 0.00 0.00 0.00 19.45 18.96 3ciy n ALA 82 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ciy s GLY 83 N -2.05 2.10 -1.34 0.00 0.00 -1.21 -3.68 107.32 101.13 3ciy s GLY 83 Ca 0.38 -1.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.34 3ciy s GLY 83 CO -0.05 -1.60 0.13 0.69 0.00 0.00 0.00 173.10 172.27 3ciy n PHE 84 N -0.60 -0.99 -4.22 1.90 3.72 0.08 -3.62 117.46 113.72 3ciy n PHE 84 Ca 0.01 0.12 -0.17 0.00 -0.05 0.00 0.00 57.45 57.35 3ciy n PHE 84 Cb 0.65 -3.44 -0.11 0.00 -0.94 0.00 0.00 39.48 35.64 3ciy n PHE 84 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3ciy s ASN 85 N -2.41 1.87 -1.18 4.37 0.01 -1.24 -4.14 114.94 112.23 3ciy s ASN 85 Ca 0.07 -0.79 -0.18 0.00 -0.71 0.00 0.00 52.86 51.25 3ciy s ASN 85 Cb -0.03 -0.05 0.10 0.00 0.41 0.00 0.00 41.25 41.68 3ciy s ASN 85 CO 0.08 -0.15 1.52 -0.44 -1.51 0.00 0.00 177.10 176.60 3ciy s SER 86 N -2.36 6.83 -0.35 -1.22 0.01 -1.23 -4.34 113.70 111.03 3ciy s SER 86 Ca 0.07 -2.39 -0.09 0.00 1.31 0.00 0.00 55.95 54.85 3ciy s SER 86 Cb -0.05 -2.50 0.03 0.00 0.21 0.00 0.00 66.02 63.70 3ciy s SER 86 CO 0.02 -1.09 0.16 -0.63 0.41 0.00 0.00 173.24 172.11 3ciy s ILE 87 N 3.37 4.27 0.04 1.44 -1.09 -1.25 -4.16 121.20 123.83 3ciy s ILE 87 Ca 0.47 -0.89 -0.25 0.00 -2.23 0.00 0.00 60.65 57.75 3ciy s ILE 87 Cb 0.00 -3.36 -0.13 0.00 -1.58 0.00 0.00 42.46 37.39 3ciy s ILE 87 CO 0.00 -0.16 1.37 0.77 -1.23 0.00 0.00 174.94 175.69 3ciy h SER 88 N 8.34 -0.80 -5.40 3.58 4.64 -1.87 -2.67 113.55 119.37 3ciy h SER 88 Ca -0.26 0.04 -0.17 0.00 -0.47 0.00 0.00 61.79 60.93 3ciy h SER 88 Cb 1.10 0.22 -0.09 0.00 -0.31 0.00 0.00 62.40 63.32 3ciy h SER 88 CO 0.64 -0.52 -0.21 -1.59 -0.87 0.00 0.00 176.83 174.27 3ciy s LYS 89 N -4.94 1.66 -0.02 4.77 0.00 -1.26 -2.57 119.74 117.37 3ciy s LYS 89 Ca -0.13 -1.52 0.01 0.00 0.00 0.00 0.00 55.97 54.34 3ciy s LYS 89 Cb 0.02 0.43 0.01 0.00 0.00 0.00 0.00 37.83 38.29 3ciy s LYS 89 CO 0.39 -0.67 -0.03 -1.17 0.00 0.00 0.00 175.35 173.87 3ciy s LEU 90 N -3.13 1.57 0.16 2.77 2.96 -1.26 -4.48 118.68 117.27 3ciy s LEU 90 Ca 0.28 -0.07 -0.09 0.00 -0.22 0.00 0.00 54.13 54.02 3ciy s LEU 90 Cb 0.00 -0.27 -0.06 0.00 0.50 0.00 0.00 46.19 46.36 3ciy s LEU 90 CO 0.14 -0.02 0.47 -1.61 -1.32 0.00 0.00 176.35 174.01 3ciy s GLU 91 N 0.51 3.78 0.05 1.98 8.01 -1.26 -4.80 118.70 126.97 3ciy s GLU 91 Ca -0.06 0.21 0.03 0.00 0.01 0.00 0.00 54.97 55.16 3ciy s GLU 91 Cb -0.09 -2.83 0.14 0.00 -4.31 0.00 0.00 34.13 27.04 3ciy s GLU 91 CO -0.01 0.44 0.99 -2.30 0.01 0.00 0.00 175.26 174.40 3ciy n PRO 92 N 0.35 0.02 -0.14 0.39 -0.02 -1.26 -2.73 135.00 131.60 3ciy n PRO 92 Ca -0.03 0.44 -0.08 0.00 -2.02 0.00 0.00 63.50 61.81 3ciy n PRO 92 Cb 0.52 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 3ciy n PRO 92 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3ciy h GLU 93 N 0.00 0.57 -0.08 -0.52 4.39 -1.90 -3.10 114.58 113.94 3ciy h GLU 93 Ca 0.00 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.68 3ciy h GLU 93 Cb 0.19 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3ciy h GLU 93 CO 0.00 0.41 0.24 -0.07 -1.16 0.00 0.00 179.01 178.43 3ciy h LEU 94 N 0.57 0.00 0.03 1.33 4.07 -1.68 -2.21 115.31 117.42 3ciy h LEU 94 Ca 0.15 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.86 3ciy h LEU 94 Cb -0.02 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.69 3ciy h LEU 94 CO -0.03 0.00 -1.30 0.00 -1.08 0.00 0.00 178.44 176.03 3ciy h GLN 96 N 0.02 0.00 0.00 0.00 3.07 -1.53 -3.26 115.11 113.41 3ciy h GLN 96 Ca -0.13 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.48 3ciy h GLN 96 Cb 1.89 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 29.44 3ciy h GLN 96 CO 0.13 0.00 -0.62 0.82 0.09 0.00 0.00 178.83 179.25 3ciy h ILE 97 N 0.00 1.14 -2.21 1.86 1.08 -1.61 -3.36 117.51 114.41 3ciy h ILE 97 Ca 0.00 -2.39 -0.59 0.00 -0.39 0.00 0.00 64.86 61.49 3ciy h ILE 97 Cb 0.91 2.42 -0.41 0.00 -3.07 0.00 0.00 36.82 36.67 3ciy h ILE 97 CO 0.00 0.60 -0.80 0.18 -0.69 0.00 0.00 178.15 177.45 3ciy n LEU 98 N -3.36 2.17 -0.09 1.44 7.99 -1.23 -4.79 117.00 119.13 3ciy n LEU 98 Ca 0.01 -5.09 0.16 0.00 -0.01 0.00 0.00 56.01 51.08 3ciy n LEU 98 Cb 0.73 -0.14 0.57 0.00 -0.11 0.00 0.00 43.42 44.48 3ciy n LEU 98 CO 0.42 2.03 1.19 -0.65 -1.51 0.00 0.00 177.39 178.87 3ciy h PRO 99 N 4.30 0.26 -5.00 3.23 0.11 -1.71 -3.26 132.00 129.93 3ciy h PRO 99 Ca 0.15 -0.02 -0.71 0.00 0.11 0.00 0.00 66.00 65.54 3ciy h PRO 99 Cb 0.76 -0.06 -0.16 0.00 0.11 0.00 0.00 31.00 31.65 3ciy h PRO 99 CO 0.67 0.17 1.25 -0.51 -0.21 0.00 0.00 178.00 179.37 3ciy s LEU 100 N -9.14 4.88 -0.12 2.35 1.02 -1.26 -4.72 118.68 111.69 3ciy s LEU 100 Ca -0.07 -2.55 -0.04 0.00 0.02 0.00 0.00 54.13 51.49 3ciy s LEU 100 Cb 0.20 -2.42 0.06 0.00 0.02 0.00 0.00 46.19 44.05 3ciy s LEU 100 CO 0.75 -0.93 0.21 -0.22 0.02 0.00 0.00 176.35 176.19 3ciy s LEU 101 N 2.34 -0.19 -0.19 1.79 0.20 -1.23 -3.69 118.68 117.71 3ciy s LEU 101 Ca 0.40 0.39 -0.03 0.00 0.69 0.00 0.00 54.13 55.59 3ciy s LEU 101 Cb -0.03 0.49 -0.10 0.00 -0.43 0.00 0.00 46.19 46.11 3ciy s LEU 101 CO -0.03 -0.25 -0.20 0.29 -0.29 0.00 0.00 176.35 175.87 3ciy n LYS 102 N 5.34 0.43 -4.02 1.98 5.02 0.19 -2.15 118.16 124.95 3ciy n LYS 102 Ca -0.05 0.13 -0.34 0.00 -2.02 0.00 0.00 58.31 56.03 3ciy n LYS 102 Cb 0.50 -1.29 -0.15 0.00 -0.02 0.00 0.00 35.03 34.07 3ciy n LYS 102 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ciy s VAL 103 N -2.36 2.91 -0.32 -0.18 1.01 -1.09 0.74 120.40 121.11 3ciy s VAL 103 Ca -0.25 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.08 3ciy s VAL 103 Cb 0.08 -2.29 0.08 0.00 0.00 0.00 0.00 36.38 34.24 3ciy s VAL 103 CO 0.38 0.47 0.03 -0.22 0.00 0.00 0.00 175.10 175.76 3ciy s LEU 104 N 1.37 4.29 -0.40 3.92 2.96 -0.65 -1.60 118.68 128.57 3ciy s LEU 104 Ca 0.05 -1.70 -0.16 0.00 -0.22 0.00 0.00 54.13 52.10 3ciy s LEU 104 Cb -0.14 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.89 3ciy s LEU 104 CO -0.06 -0.33 0.40 0.21 -1.32 0.00 0.00 176.35 175.25 3ciy s ASN 105 N 1.23 6.18 -0.36 3.68 2.47 -1.10 -1.11 114.94 125.93 3ciy s ASN 105 Ca 0.01 -0.60 0.14 0.00 0.42 0.00 0.00 52.86 52.83 3ciy s ASN 105 Cb -0.20 -2.21 0.45 0.00 -1.45 0.00 0.00 41.25 37.84 3ciy s ASN 105 CO -0.05 -0.50 1.00 0.18 -3.72 0.00 0.00 177.10 174.01 3ciy n LEU 106 N 5.49 2.49 -4.89 3.21 4.32 0.22 -2.63 117.00 125.21 3ciy n LEU 106 Ca -0.08 -4.18 -0.30 0.00 -0.02 0.00 0.00 56.01 51.43 3ciy n LEU 106 Cb 0.48 0.15 -0.04 0.00 -1.62 0.00 0.00 43.42 42.38 3ciy n LEU 106 CO 0.44 1.77 0.21 0.00 -1.22 0.00 0.00 177.39 178.59 3ciy s GLN 107 N -3.27 3.71 -1.26 3.23 -2.07 -1.15 -4.15 119.66 114.71 3ciy s GLN 107 Ca 0.34 0.14 -0.05 0.00 -1.82 0.00 0.00 55.36 53.96 3ciy s GLN 107 Cb 0.44 -2.64 0.01 0.00 -1.09 0.00 0.00 33.01 29.72 3ciy s GLN 107 CO -0.03 0.25 1.08 0.72 -1.32 0.00 0.00 175.29 175.99 3ciy n HIS 108 N -0.58 -2.55 -4.59 9.60 8.25 -1.25 -0.74 115.22 123.35 3ciy n HIS 108 Ca -0.01 0.96 -0.28 0.00 -0.26 0.00 0.00 57.72 58.13 3ciy n HIS 108 Cb 0.53 -4.95 -0.08 0.00 1.12 0.00 0.00 29.99 26.61 3ciy n HIS 108 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3ciy s ASN 109 N -3.69 3.24 0.00 0.41 -0.87 -0.26 -3.42 114.94 110.34 3ciy s ASN 109 Ca 0.35 -1.65 0.00 0.00 -1.57 0.00 0.00 52.86 50.00 3ciy s ASN 109 Cb -0.16 0.45 0.00 0.00 -0.02 0.00 0.00 41.25 41.53 3ciy s ASN 109 CO 0.71 -0.88 0.24 -0.62 -2.57 0.00 0.00 177.10 173.98 3ciy n GLU 110 N -1.02 0.00 -3.46 -0.60 -0.58 -1.13 -2.99 120.64 110.87 3ciy n GLU 110 Ca -0.10 0.17 -0.17 0.00 -0.42 0.00 0.00 57.16 56.64 3ciy n GLU 110 Cb 0.66 -0.85 0.00 0.00 -0.57 0.00 0.00 31.44 30.68 3ciy n GLU 110 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3ciy n LEU 111 N -1.02 -0.54 -0.19 -4.62 4.77 -1.02 -4.26 117.00 110.12 3ciy n LEU 111 Ca 0.00 -0.56 -0.06 0.00 -0.03 0.00 0.00 56.01 55.36 3ciy n LEU 111 Cb 0.00 -0.79 0.04 0.00 -2.33 0.00 0.00 43.42 40.34 3ciy n LEU 111 CO 0.00 0.29 1.09 0.28 -1.33 0.00 0.00 177.39 177.73 3ciy h SER 112 N 0.31 0.60 -4.77 -1.43 0.02 -1.74 -3.39 113.55 103.15 3ciy h SER 112 Ca -0.34 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.41 3ciy h SER 112 Cb 0.70 -0.14 -0.15 0.00 0.14 0.00 0.00 62.40 62.95 3ciy h SER 112 CO 0.21 0.43 -0.69 0.00 -1.14 0.00 0.00 176.83 175.64 3ciy s GLN 113 N -6.14 0.77 -0.14 3.45 -2.07 -1.26 -4.05 119.66 110.21 3ciy s GLN 113 Ca -0.13 -1.29 -0.30 0.00 -1.82 0.00 0.00 55.36 51.82 3ciy s GLN 113 Cb 0.13 -0.10 0.12 0.00 -1.09 0.00 0.00 33.01 32.07 3ciy s GLN 113 CO 0.75 -0.04 0.99 -1.50 -1.32 0.00 0.00 175.29 174.17 3ciy s ILE 114 N -3.63 0.00 0.39 3.63 1.10 -1.26 -4.95 121.20 116.48 3ciy s ILE 114 Ca 0.10 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.28 3ciy s ILE 114 Cb 0.05 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.63 3ciy s ILE 114 CO -0.06 0.00 0.12 -0.94 -2.11 0.00 0.00 174.94 171.95 3ciy s SER 115 N -1.33 2.60 0.46 4.50 1.04 -1.26 -4.66 113.70 115.05 3ciy s SER 115 Ca -0.00 -1.62 0.31 0.00 0.48 0.00 0.00 55.95 55.12 3ciy s SER 115 Cb -0.01 0.41 1.42 0.00 0.10 0.00 0.00 66.02 67.95 3ciy s SER 115 CO -0.00 -0.88 1.68 -2.24 0.98 0.00 0.00 173.24 172.77 3ciy h ASP 116 N 1.88 0.22 -0.64 7.02 3.04 -1.84 -2.51 116.42 123.59 3ciy h ASP 116 Ca -0.36 0.09 0.12 0.00 -3.24 0.00 0.00 57.03 53.64 3ciy h ASP 116 Cb 1.27 0.07 -0.09 0.00 -1.04 0.00 0.00 39.33 39.53 3ciy h ASP 116 CO 0.58 -0.07 0.16 1.56 -2.04 0.00 0.00 179.24 179.42 3ciy h GLN 117 N 0.12 0.28 -1.14 4.15 1.08 -1.95 -3.10 115.11 114.55 3ciy h GLN 117 Ca 0.75 -0.02 0.34 0.00 -1.45 0.00 0.00 58.65 58.28 3ciy h GLN 117 Cb 2.47 -0.06 -0.12 0.00 -0.05 0.00 0.00 27.48 29.71 3ciy h GLN 117 CO -0.28 0.18 0.71 0.00 -0.95 0.00 0.00 178.83 178.50 3ciy h THR 118 N 0.29 0.31 -0.15 -0.54 1.03 -1.76 -2.45 112.91 109.64 3ciy h THR 118 Ca 0.34 -0.09 0.00 0.00 -0.01 0.00 0.00 66.41 66.65 3ciy h THR 118 Cb 0.51 0.03 0.00 0.00 -1.07 0.00 0.00 68.15 67.63 3ciy h THR 118 CO -0.41 0.05 0.00 0.49 -0.01 0.00 0.00 175.52 175.63 3ciy n PHE 119 N -4.76 0.20 -0.09 0.00 3.72 -1.18 -4.20 117.46 111.17 3ciy n PHE 119 Ca 0.31 -0.45 0.25 0.00 -0.05 0.00 0.00 57.45 57.51 3ciy n PHE 119 Cb 1.12 -0.04 0.72 0.00 -0.94 0.00 0.00 39.48 40.34 3ciy n PHE 119 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3ciy h VAL 120 N 0.99 0.54 -0.16 -4.37 2.07 -1.42 0.15 116.25 114.05 3ciy h VAL 120 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3ciy h VAL 120 Cb 0.58 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3ciy h VAL 120 CO 0.00 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.08 3ciy n PHE 121 N -4.14 0.18 -3.45 1.57 3.01 -1.26 -4.65 117.46 108.71 3ciy n PHE 121 Ca 0.14 -0.09 -0.42 0.00 1.01 0.00 0.00 57.45 58.09 3ciy n PHE 121 Cb 0.83 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.27 3ciy n PHE 121 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3ciy n THR 123 N 2.80 0.00 0.70 0.00 -2.24 -1.26 -3.93 114.28 110.35 3ciy n THR 123 Ca 0.21 -0.10 0.11 0.00 -2.27 0.00 0.00 64.05 62.00 3ciy n THR 123 Cb 0.39 0.99 -0.08 0.00 -2.10 0.00 0.00 70.33 69.53 3ciy n THR 123 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3ciy n ASN 124 N -1.42 0.68 -4.66 3.42 3.02 -1.26 -4.17 115.26 110.87 3ciy n ASN 124 Ca 0.03 -0.59 -0.47 0.00 -0.03 0.00 0.00 54.58 53.53 3ciy n ASN 124 Cb 0.27 1.13 -0.04 0.00 -0.61 0.00 0.00 39.78 40.53 3ciy n ASN 124 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3ciy n LEU 125 N -1.75 2.94 -0.01 3.41 7.94 -0.91 -4.50 117.00 124.12 3ciy n LEU 125 Ca 0.02 1.09 0.01 0.00 -1.11 0.00 0.00 56.01 56.02 3ciy n LEU 125 Cb 0.40 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 42.92 3ciy n LEU 125 CO 0.43 -0.38 -0.57 0.35 -1.11 0.00 0.00 177.39 176.11 3ciy n THR 126 N 3.24 0.06 -3.79 1.96 -2.24 0.23 -2.13 114.28 111.61 3ciy n THR 126 Ca 0.17 -0.11 -0.26 0.00 -2.27 0.00 0.00 64.05 61.58 3ciy n THR 126 Cb 0.28 0.11 -0.17 0.00 -2.10 0.00 0.00 70.33 68.45 3ciy n THR 126 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3ciy s GLU 127 N -2.25 0.82 -0.23 -0.78 2.12 -0.22 0.82 118.70 118.98 3ciy s GLU 127 Ca -0.02 -0.19 -0.02 0.00 0.36 0.00 0.00 54.97 55.11 3ciy s GLU 127 Cb 0.02 -1.56 0.01 0.00 0.26 0.00 0.00 34.13 32.87 3ciy s GLU 127 CO 0.17 -0.43 -0.08 -1.17 -0.54 0.00 0.00 175.26 173.21 3ciy s LEU 128 N 1.87 2.89 -0.23 2.70 2.96 -0.37 -1.63 118.68 126.86 3ciy s LEU 128 Ca 0.02 -0.68 -0.04 0.00 -0.22 0.00 0.00 54.13 53.21 3ciy s LEU 128 Cb -0.14 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.90 3ciy s LEU 128 CO -0.07 -0.07 -0.04 -0.62 -1.32 0.00 0.00 176.35 174.23 3ciy s ASP 129 N 1.36 4.33 -0.30 3.68 3.68 -0.27 -2.06 116.67 127.10 3ciy s ASP 129 Ca 0.03 -0.50 -0.03 0.00 2.13 0.00 0.00 52.55 54.18 3ciy s ASP 129 Cb -0.15 -1.73 0.11 0.00 -1.45 0.00 0.00 42.92 39.70 3ciy s ASP 129 CO -0.06 -0.05 0.16 -0.76 0.13 0.00 0.00 175.17 174.59 3ciy s LEU 130 N 1.45 0.48 -0.21 -1.34 1.43 -0.17 0.70 118.68 121.03 3ciy s LEU 130 Ca 0.05 -1.33 0.02 0.00 -1.03 0.00 0.00 54.13 51.84 3ciy s LEU 130 Cb -0.15 -0.23 -0.14 0.00 0.03 0.00 0.00 46.19 45.70 3ciy s LEU 130 CO -0.03 -0.42 -0.18 0.80 0.23 0.00 0.00 176.35 176.76 3ciy n MET 131 N 5.10 0.57 -3.52 1.70 1.56 -1.26 -3.21 117.12 118.06 3ciy n MET 131 Ca -0.03 0.12 -0.27 0.00 -0.27 0.00 0.00 57.70 57.25 3ciy n MET 131 Cb 0.42 -1.42 -0.10 0.00 2.15 0.00 0.00 33.22 34.27 3ciy n MET 131 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 3ciy n SER 132 N -3.09 1.78 -0.04 6.12 7.64 -1.26 -4.00 113.62 120.77 3ciy n SER 132 Ca -0.37 -2.96 0.01 0.00 1.01 0.00 0.00 58.87 56.56 3ciy n SER 132 Cb 0.90 -0.66 0.01 0.00 -1.01 0.00 0.00 64.21 63.46 3ciy n SER 132 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ciy n ASN 133 N 1.80 1.27 -3.85 6.43 4.13 -1.16 -1.10 115.26 122.78 3ciy n ASN 133 Ca 0.25 -1.79 -0.22 0.00 1.68 0.00 0.00 54.58 54.51 3ciy n ASN 133 Cb 0.43 -0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.62 3ciy n ASN 133 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 3ciy n SER 134 N -0.40 -1.68 -4.41 6.41 3.41 -1.25 -3.87 113.62 111.82 3ciy n SER 134 Ca 0.02 -0.62 -0.45 0.00 -0.26 0.00 0.00 58.87 57.56 3ciy n SER 134 Cb 0.40 -0.75 -0.02 0.00 -0.26 0.00 0.00 64.21 63.58 3ciy n SER 134 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ciy s ILE 135 N -4.23 5.09 0.39 -1.33 1.01 0.36 -4.61 121.20 117.88 3ciy s ILE 135 Ca 0.21 -2.10 0.08 0.00 0.00 0.00 0.00 60.65 58.85 3ciy s ILE 135 Cb -0.12 -4.71 0.20 0.00 0.01 0.00 0.00 42.46 37.84 3ciy s ILE 135 CO 0.46 -1.38 1.97 0.45 0.00 0.00 0.00 174.94 176.44 3ciy h HIS 136 N 8.16 0.38 -3.80 3.97 3.86 -1.64 -3.30 115.15 122.77 3ciy h HIS 136 Ca 0.17 -0.02 -0.28 0.00 -1.16 0.00 0.00 60.37 59.08 3ciy h HIS 136 Cb 1.00 -0.12 -0.15 0.00 1.06 0.00 0.00 27.41 29.20 3ciy h HIS 136 CO 1.10 0.36 -0.66 0.15 0.86 0.00 0.00 177.93 179.74 3ciy s LYS 137 N -5.04 1.10 -0.08 2.45 1.02 -1.26 -3.45 119.74 114.46 3ciy s LYS 137 Ca -0.07 -1.53 -0.03 0.00 0.02 0.00 0.00 55.97 54.36 3ciy s LYS 137 Cb 0.16 -0.24 0.05 0.00 -0.52 0.00 0.00 37.83 37.28 3ciy s LYS 137 CO 0.73 -0.14 0.16 0.42 -0.92 0.00 0.00 175.35 175.61 3ciy s ILE 138 N -3.68 -0.23 0.22 2.17 -1.09 -1.26 -4.82 121.20 112.51 3ciy s ILE 138 Ca 0.24 0.33 0.08 0.00 -2.23 0.00 0.00 60.65 59.06 3ciy s ILE 138 Cb 0.06 -0.29 -0.04 0.00 -1.58 0.00 0.00 42.46 40.61 3ciy s ILE 138 CO 0.04 0.14 0.04 -0.75 -1.23 0.00 0.00 174.94 173.17 3ciy s LYS 139 N 2.12 2.46 2.63 2.79 2.20 -1.26 -4.90 119.74 125.78 3ciy s LYS 139 Ca 0.01 -1.21 0.00 0.00 -0.36 0.00 0.00 55.97 54.41 3ciy s LYS 139 Cb -0.12 -2.32 0.00 0.00 -1.51 0.00 0.00 37.83 33.88 3ciy s LYS 139 CO -0.06 0.41 0.00 0.45 -0.36 0.00 0.00 175.35 175.79 3ciy n SER 140 N -0.61 -2.94 -3.69 1.43 2.88 -1.26 -4.35 113.62 105.08 3ciy n SER 140 Ca -0.08 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.16 3ciy n SER 140 Cb 0.57 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.95 3ciy n SER 140 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3ciy n ASN 141 N -2.43 3.95 -0.17 -3.46 3.02 -1.26 -4.00 115.26 110.90 3ciy n ASN 141 Ca 0.00 -3.35 0.29 0.00 -0.03 0.00 0.00 54.58 51.50 3ciy n ASN 141 Cb 0.00 -0.81 0.66 0.00 -0.61 0.00 0.00 39.78 39.02 3ciy n ASN 141 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3ciy h PRO 142 N 4.84 0.00 -0.52 3.52 0.11 -1.77 -2.25 132.00 135.94 3ciy h PRO 142 Ca 0.18 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 65.92 3ciy h PRO 142 Cb 0.70 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.53 3ciy h PRO 142 CO 0.87 0.00 -0.61 1.19 -0.21 0.00 0.00 178.00 179.24 3ciy n PHE 143 N -3.69 1.87 0.39 0.65 3.01 -1.26 -4.45 117.46 113.98 3ciy n PHE 143 Ca 0.20 -2.01 0.00 0.00 1.01 0.00 0.00 57.45 56.65 3ciy n PHE 143 Cb 1.18 -0.37 0.02 0.00 -0.01 0.00 0.00 39.48 40.29 3ciy n PHE 143 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3ciy n LYS 144 N -0.86 0.20 -0.01 -1.08 3.00 -0.85 -2.80 118.16 115.76 3ciy n LYS 144 Ca 0.37 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.65 3ciy n LYS 144 Cb 0.88 -1.05 -0.01 0.00 0.00 0.00 0.00 35.03 34.85 3ciy n LYS 144 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3ciy n ASN 145 N -0.55 0.40 -4.57 3.14 3.02 -1.26 -5.00 115.26 110.45 3ciy n ASN 145 Ca 0.00 0.06 -0.46 0.00 -0.03 0.00 0.00 54.58 54.15 3ciy n ASN 145 Cb 0.00 -0.15 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 3ciy n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ciy n GLN 146 N -3.23 1.80 -0.00 3.52 6.02 -1.12 -4.69 117.38 119.67 3ciy n GLN 146 Ca -0.05 0.54 0.03 0.00 -0.01 0.00 0.00 57.00 57.51 3ciy n GLN 146 Cb 0.45 -2.89 -0.04 0.00 1.02 0.00 0.00 30.24 28.79 3ciy n GLN 146 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3ciy n LYS 147 N 8.15 2.39 -0.26 -1.09 4.76 -1.26 -4.42 118.16 126.43 3ciy n LYS 147 Ca 0.31 -0.03 0.06 0.00 -2.87 0.00 0.00 58.31 55.79 3ciy n LYS 147 Cb 0.35 -0.97 0.19 0.00 -1.84 0.00 0.00 35.03 32.76 3ciy n LYS 147 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3ciy n ASN 148 N -1.45 3.23 -4.52 4.39 4.13 -1.26 -4.25 115.26 115.53 3ciy n ASN 148 Ca -0.00 -2.26 -0.43 0.00 1.68 0.00 0.00 54.58 53.57 3ciy n ASN 148 Cb 0.13 -0.32 -0.05 0.00 -1.54 0.00 0.00 39.78 37.99 3ciy n ASN 148 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3ciy s LEU 149 N -1.47 4.34 -0.09 3.41 2.96 -0.91 -3.66 118.68 123.27 3ciy s LEU 149 Ca 0.29 -0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 53.86 3ciy s LEU 149 Cb 0.18 -2.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 3ciy s LEU 149 CO 0.15 -0.95 -0.12 -0.38 -1.32 0.00 0.00 176.35 173.72 3ciy n ILE 150 N 6.05 0.83 -2.52 6.68 2.08 0.24 -4.31 119.36 128.41 3ciy n ILE 150 Ca 0.01 0.33 -0.41 0.00 0.56 0.00 0.00 62.75 63.23 3ciy n ILE 150 Cb 0.48 -2.01 -0.04 0.00 -0.75 0.00 0.00 39.64 37.32 3ciy n ILE 150 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3ciy s LYS 151 N -1.80 4.57 -0.42 0.38 1.02 -1.17 -2.28 119.74 120.04 3ciy s LYS 151 Ca -0.10 1.69 0.04 0.00 0.02 0.00 0.00 55.97 57.62 3ciy s LYS 151 Cb 0.01 -3.31 0.17 0.00 -0.52 0.00 0.00 37.83 34.18 3ciy s LYS 151 CO 0.15 0.01 0.42 -1.17 -0.92 0.00 0.00 175.35 173.84 3ciy s LEU 152 N 0.03 0.43 -0.41 3.17 1.98 -0.33 -1.24 118.68 122.33 3ciy s LEU 152 Ca 0.51 -2.37 -0.22 0.00 -2.89 0.00 0.00 54.13 49.16 3ciy s LEU 152 Cb -0.28 0.28 0.02 0.00 0.66 0.00 0.00 46.19 46.86 3ciy s LEU 152 CO 0.33 -0.18 0.74 -0.62 -1.89 0.00 0.00 176.35 174.73 3ciy s ASP 153 N 0.64 6.45 -0.52 3.68 -1.08 -0.87 -1.90 116.67 123.07 3ciy s ASP 153 Ca 0.27 0.06 0.04 0.00 -0.52 0.00 0.00 52.55 52.40 3ciy s ASP 153 Cb -0.04 -2.37 0.16 0.00 -1.46 0.00 0.00 42.92 39.21 3ciy s ASP 153 CO -0.11 -0.79 0.36 -0.22 0.52 0.00 0.00 175.17 174.93 3ciy s LEU 154 N 3.08 2.90 0.13 -1.34 0.20 0.38 -1.00 118.68 123.03 3ciy s LEU 154 Ca 0.29 -3.19 0.05 0.00 0.69 0.00 0.00 54.13 51.97 3ciy s LEU 154 Cb -0.13 -1.00 -0.04 0.00 -0.43 0.00 0.00 46.19 44.59 3ciy s LEU 154 CO 0.19 -0.17 -0.12 -0.44 -0.29 0.00 0.00 176.35 175.51 3ciy s SER 155 N -0.34 1.89 -1.87 3.68 0.01 -1.20 -3.92 113.70 111.95 3ciy s SER 155 Ca 0.26 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.65 3ciy s SER 155 Cb -0.08 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.11 3ciy s SER 155 CO -0.13 -0.21 0.00 1.57 0.41 0.00 0.00 173.24 174.89 3ciy n HIS 156 N 0.32 0.00 -0.73 2.43 -0.00 -0.78 -4.27 115.22 112.19 3ciy n HIS 156 Ca -0.14 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.66 3ciy n HIS 156 Cb 0.58 -3.10 0.34 0.00 -0.00 0.00 0.00 29.99 27.82 3ciy n HIS 156 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 3ciy n ASN 157 N -1.03 4.78 0.00 0.26 5.03 -1.26 -4.10 115.26 118.94 3ciy n ASN 157 Ca -0.18 -2.63 0.00 0.00 0.87 0.00 0.00 54.58 52.64 3ciy n ASN 157 Cb 0.61 -0.58 0.00 0.00 -1.02 0.00 0.00 39.78 38.79 3ciy n ASN 157 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3ciy n GLY 158 N 0.71 0.45 3.75 7.41 0.00 -1.26 0.13 105.19 116.38 3ciy n GLY 158 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 3ciy n GLY 158 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ciy s LEU 159 N 0.00 4.34 -0.00 0.99 2.01 -1.24 -4.26 118.68 120.52 3ciy s LEU 159 Ca 0.00 2.96 0.12 0.00 0.01 0.00 0.00 54.13 57.22 3ciy s LEU 159 Cb 0.00 -3.64 -0.14 0.00 0.01 0.00 0.00 46.19 42.43 3ciy s LEU 159 CO 0.00 -0.92 0.51 -0.24 1.01 0.00 0.00 176.35 176.71 3ciy n SER 160 N 2.05 0.64 -4.14 2.29 2.88 -1.22 -1.78 113.62 114.34 3ciy n SER 160 Ca 0.08 -0.75 -0.09 0.00 -1.33 0.00 0.00 58.87 56.77 3ciy n SER 160 Cb 0.37 1.02 -0.10 0.00 -0.75 0.00 0.00 64.21 64.76 3ciy n SER 160 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3ciy s SER 161 N -2.21 0.84 -0.07 -3.46 0.15 -1.26 -4.01 113.70 103.68 3ciy s SER 161 Ca 0.04 -1.03 0.14 0.00 0.70 0.00 0.00 55.95 55.80 3ciy s SER 161 Cb 0.09 0.15 -0.23 0.00 -1.71 0.00 0.00 66.02 64.32 3ciy s SER 161 CO 0.50 -0.54 0.55 0.35 1.20 0.00 0.00 173.24 175.30 3ciy n THR 162 N -0.00 1.56 -1.56 6.45 -2.24 -1.26 -4.95 114.28 112.27 3ciy n THR 162 Ca -0.12 -0.81 -0.49 0.00 -2.27 0.00 0.00 64.05 60.37 3ciy n THR 162 Cb 0.61 -0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 67.89 3ciy n THR 162 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3ciy n LYS 163 N -2.98 1.01 -0.34 -0.78 4.81 -1.09 -4.88 118.16 113.91 3ciy n LYS 163 Ca -0.20 0.36 0.01 0.00 -0.87 0.00 0.00 58.31 57.61 3ciy n LYS 163 Cb 1.07 -1.79 0.01 0.00 0.02 0.00 0.00 35.03 34.34 3ciy n LYS 163 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3ciy n LEU 164 N 1.87 0.21 0.00 3.14 4.77 -1.26 -4.86 117.00 120.87 3ciy n LEU 164 Ca 0.15 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 3ciy n LEU 164 Cb 0.25 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3ciy n LEU 164 CO 0.60 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 3ciy n GLY 165 N -0.11 2.49 0.00 -0.72 0.00 -1.26 -4.42 105.19 101.18 3ciy n GLY 165 Ca 0.01 -1.08 0.05 0.00 0.00 0.00 0.00 46.02 45.00 3ciy n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ciy n THR 166 N -1.08 0.00 -3.61 2.61 -2.24 -1.26 -4.59 114.28 104.12 3ciy n THR 166 Ca 0.00 -0.25 -0.20 0.00 -2.27 0.00 0.00 64.05 61.34 3ciy n THR 166 Cb 0.00 0.75 -0.01 0.00 -2.10 0.00 0.00 70.33 68.97 3ciy n THR 166 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3ciy s GLY 167 N -2.46 1.48 -0.73 3.38 0.00 -1.26 -4.82 107.32 102.91 3ciy s GLY 167 Ca 0.01 -1.38 -0.23 0.00 0.00 0.00 0.00 44.72 43.12 3ciy s GLY 167 CO 0.46 -1.32 1.09 0.14 0.00 0.00 0.00 173.10 173.46 3ciy s VAL 168 N -2.13 4.20 0.20 1.40 1.01 -1.26 -4.59 120.40 119.24 3ciy s VAL 168 Ca 0.42 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.08 3ciy s VAL 168 Cb -0.09 -4.77 -0.01 0.00 0.00 0.00 0.00 36.38 31.51 3ciy s VAL 168 CO 0.31 -1.59 0.05 0.00 0.00 0.00 0.00 175.10 173.87 3ciy n GLN 169 N 8.06 0.94 -2.82 2.72 10.64 -1.01 -4.85 117.38 131.07 3ciy n GLN 169 Ca 0.03 -1.63 -0.11 0.00 -1.83 0.00 0.00 57.00 53.45 3ciy n GLN 169 Cb 0.47 0.77 0.05 0.00 -0.86 0.00 0.00 30.24 30.67 3ciy n GLN 169 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 3ciy n LEU 170 N 0.00 -4.76 -0.33 2.61 7.99 -1.26 -4.69 117.00 116.56 3ciy n LEU 170 Ca -0.05 -0.53 -0.09 0.00 -0.01 0.00 0.00 56.01 55.33 3ciy n LEU 170 Cb 0.29 -2.55 -0.08 0.00 -0.11 0.00 0.00 43.42 40.97 3ciy n LEU 170 CO 0.15 0.07 0.48 -0.33 -1.51 0.00 0.00 177.39 176.26 3ciy h GLU 171 N -0.81 -0.00 -3.92 3.23 4.39 -1.83 -3.31 114.58 112.31 3ciy h GLU 171 Ca -0.46 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 58.58 3ciy h GLU 171 Cb 1.23 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 29.50 3ciy h GLU 171 CO 0.33 -0.00 -0.59 -0.80 -1.16 0.00 0.00 179.01 176.79 3ciy s ASN 172 N -4.98 4.76 -0.06 1.42 0.01 -1.26 -4.33 114.94 110.50 3ciy s ASN 172 Ca -0.10 -2.62 0.05 0.00 -0.71 0.00 0.00 52.86 49.49 3ciy s ASN 172 Cb 0.09 -1.71 -0.01 0.00 0.41 0.00 0.00 41.25 40.03 3ciy s ASN 172 CO 0.49 -0.34 -0.22 -0.22 -1.51 0.00 0.00 177.10 175.30 3ciy s LEU 173 N 0.27 2.00 0.00 0.60 2.96 -1.25 -4.11 118.68 119.15 3ciy s LEU 173 Ca 0.14 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 3ciy s LEU 173 Cb -0.22 -1.21 0.00 0.00 0.50 0.00 0.00 46.19 45.26 3ciy s LEU 173 CO -0.03 0.20 0.40 0.00 -1.32 0.00 0.00 176.35 175.59 3ciy n GLN 174 N 3.09 1.30 -3.51 1.98 6.02 -1.14 -3.67 117.38 121.45 3ciy n GLN 174 Ca -0.18 -0.41 -0.07 0.00 -0.01 0.00 0.00 57.00 56.34 3ciy n GLN 174 Cb 0.52 -0.89 -0.08 0.00 1.02 0.00 0.00 30.24 30.82 3ciy n GLN 174 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3ciy s GLU 175 N -0.38 0.38 -0.38 -1.09 2.02 -0.97 -1.25 118.70 117.02 3ciy s GLU 175 Ca 0.01 0.90 0.03 0.00 0.02 0.00 0.00 54.97 55.94 3ciy s GLU 175 Cb 0.01 0.13 0.11 0.00 0.10 0.00 0.00 34.13 34.48 3ciy s GLU 175 CO 0.02 -0.41 0.11 -1.17 0.02 0.00 0.00 175.26 173.83 3ciy s LEU 176 N 2.64 4.76 -0.35 1.80 2.96 -1.03 -1.18 118.68 128.27 3ciy s LEU 176 Ca 0.05 -2.30 -0.20 0.00 -0.22 0.00 0.00 54.13 51.46 3ciy s LEU 176 Cb -0.13 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.90 3ciy s LEU 176 CO -0.15 -0.37 0.60 -0.76 -1.32 0.00 0.00 176.35 174.35 3ciy s LEU 177 N 0.71 4.29 -0.36 -0.68 1.02 -0.80 -2.30 118.68 120.56 3ciy s LEU 177 Ca 0.12 0.09 0.00 0.00 0.02 0.00 0.00 54.13 54.36 3ciy s LEU 177 Cb -0.21 -2.73 0.14 0.00 0.02 0.00 0.00 46.19 43.42 3ciy s LEU 177 CO -0.06 -0.56 0.22 -0.76 0.02 0.00 0.00 176.35 175.20 3ciy s LEU 178 N 2.62 1.08 0.18 1.79 1.43 -1.13 -0.47 118.68 124.17 3ciy s LEU 178 Ca 0.23 -2.24 -0.00 0.00 -1.03 0.00 0.00 54.13 51.08 3ciy s LEU 178 Cb -0.15 -0.43 -0.04 0.00 0.03 0.00 0.00 46.19 45.60 3ciy s LEU 178 CO 0.14 -0.30 0.08 0.00 0.23 0.00 0.00 176.35 176.50 3ciy s ALA 179 N 1.00 1.14 -1.83 4.21 0.00 -1.26 -3.19 121.76 121.83 3ciy s ALA 179 Ca 0.19 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.53 3ciy s ALA 179 Cb -0.22 1.03 0.00 0.00 0.00 0.00 0.00 23.12 23.93 3ciy s ALA 179 CO 0.00 -0.50 0.00 1.63 0.00 0.00 0.00 175.76 176.89 3ciy n LYS 180 N -0.22 -1.43 -2.79 0.00 5.02 0.25 -1.87 118.16 117.12 3ciy n LYS 180 Ca -0.02 1.04 -0.17 0.00 -2.02 0.00 0.00 58.31 57.14 3ciy n LYS 180 Cb 0.65 -5.38 0.05 0.00 -0.02 0.00 0.00 35.03 30.33 3ciy n LYS 180 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3ciy n ASN 181 N -1.05 1.89 -2.43 4.39 3.02 -1.26 -3.52 115.26 116.30 3ciy n ASN 181 Ca -0.17 -2.35 -0.29 0.00 -0.03 0.00 0.00 54.58 51.74 3ciy n ASN 181 Cb 0.59 -0.31 0.02 0.00 -0.61 0.00 0.00 39.78 39.47 3ciy n ASN 181 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ciy n LYS 182 N -2.00 3.29 -2.54 3.52 5.02 -0.73 -3.96 118.16 120.76 3ciy n LYS 182 Ca 0.12 -4.15 -0.42 0.00 -2.02 0.00 0.00 58.31 51.84 3ciy n LYS 182 Cb 0.51 -2.26 -0.03 0.00 -0.02 0.00 0.00 35.03 33.22 3ciy n LYS 182 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ciy s ILE 183 N -5.17 4.25 -0.14 -0.18 1.09 -1.24 -4.44 121.20 115.36 3ciy s ILE 183 Ca 0.51 1.70 0.19 0.00 -1.10 0.00 0.00 60.65 61.94 3ciy s ILE 183 Cb 0.42 -4.09 -0.15 0.00 -1.06 0.00 0.00 42.46 37.58 3ciy s ILE 183 CO -0.16 0.18 0.74 0.18 -0.10 0.00 0.00 174.94 175.78 3ciy n LEU 184 N 3.48 0.64 -3.81 2.97 4.32 -1.26 -3.36 117.00 119.99 3ciy n LEU 184 Ca 0.06 0.27 -0.03 0.00 -0.02 0.00 0.00 56.01 56.30 3ciy n LEU 184 Cb 0.48 0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.36 3ciy n LEU 184 CO 0.54 0.09 0.79 0.00 -1.22 0.00 0.00 177.39 177.59 3ciy s ALA 185 N -3.06 -1.67 -0.05 -1.18 0.00 -1.26 -1.98 121.76 112.57 3ciy s ALA 185 Ca -0.04 -0.06 0.04 0.00 0.00 0.00 0.00 51.96 51.89 3ciy s ALA 185 Cb 0.09 0.68 0.00 0.00 0.00 0.00 0.00 23.12 23.89 3ciy s ALA 185 CO 0.82 -1.06 -0.15 -0.51 0.00 0.00 0.00 175.76 174.87 3ciy s LEU 186 N -3.18 1.84 0.25 0.00 1.02 -1.20 -4.81 118.68 112.61 3ciy s LEU 186 Ca 0.17 -0.32 0.12 0.00 0.02 0.00 0.00 54.13 54.12 3ciy s LEU 186 Cb -0.01 -0.88 -0.05 0.00 0.02 0.00 0.00 46.19 45.27 3ciy s LEU 186 CO 0.03 0.11 -0.20 -0.13 0.02 0.00 0.00 176.35 176.19 3ciy s ARG 187 N 0.20 1.69 0.00 1.70 0.52 -1.26 -1.31 118.95 120.49 3ciy s ARG 187 Ca -0.06 -1.66 0.13 0.00 -0.52 0.00 0.00 55.73 53.62 3ciy s ARG 187 Cb -0.12 -1.83 0.70 0.00 0.52 0.00 0.00 34.95 34.21 3ciy s ARG 187 CO 0.02 0.36 1.30 0.45 0.02 0.00 0.00 175.30 177.45 3ciy n SER 188 N -0.35 0.00 -0.12 0.23 2.88 -1.26 -3.09 113.62 111.91 3ciy n SER 188 Ca -0.08 -0.04 -0.25 0.00 -1.33 0.00 0.00 58.87 57.17 3ciy n SER 188 Cb 0.59 -0.21 -0.09 0.00 -0.75 0.00 0.00 64.21 63.75 3ciy n SER 188 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3ciy n GLU 189 N -1.21 0.52 -0.02 -1.46 4.71 -1.26 -3.88 120.64 118.04 3ciy n GLU 189 Ca 0.07 0.22 0.08 0.00 -0.01 0.00 0.00 57.16 57.52 3ciy n GLU 189 Cb 0.09 -1.38 0.40 0.00 -1.01 0.00 0.00 31.44 29.54 3ciy n GLU 189 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 3ciy n GLU 190 N -4.02 1.16 -0.02 3.49 0.28 -1.24 -3.32 120.64 116.98 3ciy n GLU 190 Ca -0.48 -0.24 0.00 0.00 -0.16 0.00 0.00 57.16 56.28 3ciy n GLU 190 Cb 0.85 -1.25 -0.05 0.00 1.43 0.00 0.00 31.44 32.42 3ciy n GLU 190 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3ciy n LEU 191 N -0.49 0.00 0.00 -1.84 7.99 -1.18 -2.68 117.00 118.80 3ciy n LEU 191 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.12 3ciy n LEU 191 Cb 0.11 0.08 0.00 0.00 -0.11 0.00 0.00 43.42 43.49 3ciy n LEU 191 CO 0.09 0.08 0.42 -1.84 -1.51 0.00 0.00 177.39 174.63 3ciy n GLU 192 N -1.98 0.00 0.00 3.23 0.28 -1.21 -2.86 120.64 118.09 3ciy n GLU 192 Ca -0.06 0.34 0.04 0.00 -0.16 0.00 0.00 57.16 57.32 3ciy n GLU 192 Cb 0.44 -1.51 0.23 0.00 1.43 0.00 0.00 31.44 32.04 3ciy n GLU 192 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 3ciy n PHE 193 N -1.33 0.00 -3.84 -1.84 1.16 -1.26 -3.97 117.46 106.38 3ciy n PHE 193 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.24 3ciy n PHE 193 Cb 0.01 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 37.75 3ciy n PHE 193 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3ciy s LEU 194 N -1.97 5.06 -0.16 5.98 1.43 -1.14 -2.40 118.68 125.49 3ciy s LEU 194 Ca 0.12 -2.26 -0.15 0.00 -1.03 0.00 0.00 54.13 50.81 3ciy s LEU 194 Cb 0.05 -1.77 -0.12 0.00 0.03 0.00 0.00 46.19 44.39 3ciy s LEU 194 CO 0.09 -0.46 0.13 1.23 0.23 0.00 0.00 176.35 177.58 3ciy h GLY 195 N 7.68 0.00 -0.02 -3.19 0.00 -1.82 -3.17 103.07 102.54 3ciy h GLY 195 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 3ciy h GLY 195 CO 0.66 0.00 -0.01 1.16 0.00 0.00 0.00 176.54 178.34 3ciy n ASN 196 N -4.58 2.22 -4.69 0.19 0.23 -1.26 -4.09 115.26 103.29 3ciy n ASN 196 Ca -0.15 -2.87 -0.42 0.00 -0.53 0.00 0.00 54.58 50.61 3ciy n ASN 196 Cb 0.40 -0.35 -0.03 0.00 -2.08 0.00 0.00 39.78 37.73 3ciy n ASN 196 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 3ciy s SER 197 N -2.50 6.96 -0.40 0.53 0.01 -1.26 -4.85 113.70 112.20 3ciy s SER 197 Ca 0.26 1.97 0.01 0.00 1.31 0.00 0.00 55.95 59.50 3ciy s SER 197 Cb 0.22 -2.56 0.11 0.00 0.21 0.00 0.00 66.02 64.00 3ciy s SER 197 CO 0.02 -0.63 0.14 -0.55 0.41 0.00 0.00 173.24 172.64 3ciy s SER 198 N 1.59 4.92 -0.03 2.44 0.15 -1.26 -1.82 113.70 119.69 3ciy s SER 198 Ca 0.60 -2.24 -0.30 0.00 0.70 0.00 0.00 55.95 54.71 3ciy s SER 198 Cb -0.28 -1.71 -0.03 0.00 -1.71 0.00 0.00 66.02 62.29 3ciy s SER 198 CO 0.25 -0.42 1.05 -0.76 1.20 0.00 0.00 173.24 174.55 3ciy s LEU 199 N 0.81 4.33 -0.03 3.45 1.43 -0.83 -4.45 118.68 123.39 3ciy s LEU 199 Ca 0.11 1.70 -0.00 0.00 -1.03 0.00 0.00 54.13 54.91 3ciy s LEU 199 Cb -0.21 -3.57 -0.26 0.00 0.03 0.00 0.00 46.19 42.18 3ciy s LEU 199 CO -0.06 -0.38 0.74 -0.09 0.23 0.00 0.00 176.35 176.79 3ciy h ARG 200 N 6.96 0.19 -3.04 1.70 2.43 -1.52 -2.10 114.38 119.00 3ciy h ARG 200 Ca -0.38 -0.33 -0.47 0.00 -0.81 0.00 0.00 59.98 58.00 3ciy h ARG 200 Cb 1.19 0.12 -0.41 0.00 -0.42 0.00 0.00 29.97 30.46 3ciy h ARG 200 CO 0.80 1.00 -0.75 0.21 -1.51 0.00 0.00 179.97 179.72 3ciy s LYS 201 N -2.61 0.11 -0.47 0.20 2.20 -0.38 -1.05 119.74 117.73 3ciy s LYS 201 Ca -0.10 -0.15 -0.04 0.00 -0.36 0.00 0.00 55.97 55.31 3ciy s LYS 201 Cb 0.07 -1.76 0.12 0.00 -1.51 0.00 0.00 37.83 34.75 3ciy s LYS 201 CO 0.83 -0.71 0.29 -1.17 -0.36 0.00 0.00 175.35 174.23 3ciy s LEU 202 N 2.12 5.38 0.37 5.43 2.96 -1.14 -2.47 118.68 131.32 3ciy s LEU 202 Ca 0.03 -2.19 -0.25 0.00 -0.22 0.00 0.00 54.13 51.50 3ciy s LEU 202 Cb -0.16 -1.88 -0.09 0.00 0.50 0.00 0.00 46.19 44.56 3ciy s LEU 202 CO -0.12 -0.54 1.03 -0.62 -1.32 0.00 0.00 176.35 174.77 3ciy s ASP 203 N 1.78 6.97 -0.39 3.68 3.68 -0.97 -2.59 116.67 128.83 3ciy s ASP 203 Ca 0.10 2.01 0.10 0.00 2.13 0.00 0.00 52.55 56.89 3ciy s ASP 203 Cb -0.23 -2.59 0.40 0.00 -1.45 0.00 0.00 42.92 39.05 3ciy s ASP 203 CO -0.03 -0.34 1.30 0.18 0.13 0.00 0.00 175.17 176.41 3ciy n LEU 204 N 0.23 -1.43 -4.91 -1.34 4.77 -0.05 -2.83 117.00 111.44 3ciy n LEU 204 Ca 0.03 -3.49 -0.27 0.00 -0.03 0.00 0.00 56.01 52.25 3ciy n LEU 204 Cb 0.49 0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.68 3ciy n LEU 204 CO 0.46 1.85 0.48 -0.44 -1.33 0.00 0.00 177.39 178.41 3ciy s SER 205 N -1.47 5.94 0.00 -1.43 0.01 -1.04 -4.19 113.70 111.51 3ciy s SER 205 Ca 0.23 0.81 0.00 0.00 1.31 0.00 0.00 55.95 58.30 3ciy s SER 205 Cb 0.41 -1.97 0.00 0.00 0.21 0.00 0.00 66.02 64.67 3ciy s SER 205 CO -0.07 -0.81 0.00 -1.20 0.41 0.00 0.00 173.24 171.57 3ciy n SER 206 N -2.41 0.00 -4.69 2.44 7.64 0.43 0.87 113.62 117.90 3ciy n SER 206 Ca 0.03 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.48 3ciy n SER 206 Cb 0.56 -2.02 -0.03 0.00 -1.01 0.00 0.00 64.21 61.72 3ciy n SER 206 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3ciy s ASN 207 N -1.87 7.03 -1.28 6.43 0.01 -1.25 -4.55 114.94 119.46 3ciy s ASN 207 Ca 0.00 1.84 -0.15 0.00 -0.71 0.00 0.00 52.86 53.84 3ciy s ASN 207 Cb 0.00 -2.56 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 3ciy s ASN 207 CO 0.00 -0.60 2.27 -0.81 -1.51 0.00 0.00 177.10 176.45 3ciy n PRO 208 N 5.22 2.61 -2.65 -0.60 -0.04 -1.21 -4.49 135.00 133.84 3ciy n PRO 208 Ca 0.11 -2.27 -0.41 0.00 -0.04 0.00 0.00 63.50 60.89 3ciy n PRO 208 Cb 0.46 -3.06 -0.04 0.00 -0.04 0.00 0.00 33.50 30.82 3ciy n PRO 208 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ciy s LEU 209 N 1.47 4.47 -0.00 1.53 1.43 -1.23 -4.40 118.68 121.94 3ciy s LEU 209 Ca 0.52 1.87 0.01 0.00 -1.03 0.00 0.00 54.13 55.50 3ciy s LEU 209 Cb 0.14 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.76 3ciy s LEU 209 CO -0.03 -0.16 0.03 0.29 0.23 0.00 0.00 176.35 176.71 3ciy n LYS 210 N 2.94 1.92 -3.70 1.70 5.02 -0.84 -4.85 118.16 120.35 3ciy n LYS 210 Ca 0.03 -0.01 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 3ciy n LYS 210 Cb 0.48 -0.89 -0.09 0.00 -0.02 0.00 0.00 35.03 34.51 3ciy n LYS 210 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3ciy s GLU 211 N -1.81 0.60 -0.77 1.97 -1.05 -1.25 -5.00 118.70 111.40 3ciy s GLU 211 Ca -0.00 0.72 -0.04 0.00 -0.15 0.00 0.00 54.97 55.50 3ciy s GLU 211 Cb 0.01 0.29 0.19 0.00 -0.44 0.00 0.00 34.13 34.18 3ciy s GLU 211 CO 0.05 -0.07 0.63 -0.06 0.95 0.00 0.00 175.26 176.75 3ciy s PHE 212 N 0.30 3.65 0.06 4.83 0.08 -1.26 -3.21 117.98 122.43 3ciy s PHE 212 Ca -0.00 -2.78 -0.37 0.00 0.12 0.00 0.00 56.93 53.89 3ciy s PHE 212 Cb -0.04 -3.28 -0.19 0.00 -0.57 0.00 0.00 43.02 38.94 3ciy s PHE 212 CO 0.00 -0.81 1.03 0.45 -0.10 0.00 0.00 175.22 175.79 3ciy n SER 213 N 3.02 0.13 -4.47 1.36 2.88 -0.42 -4.77 113.62 111.35 3ciy n SER 213 Ca 0.14 1.15 -0.47 0.00 -1.33 0.00 0.00 58.87 58.36 3ciy n SER 213 Cb 0.38 -0.99 -0.03 0.00 -0.75 0.00 0.00 64.21 62.83 3ciy n SER 213 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3ciy n PRO 214 N 1.57 0.46 -2.16 -1.46 -0.04 -1.26 -2.02 135.00 130.09 3ciy n PRO 214 Ca 0.19 0.16 -0.15 0.00 -0.04 0.00 0.00 63.50 63.66 3ciy n PRO 214 Cb 0.14 -1.31 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 3ciy n PRO 214 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ciy n GLY 215 N 1.74 0.03 0.11 0.55 0.00 -1.26 -4.28 105.19 102.08 3ciy n GLY 215 Ca 0.15 -0.26 0.04 0.00 0.00 0.00 0.00 46.02 45.96 3ciy n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ciy n PHE 217 N -0.41 0.00 0.24 0.00 3.72 -1.26 -4.67 117.46 115.08 3ciy n PHE 217 Ca 0.07 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.53 3ciy n PHE 217 Cb 0.08 0.00 0.30 0.00 -0.94 0.00 0.00 39.48 38.91 3ciy n PHE 217 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ciy n GLN 218 N -0.78 0.07 0.00 -1.08 1.13 -1.22 -1.23 117.38 114.27 3ciy n GLN 218 Ca 0.00 0.45 0.12 0.00 -1.94 0.00 0.00 57.00 55.63 3ciy n GLN 218 Cb 0.08 -1.67 0.15 0.00 0.11 0.00 0.00 30.24 28.91 3ciy n GLN 218 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3ciy n THR 219 N -1.80 0.00 -3.27 5.09 -2.24 -1.25 -4.87 114.28 105.94 3ciy n THR 219 Ca 0.01 -0.07 -0.38 0.00 -2.27 0.00 0.00 64.05 61.33 3ciy n THR 219 Cb 0.09 0.63 -0.06 0.00 -2.10 0.00 0.00 70.33 68.90 3ciy n THR 219 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ciy s ILE 220 N -2.79 5.04 0.01 2.28 -1.09 -0.37 -4.53 121.20 119.75 3ciy s ILE 220 Ca 0.15 1.10 -0.01 0.00 -2.23 0.00 0.00 60.65 59.65 3ciy s ILE 220 Cb 0.18 -3.87 -0.00 0.00 -1.58 0.00 0.00 42.46 37.18 3ciy s ILE 220 CO 0.68 0.39 1.02 1.23 -1.23 0.00 0.00 174.94 177.03 3ciy h GLY 221 N 6.03 -2.52 -6.41 6.18 0.00 -1.33 -3.41 103.07 101.61 3ciy h GLY 221 Ca -0.44 1.10 -0.16 0.00 0.00 0.00 0.00 47.33 47.83 3ciy h GLY 221 CO 0.71 -0.95 -0.48 0.54 0.00 0.00 0.00 176.54 176.37 3ciy s LYS 222 N -3.11 0.32 -0.48 4.80 1.02 -1.02 -4.94 119.74 116.32 3ciy s LYS 222 Ca -0.01 0.59 -0.11 0.00 0.02 0.00 0.00 55.97 56.47 3ciy s LYS 222 Cb 0.00 -0.40 0.12 0.00 -0.52 0.00 0.00 37.83 37.03 3ciy s LYS 222 CO 0.03 -0.56 0.37 -1.17 -0.92 0.00 0.00 175.35 173.10 3ciy s LEU 223 N 2.53 5.74 -0.00 3.17 2.96 -1.26 -1.97 118.68 129.84 3ciy s LEU 223 Ca 0.09 -1.82 -0.02 0.00 -0.22 0.00 0.00 54.13 52.16 3ciy s LEU 223 Cb -0.15 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 3ciy s LEU 223 CO -0.15 -0.71 0.40 -0.26 -1.32 0.00 0.00 176.35 174.31 3ciy h PHE 224 N 8.55 -0.06 -2.11 5.38 0.04 -1.53 -2.73 116.94 124.48 3ciy h PHE 224 Ca -0.23 -0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.09 3ciy h PHE 224 Cb 1.08 0.02 0.01 0.00 2.20 0.00 0.00 35.95 39.26 3ciy h PHE 224 CO 0.65 -0.04 -0.26 0.00 -0.60 0.00 0.00 178.31 178.07 3ciy s ALA 225 N -3.10 4.08 -0.10 2.45 0.00 -0.22 -0.38 121.76 124.50 3ciy s ALA 225 Ca -0.01 -1.33 -0.27 0.00 0.00 0.00 0.00 51.96 50.35 3ciy s ALA 225 Cb 0.00 -1.83 0.06 0.00 0.00 0.00 0.00 23.12 21.35 3ciy s ALA 225 CO 0.03 -0.16 0.62 -1.17 0.00 0.00 0.00 175.76 175.08 3ciy s LEU 226 N -4.31 -0.41 -0.35 0.00 2.96 -1.06 -2.89 118.68 112.62 3ciy s LEU 226 Ca 0.46 0.79 0.00 0.00 -0.22 0.00 0.00 54.13 55.16 3ciy s LEU 226 Cb -0.10 2.29 0.14 0.00 0.50 0.00 0.00 46.19 49.02 3ciy s LEU 226 CO 0.33 -0.49 0.25 -0.76 -1.32 0.00 0.00 176.35 174.36 3ciy s LEU 227 N -0.81 0.63 -0.44 -0.68 1.43 -1.07 -2.65 118.68 115.09 3ciy s LEU 227 Ca -0.09 -1.90 0.00 0.00 -1.03 0.00 0.00 54.13 51.12 3ciy s LEU 227 Cb -0.02 -0.12 0.39 0.00 0.03 0.00 0.00 46.19 46.46 3ciy s LEU 227 CO 0.07 -0.31 1.91 0.18 0.23 0.00 0.00 176.35 178.42 3ciy n LEU 228 N 4.26 6.64 -4.68 1.79 4.77 -0.72 -0.87 117.00 128.18 3ciy n LEU 228 Ca 0.10 -3.54 -0.43 0.00 -0.03 0.00 0.00 56.01 52.11 3ciy n LEU 228 Cb 0.40 -0.93 -0.01 0.00 -2.33 0.00 0.00 43.42 40.55 3ciy n LEU 228 CO 0.11 1.20 0.85 0.59 -1.33 0.00 0.00 177.39 178.81 3ciy n ASN 229 N -0.43 2.53 -3.73 -1.43 3.02 -1.25 -3.52 115.26 110.45 3ciy n ASN 229 Ca 0.46 1.20 -0.28 0.00 -0.03 0.00 0.00 54.58 55.93 3ciy n ASN 229 Cb 0.88 -1.45 0.01 0.00 -0.61 0.00 0.00 39.78 38.60 3ciy n ASN 229 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3ciy n ASN 230 N 0.87 -4.86 -0.08 6.41 4.05 0.61 -0.43 115.26 121.82 3ciy n ASN 230 Ca 0.06 -0.80 0.01 0.00 0.45 0.00 0.00 54.58 54.29 3ciy n ASN 230 Cb 0.35 -1.57 0.01 0.00 1.23 0.00 0.00 39.78 39.80 3ciy n ASN 230 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3ciy n ALA 231 N -2.10 1.53 -3.47 5.20 0.00 -1.23 -1.21 120.51 119.23 3ciy n ALA 231 Ca -0.27 -0.89 -0.28 0.00 0.00 0.00 0.00 53.44 52.00 3ciy n ALA 231 Cb 0.69 -0.10 0.02 0.00 0.00 0.00 0.00 19.45 20.06 3ciy n ALA 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3ciy n GLN 232 N -0.26 -1.84 -4.03 0.00 6.02 -1.26 -4.10 117.38 111.91 3ciy n GLN 232 Ca 0.01 1.34 -0.35 0.00 -0.01 0.00 0.00 57.00 57.99 3ciy n GLN 232 Cb 0.47 -2.88 -0.08 0.00 1.02 0.00 0.00 30.24 28.77 3ciy n GLN 232 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3ciy s LEU 233 N -3.30 3.96 0.37 1.08 1.02 -1.26 -4.89 118.68 115.66 3ciy s LEU 233 Ca 0.23 0.22 -0.10 0.00 0.02 0.00 0.00 54.13 54.50 3ciy s LEU 233 Cb -0.03 -1.97 -0.06 0.00 0.02 0.00 0.00 46.19 44.14 3ciy s LEU 233 CO 0.86 0.28 0.71 0.21 0.02 0.00 0.00 176.35 178.44 3ciy s ASN 234 N -0.29 6.53 0.60 2.29 2.47 -1.26 -2.88 114.94 122.40 3ciy s ASN 234 Ca 0.09 1.04 0.29 0.00 0.42 0.00 0.00 52.86 54.70 3ciy s ASN 234 Cb -0.12 -2.28 1.49 0.00 -1.45 0.00 0.00 41.25 38.88 3ciy s ASN 234 CO 0.01 -0.33 1.89 -0.65 -3.72 0.00 0.00 177.10 174.31 3ciy h PRO 235 N 1.47 0.00 0.00 0.43 0.11 -1.87 0.24 132.00 132.38 3ciy h PRO 235 Ca -0.47 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.48 3ciy h PRO 235 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 3ciy h PRO 235 CO 0.65 0.00 -0.86 1.25 -0.21 0.00 0.00 178.00 178.83 3ciy h HIS 236 N 0.00 0.00 -0.92 0.65 2.76 -1.96 -0.50 115.15 115.18 3ciy h HIS 236 Ca 0.18 0.00 0.19 0.00 -2.20 0.00 0.00 60.37 58.54 3ciy h HIS 236 Cb 1.10 0.00 -0.11 0.00 1.55 0.00 0.00 27.41 29.96 3ciy h HIS 236 CO 0.00 1.31 0.50 -0.07 -1.30 0.00 0.00 177.93 178.36 3ciy h LEU 237 N -1.00 0.58 0.72 0.26 4.07 -1.71 1.54 115.31 119.76 3ciy h LEU 237 Ca -0.24 0.11 -0.04 0.00 0.08 0.00 0.00 57.88 57.80 3ciy h LEU 237 Cb 1.19 0.03 0.01 0.00 1.08 0.00 0.00 40.66 42.96 3ciy h LEU 237 CO -0.14 0.17 -0.35 0.74 -1.08 0.00 0.00 178.44 177.78 3ciy h THR 238 N 0.61 0.09 -0.99 0.22 2.02 -0.66 0.58 112.91 114.77 3ciy h THR 238 Ca 0.54 -0.26 0.24 0.00 0.77 0.00 0.00 66.41 67.70 3ciy h THR 238 Cb 0.89 0.12 -0.12 0.00 -1.74 0.00 0.00 68.15 67.30 3ciy h THR 238 CO -0.42 0.01 0.57 -0.08 0.37 0.00 0.00 175.52 175.97 3ciy h GLU 239 N -1.20 0.56 0.17 6.66 4.81 0.70 -1.87 114.58 124.41 3ciy h GLU 239 Ca -0.10 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 3ciy h GLU 239 Cb 0.76 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3ciy h GLU 239 CO 0.16 0.37 -0.08 -0.22 -0.73 0.00 0.00 179.01 178.51 3ciy h LYS 240 N 0.58 -0.22 -1.04 1.92 3.64 0.22 -3.29 116.57 118.38 3ciy h LYS 240 Ca 0.63 0.01 0.41 0.00 -1.27 0.00 0.00 60.65 60.43 3ciy h LYS 240 Cb 1.17 0.05 -0.17 0.00 -0.41 0.00 0.00 32.23 32.86 3ciy h LYS 240 CO -0.47 0.13 0.58 1.25 -2.27 0.00 0.00 179.45 178.67 3ciy h LEU 241 N -0.96 0.34 -0.50 5.20 5.85 0.71 -1.41 115.31 124.53 3ciy h LEU 241 Ca -0.02 0.24 0.10 0.00 0.84 0.00 0.00 57.88 59.03 3ciy h LEU 241 Cb 0.45 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.61 3ciy h LEU 241 CO 0.04 -0.37 -0.25 0.00 -0.34 0.00 0.00 178.44 177.52 3ciy h TRP 243 N -0.14 0.16 0.00 0.00 6.55 -1.42 0.27 115.95 121.36 3ciy h TRP 243 Ca 0.23 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.07 3ciy h TRP 243 Cb 0.50 -0.05 0.00 0.00 -0.86 0.00 0.00 29.16 28.75 3ciy h TRP 243 CO -0.53 0.08 0.00 0.39 -1.05 0.00 0.00 178.44 177.33 3ciy n GLU 244 N -4.46 0.12 -0.18 0.49 -0.58 -0.51 -1.67 120.64 113.85 3ciy n GLU 244 Ca 0.06 0.18 0.10 0.00 -0.42 0.00 0.00 57.16 57.08 3ciy n GLU 244 Cb 0.36 -1.66 0.27 0.00 -0.57 0.00 0.00 31.44 29.85 3ciy n GLU 244 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3ciy n LEU 245 N -1.86 2.65 -4.87 -4.62 4.77 0.92 -4.23 117.00 109.76 3ciy n LEU 245 Ca 0.05 -1.20 -0.30 0.00 -0.03 0.00 0.00 56.01 54.53 3ciy n LEU 245 Cb 0.32 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.23 3ciy n LEU 245 CO 0.25 0.60 0.75 -0.44 -1.33 0.00 0.00 177.39 177.21 3ciy s SER 246 N -1.35 5.16 -0.29 -1.43 0.01 -0.67 -3.85 113.70 111.28 3ciy s SER 246 Ca 0.35 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.74 3ciy s SER 246 Cb 0.19 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 64.54 3ciy s SER 246 CO 0.27 -1.52 0.00 0.59 0.41 0.00 0.00 173.24 172.99 3ciy n ASN 247 N -3.12 -0.91 -4.97 2.44 3.02 -1.13 -4.88 115.26 105.72 3ciy n ASN 247 Ca 0.07 0.07 -0.21 0.00 -0.03 0.00 0.00 54.58 54.48 3ciy n ASN 247 Cb 0.57 -1.17 -0.01 0.00 -0.61 0.00 0.00 39.78 38.56 3ciy n ASN 247 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3ciy s THR 248 N -1.08 4.89 -0.37 3.41 -4.23 -1.25 -4.99 115.64 112.01 3ciy s THR 248 Ca 0.00 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 3ciy s THR 248 Cb 0.00 -3.73 0.09 0.00 1.34 0.00 0.00 72.50 70.20 3ciy s THR 248 CO 0.00 -0.32 0.95 -1.20 -0.54 0.00 0.00 174.62 173.51 3ciy n SER 249 N -1.54 2.54 -4.69 3.99 7.64 -1.26 -4.63 113.62 115.66 3ciy n SER 249 Ca -0.06 -2.17 -0.42 0.00 1.01 0.00 0.00 58.87 57.23 3ciy n SER 249 Cb 0.57 -0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 63.21 3ciy n SER 249 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 3ciy s ILE 250 N -0.72 3.79 -0.06 0.44 -1.16 -1.03 -4.13 121.20 118.32 3ciy s ILE 250 Ca 0.07 1.18 0.01 0.00 -0.51 0.00 0.00 60.65 61.39 3ciy s ILE 250 Cb 0.06 -3.76 -0.04 0.00 0.61 0.00 0.00 42.46 39.33 3ciy s ILE 250 CO 0.02 0.01 -0.05 0.00 -2.81 0.00 0.00 174.94 172.10 3ciy n GLN 251 N 5.23 0.34 -4.55 3.50 6.02 0.49 -4.29 117.38 124.11 3ciy n GLN 251 Ca 0.13 0.03 -0.33 0.00 -0.01 0.00 0.00 57.00 56.82 3ciy n GLN 251 Cb 0.44 -1.12 -0.11 0.00 1.02 0.00 0.00 30.24 30.47 3ciy n GLN 251 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3ciy s ASN 252 N -4.54 4.56 -0.16 1.08 -0.87 -1.13 -1.19 114.94 112.69 3ciy s ASN 252 Ca -0.08 -0.12 -0.07 0.00 -1.57 0.00 0.00 52.86 51.02 3ciy s ASN 252 Cb 0.02 -1.08 0.07 0.00 -0.02 0.00 0.00 41.25 40.24 3ciy s ASN 252 CO 0.15 0.31 0.35 -0.22 -2.57 0.00 0.00 177.10 175.12 3ciy s LEU 253 N -1.17 -0.19 -0.16 0.60 2.96 -0.84 -2.56 118.68 117.33 3ciy s LEU 253 Ca 0.15 0.79 -0.02 0.00 -0.22 0.00 0.00 54.13 54.82 3ciy s LEU 253 Cb -0.11 1.10 -0.02 0.00 0.50 0.00 0.00 46.19 47.66 3ciy s LEU 253 CO 0.05 -0.21 -0.07 -0.55 -1.32 0.00 0.00 176.35 174.25 3ciy s SER 254 N 1.90 4.40 -0.50 3.68 0.15 -1.09 -1.64 113.70 120.61 3ciy s SER 254 Ca -0.05 -0.26 0.07 0.00 0.70 0.00 0.00 55.95 56.41 3ciy s SER 254 Cb -0.10 -1.71 0.27 0.00 -1.71 0.00 0.00 66.02 62.76 3ciy s SER 254 CO -0.11 0.12 0.66 0.18 1.20 0.00 0.00 173.24 175.29 3ciy n LEU 255 N 3.82 1.92 -4.86 3.45 4.77 -0.83 -1.75 117.00 123.52 3ciy n LEU 255 Ca -0.18 -5.08 -0.37 0.00 -0.03 0.00 0.00 56.01 50.35 3ciy n LEU 255 Cb 0.52 0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 3ciy n LEU 255 CO 0.31 2.11 -0.04 0.00 -1.33 0.00 0.00 177.39 178.44 3ciy s ALA 256 N -1.97 3.80 -0.66 -1.18 0.00 -1.26 -4.14 121.76 116.35 3ciy s ALA 256 Ca 0.38 -0.45 -0.02 0.00 0.00 0.00 0.00 51.96 51.88 3ciy s ALA 256 Cb 0.19 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 21.15 3ciy s ALA 256 CO -0.07 0.56 0.64 0.09 0.00 0.00 0.00 175.76 176.98 3ciy n ASN 257 N 1.84 -7.48 -1.83 0.00 3.02 -0.06 -0.29 115.26 110.46 3ciy n ASN 257 Ca -0.17 0.01 -0.07 0.00 -0.03 0.00 0.00 54.58 54.33 3ciy n ASN 257 Cb 0.54 -5.07 -0.02 0.00 -0.61 0.00 0.00 39.78 34.61 3ciy n ASN 257 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3ciy n ASN 258 N -1.53 -0.36 -2.15 6.41 3.02 -1.19 -2.96 115.26 116.51 3ciy n ASN 258 Ca 0.02 -1.81 -0.29 0.00 -0.03 0.00 0.00 54.58 52.47 3ciy n ASN 258 Cb 0.49 0.76 0.05 0.00 -0.61 0.00 0.00 39.78 40.47 3ciy n ASN 258 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ciy n GLN 259 N -0.24 3.13 -1.21 3.52 3.00 -1.14 -4.51 117.38 119.93 3ciy n GLN 259 Ca 0.02 -3.72 -0.37 0.00 -0.01 0.00 0.00 57.00 52.92 3ciy n GLN 259 Cb 0.23 -2.27 -0.03 0.00 0.00 0.00 0.00 30.24 28.17 3ciy n GLN 259 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3ciy n LEU 260 N -0.82 5.67 0.01 1.08 4.32 -1.24 -4.57 117.00 121.45 3ciy n LEU 260 Ca 0.53 -3.42 0.00 0.00 -0.02 0.00 0.00 56.01 53.11 3ciy n LEU 260 Cb 0.83 -1.31 0.02 0.00 -1.62 0.00 0.00 43.42 41.34 3ciy n LEU 260 CO 0.59 0.60 0.51 0.18 -1.22 0.00 0.00 177.39 178.05 3ciy n LEU 261 N 5.76 0.02 -3.54 2.23 4.77 -1.25 -3.67 117.00 121.31 3ciy n LEU 261 Ca 0.53 0.42 -0.07 0.00 -0.03 0.00 0.00 56.01 56.86 3ciy n LEU 261 Cb 0.31 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 3ciy n LEU 261 CO 0.90 -0.42 0.75 0.00 -1.33 0.00 0.00 177.39 177.29 3ciy s ALA 262 N -2.84 -1.86 0.04 -1.18 0.00 -1.26 -0.38 121.76 114.28 3ciy s ALA 262 Ca -0.00 1.03 0.00 0.00 0.00 0.00 0.00 51.96 52.99 3ciy s ALA 262 Cb 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 3ciy s ALA 262 CO 0.01 -0.71 -0.04 0.95 0.00 0.00 0.00 175.76 175.97 3ciy s THR 263 N -3.00 0.27 0.39 0.00 -4.23 -0.69 -4.81 115.64 103.58 3ciy s THR 263 Ca 0.07 -1.41 0.05 0.00 -1.18 0.00 0.00 61.69 59.22 3ciy s THR 263 Cb -0.01 -0.97 -0.02 0.00 1.34 0.00 0.00 72.50 72.84 3ciy s THR 263 CO -0.07 -0.73 0.20 -0.94 -0.54 0.00 0.00 174.62 172.54 3ciy s SER 264 N -2.24 2.47 0.37 3.99 1.04 -1.26 -0.93 113.70 117.13 3ciy s SER 264 Ca -0.03 -1.75 0.13 0.00 0.48 0.00 0.00 55.95 54.78 3ciy s SER 264 Cb -0.01 0.59 0.70 0.00 0.10 0.00 0.00 66.02 67.40 3ciy s SER 264 CO -0.05 -1.02 1.81 -0.08 0.98 0.00 0.00 173.24 174.88 3ciy h GLU 265 N 1.87 0.00 0.00 4.02 4.81 -1.76 -2.69 114.58 120.83 3ciy h GLU 265 Ca -0.30 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.86 3ciy h GLU 265 Cb 1.26 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 3ciy h GLU 265 CO 0.47 0.39 -0.30 0.66 -0.73 0.00 0.00 179.01 179.49 3ciy h SER 266 N 0.00 0.00 0.00 1.04 4.64 -1.88 -3.26 113.55 114.09 3ciy h SER 266 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ciy h SER 266 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3ciy h SER 266 CO 0.05 0.30 0.00 0.41 -0.87 0.00 0.00 176.83 176.73 3ciy n THR 267 N -3.27 0.00 0.82 2.95 -1.04 -1.01 -1.99 114.28 110.74 3ciy n THR 267 Ca 0.02 1.27 0.01 0.00 -2.04 0.00 0.00 64.05 63.31 3ciy n THR 267 Cb 0.58 -2.06 0.06 0.00 -1.82 0.00 0.00 70.33 67.08 3ciy n THR 267 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3ciy n PHE 268 N -1.63 0.28 -0.08 -1.42 3.72 -1.26 -3.95 117.46 113.11 3ciy n PHE 268 Ca 0.00 -0.10 0.15 0.00 -0.05 0.00 0.00 57.45 57.46 3ciy n PHE 268 Cb 0.00 -0.14 0.56 0.00 -0.94 0.00 0.00 39.48 38.95 3ciy n PHE 268 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ciy h SER 269 N 0.56 0.26 0.46 4.37 4.64 -1.44 -0.53 113.55 121.86 3ciy h SER 269 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3ciy h SER 269 Cb 0.65 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3ciy h SER 269 CO 0.06 0.15 -0.02 1.23 -0.87 0.00 0.00 176.83 177.38 3ciy h GLY 270 N 0.29 0.00 2.00 -0.77 0.00 -1.77 -2.66 103.07 100.16 3ciy h GLY 270 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 3ciy h GLY 270 CO -0.07 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.51 3ciy n LEU 271 N -3.19 0.73 -0.35 3.11 7.99 -0.21 -3.81 117.00 121.27 3ciy n LEU 271 Ca -0.01 0.61 0.25 0.00 -0.01 0.00 0.00 56.01 56.85 3ciy n LEU 271 Cb 0.19 -0.43 0.50 0.00 -0.11 0.00 0.00 43.42 43.57 3ciy n LEU 271 CO 0.25 -0.33 1.15 0.07 -1.51 0.00 0.00 177.39 177.01 3ciy h LYS 272 N 0.00 0.30 -0.09 3.23 2.10 -1.62 1.13 116.57 121.64 3ciy h LYS 272 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3ciy h LYS 272 Cb 0.58 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 3ciy h LYS 272 CO 0.00 0.20 0.00 0.91 -2.00 0.00 0.00 179.45 178.56 3ciy n TRP 273 N -4.93 0.00 -3.87 0.07 8.01 -1.25 -4.86 117.44 110.61 3ciy n TRP 273 Ca 0.31 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.33 3ciy n TRP 273 Cb 1.03 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.31 30.31 3ciy n TRP 273 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 3ciy n THR 274 N -0.44 0.00 -3.65 -0.99 -2.24 0.39 -2.83 114.28 104.51 3ciy n THR 274 Ca 0.00 -1.40 -0.28 0.00 -2.27 0.00 0.00 64.05 60.11 3ciy n THR 274 Cb 0.02 -0.11 -0.11 0.00 -2.10 0.00 0.00 70.33 68.03 3ciy n THR 274 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ciy s ASN 275 N -2.98 3.18 -0.34 3.42 3.84 -1.26 -5.02 114.94 115.78 3ciy s ASN 275 Ca 0.16 -3.43 -0.14 0.00 0.21 0.00 0.00 52.86 49.66 3ciy s ASN 275 Cb -0.01 -1.04 -0.02 0.00 -0.55 0.00 0.00 41.25 39.63 3ciy s ASN 275 CO 0.10 -0.13 0.31 -0.76 -2.79 0.00 0.00 177.10 173.83 3ciy s LEU 276 N -0.66 4.46 -0.03 3.21 2.01 -1.26 -4.30 118.68 122.11 3ciy s LEU 276 Ca 0.28 -0.30 -0.00 0.00 0.01 0.00 0.00 54.13 54.12 3ciy s LEU 276 Cb -0.02 -2.25 -0.00 0.00 0.01 0.00 0.00 46.19 43.93 3ciy s LEU 276 CO -0.17 -0.28 -0.01 0.74 1.01 0.00 0.00 176.35 177.63 3ciy h THR 277 N 5.51 0.00 -3.98 5.49 2.02 -1.39 -1.08 112.91 119.48 3ciy h THR 277 Ca -0.31 -0.30 -0.69 0.00 0.77 0.00 0.00 66.41 65.89 3ciy h THR 277 Cb 1.15 0.00 -0.26 0.00 -1.74 0.00 0.00 68.15 67.30 3ciy h THR 277 CO 0.66 0.00 -0.81 -1.58 0.37 0.00 0.00 175.52 174.17 3ciy s GLN 278 N -1.20 2.62 -0.05 6.66 0.74 -0.96 -0.60 119.66 126.87 3ciy s GLN 278 Ca -0.01 -0.77 0.02 0.00 0.05 0.00 0.00 55.36 54.65 3ciy s GLN 278 Cb 0.00 -2.33 0.01 0.00 1.10 0.00 0.00 33.01 31.79 3ciy s GLN 278 CO 0.01 0.49 -0.10 -1.17 -0.55 0.00 0.00 175.29 173.98 3ciy s LEU 279 N -0.41 1.59 -0.07 3.68 2.96 -0.78 -1.98 118.68 123.67 3ciy s LEU 279 Ca 0.04 -0.24 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 3ciy s LEU 279 Cb -0.12 -0.68 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 3ciy s LEU 279 CO 0.02 0.02 -0.18 -0.62 -1.32 0.00 0.00 176.35 174.26 3ciy s ASP 280 N 0.64 3.65 0.00 3.68 2.15 -0.65 -1.15 116.67 124.99 3ciy s ASP 280 Ca -0.12 -0.34 0.12 0.00 0.43 0.00 0.00 52.55 52.63 3ciy s ASP 280 Cb -0.14 -0.99 0.19 0.00 -0.30 0.00 0.00 42.92 41.68 3ciy s ASP 280 CO 0.02 0.27 1.05 0.18 -0.17 0.00 0.00 175.17 176.52 3ciy n LEU 281 N 2.80 0.38 -4.73 -1.34 4.77 -0.05 -1.97 117.00 116.87 3ciy n LEU 281 Ca -0.17 -1.50 -0.32 0.00 -0.03 0.00 0.00 56.01 53.98 3ciy n LEU 281 Cb 0.52 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.71 3ciy n LEU 281 CO 0.26 0.48 0.73 -0.94 -1.33 0.00 0.00 177.39 176.59 3ciy s SER 282 N -1.38 4.16 -0.89 -1.43 1.04 -1.15 -4.06 113.70 109.99 3ciy s SER 282 Ca 0.15 2.08 -0.06 0.00 0.48 0.00 0.00 55.95 58.60 3ciy s SER 282 Cb 0.17 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.74 3ciy s SER 282 CO -0.08 -2.27 0.66 -1.22 0.98 0.00 0.00 173.24 171.31 3ciy n TYR 283 N -3.27 -2.16 -1.25 5.02 4.02 -0.41 -2.65 117.16 116.45 3ciy n TYR 283 Ca 0.11 0.77 0.01 0.00 -0.01 0.00 0.00 57.90 58.78 3ciy n TYR 283 Cb 0.52 -3.14 0.01 0.00 -0.02 0.00 0.00 39.34 36.71 3ciy n TYR 283 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3ciy n ASN 284 N -2.41 0.36 -2.27 7.72 3.02 -1.25 -0.89 115.26 119.55 3ciy n ASN 284 Ca -0.20 -1.59 -0.03 0.00 -0.03 0.00 0.00 54.58 52.72 3ciy n ASN 284 Cb 0.63 -0.10 -0.00 0.00 -0.61 0.00 0.00 39.78 39.69 3ciy n ASN 284 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3ciy n ASN 285 N -0.15 -1.58 -4.59 6.41 3.02 -1.26 -3.69 115.26 113.41 3ciy n ASN 285 Ca 0.01 0.37 -0.43 0.00 -0.03 0.00 0.00 54.58 54.50 3ciy n ASN 285 Cb 0.55 -1.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.18 3ciy n ASN 285 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3ciy n LEU 286 N -2.37 3.24 -0.05 3.41 7.94 -1.24 -4.40 117.00 123.54 3ciy n LEU 286 Ca -0.04 0.25 0.01 0.00 -1.11 0.00 0.00 56.01 55.12 3ciy n LEU 286 Cb 0.46 -1.54 -0.16 0.00 0.53 0.00 0.00 43.42 42.71 3ciy n LEU 286 CO 0.04 -0.65 -0.93 1.57 -1.11 0.00 0.00 177.39 176.31 3ciy n HIS 287 N 11.40 0.00 -5.14 1.96 -0.00 0.49 -2.37 115.22 121.55 3ciy n HIS 287 Ca 0.30 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.72 3ciy n HIS 287 Cb 0.43 -0.71 -0.16 0.00 -0.00 0.00 0.00 29.99 29.55 3ciy n HIS 287 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3ciy s ASP 288 N -4.91 2.82 -0.52 0.26 1.11 -1.11 -2.74 116.67 111.57 3ciy s ASP 288 Ca -0.09 -0.47 0.06 0.00 0.18 0.00 0.00 52.55 52.23 3ciy s ASP 288 Cb 0.10 -0.81 0.22 0.00 1.07 0.00 0.00 42.92 43.50 3ciy s ASP 288 CO 0.85 0.21 0.56 0.52 1.18 0.00 0.00 175.17 178.49 3ciy n VAL 289 N 3.04 0.53 -0.95 -1.27 0.31 -1.26 -1.71 118.33 117.02 3ciy n VAL 289 Ca -0.18 -4.42 -0.36 0.00 -0.01 0.00 0.00 64.34 59.37 3ciy n VAL 289 Cb 0.52 -1.99 0.06 0.00 -0.91 0.00 0.00 33.84 31.52 3ciy n VAL 289 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ciy n GLY 290 N 1.55 -3.71 3.73 2.92 0.00 -0.11 -4.87 105.19 104.69 3ciy n GLY 290 Ca 0.25 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3ciy n GLY 290 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ciy s ASN 291 N -1.19 6.72 -1.89 1.61 0.01 -1.26 -3.05 114.94 115.89 3ciy s ASN 291 Ca 0.42 2.50 0.00 0.00 -0.71 0.00 0.00 52.86 55.07 3ciy s ASN 291 Cb -0.10 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.96 3ciy s ASN 291 CO 0.75 -0.70 0.00 0.61 -1.51 0.00 0.00 177.10 176.25 3ciy n GLY 292 N 3.17 0.30 0.29 0.66 0.00 -1.10 -3.96 105.19 104.56 3ciy n GLY 292 Ca 0.11 -0.02 0.16 0.00 0.00 0.00 0.00 46.02 46.26 3ciy n GLY 292 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3ciy h SER 293 N 0.00 0.00 -0.32 1.61 0.02 -1.72 -1.43 113.55 111.71 3ciy h SER 293 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3ciy h SER 293 Cb 1.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.89 3ciy h SER 293 CO 0.59 0.04 0.00 0.49 -1.14 0.00 0.00 176.83 176.81 3ciy n PHE 294 N -3.57 0.53 0.10 3.45 3.72 -1.26 -4.38 117.46 116.05 3ciy n PHE 294 Ca -0.02 -0.57 0.06 0.00 -0.05 0.00 0.00 57.45 56.87 3ciy n PHE 294 Cb 0.15 -0.08 0.33 0.00 -0.94 0.00 0.00 39.48 38.94 3ciy n PHE 294 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3ciy n SER 295 N 0.29 0.31 -0.94 4.37 3.41 -0.54 -1.36 113.62 119.15 3ciy n SER 295 Ca 0.13 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.44 3ciy n SER 295 Cb 0.50 -0.62 0.27 0.00 -0.26 0.00 0.00 64.21 64.10 3ciy n SER 295 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3ciy n TYR 296 N -1.92 0.50 -2.98 7.33 0.53 -1.26 -4.57 117.16 114.80 3ciy n TYR 296 Ca -0.01 -0.25 -0.28 0.00 -1.02 0.00 0.00 57.90 56.34 3ciy n TYR 296 Cb 0.11 0.00 -0.04 0.00 -1.03 0.00 0.00 39.34 38.38 3ciy n TYR 296 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3ciy n LEU 297 N 1.04 4.61 -0.38 7.72 4.77 -0.47 -4.18 117.00 130.11 3ciy n LEU 297 Ca 0.18 -5.64 0.00 0.00 -0.03 0.00 0.00 56.01 50.52 3ciy n LEU 297 Cb 0.48 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3ciy n LEU 297 CO 0.14 2.30 0.12 -0.81 -1.33 0.00 0.00 177.39 177.81 3ciy n PRO 298 N -0.11 0.39 0.00 3.23 -0.04 -1.25 -1.67 135.00 135.55 3ciy n PRO 298 Ca 0.32 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 3ciy n PRO 298 Cb 0.38 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 3ciy n PRO 298 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3ciy n SER 299 N 0.12 0.24 -4.68 3.54 2.88 -1.26 -4.57 113.62 109.89 3ciy n SER 299 Ca 0.00 -0.02 -0.45 0.00 -1.33 0.00 0.00 58.87 57.07 3ciy n SER 299 Cb 0.07 0.09 -0.04 0.00 -0.75 0.00 0.00 64.21 63.58 3ciy n SER 299 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3ciy n LEU 300 N -0.11 3.63 -0.05 2.46 0.00 -0.41 -4.55 117.00 117.97 3ciy n LEU 300 Ca 0.00 0.99 -0.02 0.00 0.00 0.00 0.00 56.01 56.98 3ciy n LEU 300 Cb 0.00 -1.45 -0.13 0.00 0.00 0.00 0.00 43.42 41.84 3ciy n LEU 300 CO 0.00 -0.01 -0.91 0.54 0.00 0.00 0.00 177.39 177.02 3ciy n ARG 301 N 5.73 1.08 -4.68 1.96 1.74 0.23 -0.41 116.66 122.31 3ciy n ARG 301 Ca 0.20 -0.06 -0.24 0.00 -0.77 0.00 0.00 57.85 56.98 3ciy n ARG 301 Cb 0.33 -1.41 -0.15 0.00 -1.02 0.00 0.00 32.46 30.21 3ciy n ARG 301 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3ciy s TYR 302 N -2.68 1.54 -0.24 -1.55 2.02 -0.64 0.79 117.35 116.59 3ciy s TYR 302 Ca -0.07 -0.32 -0.07 0.00 -0.37 0.00 0.00 57.07 56.24 3ciy s TYR 302 Cb 0.07 -0.96 0.12 0.00 -0.40 0.00 0.00 41.96 40.79 3ciy s TYR 302 CO 0.68 0.02 0.49 -1.17 -1.57 0.00 0.00 175.55 173.99 3ciy s LEU 303 N -0.73 -0.84 -0.28 -1.29 2.96 -0.98 -1.87 118.68 115.66 3ciy s LEU 303 Ca 0.06 1.03 -0.05 0.00 -0.22 0.00 0.00 54.13 54.94 3ciy s LEU 303 Cb -0.07 1.63 0.01 0.00 0.50 0.00 0.00 46.19 48.26 3ciy s LEU 303 CO 0.00 -0.24 0.03 -0.55 -1.32 0.00 0.00 176.35 174.28 3ciy s SER 304 N 2.70 4.86 -0.29 3.68 0.15 -0.30 -2.80 113.70 121.70 3ciy s SER 304 Ca 0.01 -0.75 0.11 0.00 0.70 0.00 0.00 55.95 56.02 3ciy s SER 304 Cb -0.13 -1.81 0.61 0.00 -1.71 0.00 0.00 66.02 62.98 3ciy s SER 304 CO -0.15 -0.17 1.62 0.18 1.20 0.00 0.00 173.24 175.92 3ciy n LEU 305 N 4.80 5.02 -4.49 3.45 4.32 -0.76 -0.87 117.00 128.48 3ciy n LEU 305 Ca -0.15 -3.39 -0.34 0.00 -0.02 0.00 0.00 56.01 52.10 3ciy n LEU 305 Cb 0.48 -0.67 0.11 0.00 -1.62 0.00 0.00 43.42 41.71 3ciy n LEU 305 CO 0.30 0.95 0.15 -0.62 -1.22 0.00 0.00 177.39 176.94 3ciy n GLU 306 N -0.67 -0.00 -3.21 3.23 1.02 -1.24 -4.03 120.64 115.73 3ciy n GLU 306 Ca 0.36 0.05 -0.23 0.00 -0.02 0.00 0.00 57.16 57.33 3ciy n GLU 306 Cb 1.20 -1.97 0.01 0.00 -0.02 0.00 0.00 31.44 30.65 3ciy n GLU 306 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3ciy n TYR 307 N -3.15 -1.67 -4.03 -0.32 4.02 -0.10 -1.29 117.16 110.62 3ciy n TYR 307 Ca 0.09 0.69 -0.10 0.00 -0.01 0.00 0.00 57.90 58.58 3ciy n TYR 307 Cb 0.52 -1.71 -0.08 0.00 -0.02 0.00 0.00 39.34 38.05 3ciy n TYR 307 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3ciy s ASN 308 N -2.06 0.09 -0.82 7.72 0.01 -0.40 -1.55 114.94 117.94 3ciy s ASN 308 Ca 0.11 -1.00 0.02 0.00 -0.71 0.00 0.00 52.86 51.28 3ciy s ASN 308 Cb -0.01 0.42 0.26 0.00 0.41 0.00 0.00 41.25 42.32 3ciy s ASN 308 CO 0.65 -0.88 0.96 0.59 -1.51 0.00 0.00 177.10 176.92 3ciy n ASN 309 N -0.21 4.60 -4.74 -1.22 3.02 -1.09 -1.85 115.26 113.77 3ciy n ASN 309 Ca -0.05 -3.37 -0.40 0.00 -0.03 0.00 0.00 54.58 50.72 3ciy n ASN 309 Cb 0.63 -0.92 -0.05 0.00 -0.61 0.00 0.00 39.78 38.84 3ciy n ASN 309 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3ciy s ILE 310 N -2.35 4.74 -0.06 2.41 1.01 -0.82 -3.18 121.20 122.96 3ciy s ILE 310 Ca 0.35 1.65 -0.26 0.00 0.00 0.00 0.00 60.65 62.38 3ciy s ILE 310 Cb 0.07 -4.13 -0.22 0.00 0.01 0.00 0.00 42.46 38.19 3ciy s ILE 310 CO -0.00 0.35 1.07 -0.61 0.00 0.00 0.00 174.94 175.74 3ciy h GLN 311 N 5.76 0.05 -2.76 2.79 5.75 -1.80 -2.16 115.11 122.75 3ciy h GLN 311 Ca -0.44 -0.05 0.09 0.00 -0.15 0.00 0.00 58.65 58.11 3ciy h GLN 311 Cb 1.21 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.72 3ciy h GLN 311 CO 0.71 0.75 0.35 -0.98 -2.65 0.00 0.00 178.83 177.01 3ciy s ARG 312 N -3.39 1.65 -0.33 1.69 1.70 -1.26 -3.17 118.95 115.83 3ciy s ARG 312 Ca -0.17 -0.96 -0.01 0.00 -0.47 0.00 0.00 55.73 54.12 3ciy s ARG 312 Cb 0.00 0.53 0.11 0.00 -0.57 0.00 0.00 34.95 35.02 3ciy s ARG 312 CO 0.70 -0.76 0.14 -0.51 -1.08 0.00 0.00 175.30 173.78 3ciy s LEU 313 N -3.01 1.79 0.95 -1.89 1.43 -1.25 -4.82 118.68 111.88 3ciy s LEU 313 Ca 0.13 -1.78 -0.12 0.00 -1.03 0.00 0.00 54.13 51.34 3ciy s LEU 313 Cb -0.04 -0.72 0.16 0.00 0.03 0.00 0.00 46.19 45.62 3ciy s LEU 313 CO 0.06 -0.39 1.10 -0.94 0.23 0.00 0.00 176.35 176.41 3ciy s SER 314 N 1.47 3.07 0.32 2.29 1.04 -1.26 -3.45 113.70 117.18 3ciy s SER 314 Ca 0.12 1.26 0.05 0.00 0.48 0.00 0.00 55.95 57.86 3ciy s SER 314 Cb -0.19 -1.93 0.67 0.00 0.10 0.00 0.00 66.02 64.68 3ciy s SER 314 CO -0.21 -2.86 1.86 1.55 0.98 0.00 0.00 173.24 174.55 3ciy h PRO 315 N -1.71 0.84 0.00 4.02 0.13 -1.78 -0.21 132.00 133.30 3ciy h PRO 315 Ca -0.52 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 3ciy h PRO 315 Cb 1.31 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3ciy h PRO 315 CO 0.57 0.55 0.00 -2.13 -0.23 0.00 0.00 178.00 176.76 3ciy n ARG 316 N -4.59 0.84 0.27 0.86 3.00 -1.26 -4.09 116.66 111.69 3ciy n ARG 316 Ca 0.18 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.86 3ciy n ARG 316 Cb 0.40 -1.40 -0.08 0.00 0.00 0.00 0.00 32.46 31.38 3ciy n ARG 316 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 3ciy h SER 317 N 0.00 -1.00 -0.27 6.15 0.02 -1.33 -2.87 113.55 114.25 3ciy h SER 317 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3ciy h SER 317 Cb 0.00 0.32 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3ciy h SER 317 CO 0.00 -0.54 0.00 0.49 -1.14 0.00 0.00 176.83 175.64 3ciy n PHE 318 N -5.49 0.36 -1.68 3.45 3.01 -1.26 -3.95 117.46 111.91 3ciy n PHE 318 Ca -0.11 -0.18 -0.46 0.00 1.01 0.00 0.00 57.45 57.71 3ciy n PHE 318 Cb 0.39 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.82 3ciy n PHE 318 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 3ciy n TYR 319 N 0.32 2.41 0.00 1.38 9.36 -1.15 -2.75 117.16 126.73 3ciy n TYR 319 Ca 0.11 -0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.24 3ciy n TYR 319 Cb 0.25 -2.70 0.00 0.00 -0.63 0.00 0.00 39.34 36.27 3ciy n TYR 319 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3ciy n GLY 320 N 4.32 3.90 3.54 2.98 0.00 -1.26 -2.70 105.19 115.97 3ciy n GLY 320 Ca 0.21 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 3ciy n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ciy s LEU 321 N 0.00 4.15 0.00 0.99 1.43 -1.11 -3.91 118.68 120.24 3ciy s LEU 321 Ca 0.00 -2.38 0.24 0.00 -1.03 0.00 0.00 54.13 50.96 3ciy s LEU 321 Cb 0.00 -2.52 0.52 0.00 0.03 0.00 0.00 46.19 44.22 3ciy s LEU 321 CO 0.00 -1.12 1.45 -1.54 0.23 0.00 0.00 176.35 175.37 3ciy n SER 322 N 7.70 2.64 -0.00 2.29 3.41 -1.26 -4.05 113.62 124.35 3ciy n SER 322 Ca 0.42 -1.86 0.03 0.00 -0.26 0.00 0.00 58.87 57.19 3ciy n SER 322 Cb 0.46 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 3ciy n SER 322 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3ciy n ASN 323 N 1.00 2.51 -4.59 4.04 2.85 -1.26 -4.60 115.26 115.21 3ciy n ASN 323 Ca 0.17 -0.22 -0.47 0.00 -0.11 0.00 0.00 54.58 53.95 3ciy n ASN 323 Cb 0.51 1.16 -0.03 0.00 1.24 0.00 0.00 39.78 42.66 3ciy n ASN 323 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 3ciy n LEU 324 N -1.49 1.75 0.00 1.20 7.94 0.46 -4.40 117.00 122.46 3ciy n LEU 324 Ca -0.00 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 3ciy n LEU 324 Cb 0.12 -1.26 0.00 0.00 0.53 0.00 0.00 43.42 42.81 3ciy n LEU 324 CO 0.11 -1.28 -0.02 0.54 -1.11 0.00 0.00 177.39 175.62 3ciy n ARG 325 N 1.35 3.76 -3.59 1.96 1.74 0.24 -2.49 116.66 119.63 3ciy n ARG 325 Ca 0.12 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 57.01 3ciy n ARG 325 Cb 0.28 -0.32 -0.15 0.00 -1.02 0.00 0.00 32.46 31.26 3ciy n ARG 325 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3ciy s TYR 326 N -0.60 -0.14 -0.07 -1.55 6.14 -0.93 -1.64 117.35 118.56 3ciy s TYR 326 Ca 0.00 0.28 0.05 0.00 0.64 0.00 0.00 57.07 58.04 3ciy s TYR 326 Cb 0.00 -0.38 -0.00 0.00 0.42 0.00 0.00 41.96 41.99 3ciy s TYR 326 CO 0.00 -0.44 -0.22 -1.17 0.64 0.00 0.00 175.55 174.36 3ciy s LEU 327 N 2.28 2.01 -0.19 6.97 2.96 -0.27 -2.31 118.68 130.12 3ciy s LEU 327 Ca 0.04 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 3ciy s LEU 327 Cb -0.14 -1.25 0.02 0.00 0.50 0.00 0.00 46.19 45.32 3ciy s LEU 327 CO -0.09 0.18 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.38 3ciy s SER 328 N 0.12 3.27 -0.24 3.68 0.15 -1.12 -1.64 113.70 117.92 3ciy s SER 328 Ca -0.10 -0.73 0.10 0.00 0.70 0.00 0.00 55.95 55.92 3ciy s SER 328 Cb -0.15 -1.48 0.44 0.00 -1.71 0.00 0.00 66.02 63.12 3ciy s SER 328 CO 0.05 -0.02 1.27 0.18 1.20 0.00 0.00 173.24 175.91 3ciy n LEU 329 N 4.60 3.29 -4.61 3.45 4.77 0.21 -1.82 117.00 126.89 3ciy n LEU 329 Ca -0.20 -4.01 -0.43 0.00 -0.03 0.00 0.00 56.01 51.34 3ciy n LEU 329 Cb 0.49 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3ciy n LEU 329 CO 0.25 1.48 1.78 1.17 -1.33 0.00 0.00 177.39 180.74 3ciy n LYS 330 N -1.07 2.14 -3.42 3.23 4.81 -1.25 -1.46 118.16 121.14 3ciy n LYS 330 Ca 0.25 0.66 -0.25 0.00 -0.87 0.00 0.00 58.31 58.10 3ciy n LYS 330 Cb 0.78 -3.12 0.04 0.00 0.02 0.00 0.00 35.03 32.75 3ciy n LYS 330 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3ciy n ARG 331 N 8.36 -5.66 -0.37 1.64 3.00 -0.11 -0.92 116.66 122.59 3ciy n ARG 331 Ca 0.28 0.76 0.08 0.00 -0.00 0.00 0.00 57.85 58.97 3ciy n ARG 331 Cb 0.42 -5.66 0.26 0.00 0.00 0.00 0.00 32.46 27.48 3ciy n ARG 331 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3ciy n ALA 332 N -4.19 2.68 -2.55 5.13 0.00 -0.54 -1.27 120.51 119.77 3ciy n ALA 332 Ca -0.03 -1.08 -0.25 0.00 0.00 0.00 0.00 53.44 52.07 3ciy n ALA 332 Cb 0.57 -0.99 -0.11 0.00 0.00 0.00 0.00 19.45 18.93 3ciy n ALA 332 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3ciy s PHE 333 N -1.50 2.22 0.00 0.00 0.08 -0.77 -1.94 117.98 116.07 3ciy s PHE 333 Ca 0.38 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 56.60 3ciy s PHE 333 Cb 0.22 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 41.14 3ciy s PHE 333 CO 0.22 0.22 0.00 2.41 -0.10 0.00 0.00 175.22 177.97 3ciy n THR 334 N -0.86 0.00 -1.83 0.64 -1.04 -0.81 -4.40 114.28 105.99 3ciy n THR 334 Ca -0.04 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 61.97 3ciy n THR 334 Cb 0.67 -1.73 0.15 0.00 -1.82 0.00 0.00 70.33 67.60 3ciy n THR 334 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3ciy n LYS 335 N -0.39 1.71 -3.22 -2.82 4.01 -1.26 -4.57 118.16 111.62 3ciy n LYS 335 Ca 0.00 -3.28 -0.20 0.00 -0.51 0.00 0.00 58.31 54.32 3ciy n LYS 335 Cb 0.00 -1.51 0.01 0.00 -0.51 0.00 0.00 35.03 33.02 3ciy n LYS 335 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3ciy n SER 342 N -0.82 -3.42 -4.89 4.39 2.88 -1.26 -4.78 113.62 105.72 3ciy n SER 342 Ca 0.21 -0.52 -0.35 0.00 -1.33 0.00 0.00 58.87 56.88 3ciy n SER 342 Cb 0.80 -1.10 -0.05 0.00 -0.75 0.00 0.00 64.21 63.11 3ciy n SER 342 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 3ciy s HIS 343 N -2.21 3.57 0.36 0.66 0.00 -1.26 -5.10 115.29 111.31 3ciy s HIS 343 Ca 0.07 0.43 -0.10 0.00 -3.00 0.00 0.00 55.06 52.46 3ciy s HIS 343 Cb -0.01 -1.87 -0.07 0.00 -4.00 0.00 0.00 32.58 26.63 3ciy s HIS 343 CO 0.62 0.68 0.72 -1.25 -1.00 0.00 0.00 174.74 174.51 3ciy s PRO 344 N -1.58 3.80 -0.08 -0.38 0.04 -1.26 -5.02 135.00 130.52 3ciy s PRO 344 Ca 0.22 0.43 -0.31 0.00 0.04 0.00 0.00 61.00 61.39 3ciy s PRO 344 Cb -0.12 -2.45 0.08 0.00 0.04 0.00 0.00 34.50 32.05 3ciy s PRO 344 CO 0.13 0.05 0.74 0.54 0.04 0.00 0.00 177.00 178.50 3ciy s ASN 345 N -2.95 -0.61 -0.13 6.66 4.22 -1.19 -4.05 114.94 116.89 3ciy s ASN 345 Ca 0.51 0.69 -0.06 0.00 -2.14 0.00 0.00 52.86 51.86 3ciy s ASN 345 Cb -0.10 0.53 -0.04 0.00 1.28 0.00 0.00 41.25 42.92 3ciy s ASN 345 CO 0.28 -0.54 0.09 0.27 -2.04 0.00 0.00 177.10 175.16 3ciy s ILE 346 N -1.10 5.07 0.63 0.54 -4.36 -1.26 -3.90 121.20 116.81 3ciy s ILE 346 Ca -0.09 0.05 0.06 0.00 -0.26 0.00 0.00 60.65 60.41 3ciy s ILE 346 Cb -0.00 -3.21 0.10 0.00 1.25 0.00 0.00 42.46 40.60 3ciy s ILE 346 CO 0.08 0.57 0.86 1.51 0.24 0.00 0.00 174.94 178.21 3ciy s ASP 347 N -0.64 4.83 0.92 4.36 1.47 -1.22 -4.96 116.67 121.43 3ciy s ASP 347 Ca 0.12 -0.70 -0.10 0.00 1.18 0.00 0.00 52.55 53.04 3ciy s ASP 347 Cb -0.12 0.23 0.15 0.00 -0.34 0.00 0.00 42.92 42.84 3ciy s ASP 347 CO 0.02 -1.53 1.14 -1.81 0.68 0.00 0.00 175.17 173.67 3ciy s ASP 348 N -4.70 2.86 -1.48 2.11 1.01 -1.26 -3.72 116.67 111.48 3ciy s ASP 348 Ca 0.64 2.18 -0.13 0.00 0.71 0.00 0.00 52.55 55.94 3ciy s ASP 348 Cb -0.05 -2.56 0.09 0.00 1.01 0.00 0.00 42.92 41.41 3ciy s ASP 348 CO 0.41 -3.14 0.74 0.49 0.21 0.00 0.00 175.17 173.88 3ciy n PHE 349 N -4.26 -1.97 0.44 4.23 3.72 -0.98 -4.45 117.46 114.19 3ciy n PHE 349 Ca 0.12 0.70 0.11 0.00 -0.05 0.00 0.00 57.45 58.33 3ciy n PHE 349 Cb 0.52 -3.39 -0.07 0.00 -0.94 0.00 0.00 39.48 35.60 3ciy n PHE 349 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3ciy n SER 350 N -2.57 0.51 -0.59 4.37 7.64 -1.24 -4.12 113.62 117.61 3ciy n SER 350 Ca 0.02 -0.26 0.06 0.00 1.01 0.00 0.00 58.87 59.70 3ciy n SER 350 Cb 0.53 1.20 0.12 0.00 -1.01 0.00 0.00 64.21 65.04 3ciy n SER 350 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3ciy n PHE 351 N -2.02 0.30 0.18 1.43 3.72 -1.26 -4.35 117.46 115.46 3ciy n PHE 351 Ca 0.00 -0.31 0.18 0.00 -0.05 0.00 0.00 57.45 57.28 3ciy n PHE 351 Cb 0.47 -0.02 0.75 0.00 -0.94 0.00 0.00 39.48 39.74 3ciy n PHE 351 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3ciy h GLN 352 N 2.17 0.00 0.00 -1.08 3.07 -1.71 -1.47 115.11 116.09 3ciy h GLN 352 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 58.65 58.56 3ciy h GLN 352 Cb 0.64 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.17 3ciy h GLN 352 CO 0.00 0.00 -0.91 -1.49 0.09 0.00 0.00 178.83 176.52 3ciy h TRP 353 N 0.00 0.00 -0.23 0.06 4.06 -1.90 -3.38 115.95 114.57 3ciy h TRP 353 Ca 0.13 0.00 -0.65 0.00 2.06 0.00 0.00 58.89 60.43 3ciy h TRP 353 Cb 0.99 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.14 3ciy h TRP 353 CO 0.00 0.80 3.27 1.28 -3.56 0.00 0.00 178.44 180.23 3ciy n LEU 354 N -3.25 8.38 0.00 -4.49 4.77 -0.55 -4.55 117.00 117.30 3ciy n LEU 354 Ca -0.01 -4.38 0.05 0.00 -0.03 0.00 0.00 56.01 51.64 3ciy n LEU 354 Cb 0.87 -1.51 0.28 0.00 -2.33 0.00 0.00 43.42 40.73 3ciy n LEU 354 CO 0.44 2.05 0.62 2.29 -1.33 0.00 0.00 177.39 181.46 3ciy n LYS 355 N 3.13 0.16 -0.03 3.23 -0.00 -1.26 -2.33 118.16 121.05 3ciy n LYS 355 Ca 0.73 0.18 0.03 0.00 -0.00 0.00 0.00 58.31 59.26 3ciy n LYS 355 Cb 0.28 -1.50 0.04 0.00 -0.00 0.00 0.00 35.03 33.86 3ciy n LYS 355 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 3ciy n TYR 356 N -1.29 0.08 -2.15 5.58 4.01 -1.26 -4.13 117.16 117.99 3ciy n TYR 356 Ca 0.05 -0.15 -0.39 0.00 -0.16 0.00 0.00 57.90 57.25 3ciy n TYR 356 Cb 0.09 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.10 3ciy n TYR 356 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3ciy s LEU 357 N -0.66 4.18 0.00 7.72 2.96 -0.99 -4.45 118.68 127.45 3ciy s LEU 357 Ca 0.09 2.51 0.00 0.00 -0.22 0.00 0.00 54.13 56.51 3ciy s LEU 357 Cb 0.06 -3.98 0.00 0.00 0.50 0.00 0.00 46.19 42.76 3ciy s LEU 357 CO 0.08 -0.81 0.07 -1.84 -1.32 0.00 0.00 176.35 172.53 3ciy n GLU 358 N 0.03 1.19 -3.56 1.98 0.28 -0.65 -1.77 120.64 118.13 3ciy n GLU 358 Ca 0.04 -0.07 -0.25 0.00 -0.16 0.00 0.00 57.16 56.72 3ciy n GLU 358 Cb 0.45 -0.37 -0.15 0.00 1.43 0.00 0.00 31.44 32.79 3ciy n GLU 358 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 3ciy s TYR 359 N -0.19 0.12 -0.17 -1.84 6.04 -1.07 -1.41 117.35 118.83 3ciy s TYR 359 Ca 0.00 -0.37 0.01 0.00 0.04 0.00 0.00 57.07 56.76 3ciy s TYR 359 Cb 0.00 -0.68 0.01 0.00 -1.04 0.00 0.00 41.96 40.25 3ciy s TYR 359 CO 0.00 -0.63 -0.19 -1.17 -1.54 0.00 0.00 175.55 172.02 3ciy s LEU 360 N 2.17 2.20 -0.09 6.97 2.96 -0.69 -1.11 118.68 131.09 3ciy s LEU 360 Ca 0.05 -0.61 0.04 0.00 -0.22 0.00 0.00 54.13 53.40 3ciy s LEU 360 Cb -0.16 -1.49 -0.00 0.00 0.50 0.00 0.00 46.19 45.04 3ciy s LEU 360 CO -0.18 0.03 -0.24 0.21 -1.32 0.00 0.00 176.35 174.85 3ciy s ASN 361 N 1.12 3.12 -0.21 3.68 3.84 -0.65 -2.33 114.94 123.51 3ciy s ASN 361 Ca 0.00 -0.54 0.22 0.00 0.21 0.00 0.00 52.86 52.76 3ciy s ASN 361 Cb -0.14 -1.32 0.49 0.00 -0.55 0.00 0.00 41.25 39.73 3ciy s ASN 361 CO -0.08 0.18 1.13 0.23 -2.79 0.00 0.00 177.10 175.77 3ciy n MET 362 N 3.42 1.49 -1.16 0.43 2.81 -1.01 0.67 117.12 123.77 3ciy n MET 362 Ca -0.19 -3.24 -0.29 0.00 -1.81 0.00 0.00 57.70 52.18 3ciy n MET 362 Cb 0.53 -1.32 0.19 0.00 -0.71 0.00 0.00 33.22 31.91 3ciy n MET 362 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3ciy s ASP 363 N -3.41 2.34 -0.82 7.83 1.01 -1.26 -4.45 116.67 117.91 3ciy s ASP 363 Ca 0.30 1.10 -0.02 0.00 0.71 0.00 0.00 52.55 54.64 3ciy s ASP 363 Cb 0.34 -1.72 0.00 0.00 1.01 0.00 0.00 42.92 42.55 3ciy s ASP 363 CO -0.06 -3.29 0.64 -0.67 0.21 0.00 0.00 175.17 172.00 3ciy n ASP 364 N -4.27 -5.76 -3.37 0.27 -0.08 -0.91 -0.94 116.55 101.48 3ciy n ASP 364 Ca 0.06 -0.70 -0.12 0.00 -1.51 0.00 0.00 54.79 52.51 3ciy n ASP 364 Cb 0.58 -2.86 -0.03 0.00 2.34 0.00 0.00 41.12 41.15 3ciy n ASP 364 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 3ciy s ASN 365 N -3.02 0.52 0.00 1.67 0.01 0.07 -2.69 114.94 111.50 3ciy s ASN 365 Ca 0.03 -1.30 0.09 0.00 -0.71 0.00 0.00 52.86 50.97 3ciy s ASN 365 Cb -0.01 0.68 0.25 0.00 0.41 0.00 0.00 41.25 42.57 3ciy s ASN 365 CO 0.85 -1.33 1.18 0.59 -1.51 0.00 0.00 177.10 176.89 3ciy n ASN 366 N -1.16 2.71 -4.53 -1.22 5.03 -1.25 -4.12 115.26 110.72 3ciy n ASN 366 Ca -0.01 -1.95 -0.54 0.00 0.87 0.00 0.00 54.58 52.95 3ciy n ASN 366 Cb 0.61 -0.18 -0.06 0.00 -1.02 0.00 0.00 39.78 39.13 3ciy n ASN 366 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 3ciy n ILE 367 N 0.38 0.48 0.05 2.41 -0.00 -1.04 -4.42 119.36 117.21 3ciy n ILE 367 Ca 0.10 -0.12 -0.03 0.00 -0.00 0.00 0.00 62.75 62.69 3ciy n ILE 367 Cb 0.39 -0.38 -0.02 0.00 -0.00 0.00 0.00 39.64 39.63 3ciy n ILE 367 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.55 175.90 3ciy h PRO 368 N 3.16 -0.18 -2.82 0.38 0.11 -1.86 -2.60 132.00 128.20 3ciy h PRO 368 Ca -0.45 0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.72 3ciy h PRO 368 Cb 1.39 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.53 3ciy h PRO 368 CO 0.68 -0.12 0.40 0.45 -0.21 0.00 0.00 178.00 179.19 3ciy s SER 369 N -2.69 0.00 0.74 -2.05 0.15 -1.26 -1.67 113.70 106.92 3ciy s SER 369 Ca -0.03 -0.96 -0.11 0.00 0.70 0.00 0.00 55.95 55.54 3ciy s SER 369 Cb 0.01 0.71 0.04 0.00 -1.71 0.00 0.00 66.02 65.07 3ciy s SER 369 CO 0.12 -1.42 1.10 0.42 1.20 0.00 0.00 173.24 174.66 3ciy s THR 370 N -2.26 3.29 0.41 6.45 -4.23 -1.26 -5.03 115.64 113.01 3ciy s THR 370 Ca 0.18 0.42 0.06 0.00 -1.18 0.00 0.00 61.69 61.17 3ciy s THR 370 Cb -0.04 -3.33 -0.07 0.00 1.34 0.00 0.00 72.50 70.40 3ciy s THR 370 CO 0.09 -0.55 0.02 -0.54 -0.54 0.00 0.00 174.62 173.10 3ciy s LYS 371 N -5.30 1.94 0.57 3.99 1.02 -1.26 -5.03 119.74 115.68 3ciy s LYS 371 Ca 0.59 -2.11 0.32 0.00 0.02 0.00 0.00 55.97 54.80 3ciy s LYS 371 Cb -0.12 -1.55 1.72 0.00 -0.52 0.00 0.00 37.83 37.36 3ciy s LYS 371 CO 0.52 -0.08 2.16 0.66 -0.92 0.00 0.00 175.35 177.69 3ciy h SER 372 N 1.78 0.00 0.00 2.83 4.64 -1.89 -3.20 113.55 117.71 3ciy h SER 372 Ca -0.44 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.85 3ciy h SER 372 Cb 1.24 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.26 3ciy h SER 372 CO 0.79 0.06 -0.46 0.59 -0.87 0.00 0.00 176.83 176.95 3ciy n ASN 373 N -3.50 1.31 0.00 4.97 3.02 -1.26 -4.13 115.26 115.67 3ciy n ASN 373 Ca -0.02 -2.77 0.00 0.00 -0.03 0.00 0.00 54.58 51.76 3ciy n ASN 373 Cb 0.18 -0.37 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 3ciy n ASN 373 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3ciy n THR 374 N -0.60 0.00 1.05 3.41 -1.04 -1.21 -2.32 114.28 113.58 3ciy n THR 374 Ca 0.10 1.40 0.00 0.00 -2.04 0.00 0.00 64.05 63.52 3ciy n THR 374 Cb 0.77 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 67.02 3ciy n THR 374 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3ciy n PHE 375 N -1.95 0.00 -1.87 -1.42 3.72 -1.26 -4.08 117.46 110.60 3ciy n PHE 375 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 3ciy n PHE 375 Cb 0.00 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.48 3ciy n PHE 375 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3ciy s THR 376 N -1.52 2.66 0.00 4.37 2.01 -1.10 -2.85 115.64 119.21 3ciy s THR 376 Ca 0.00 0.34 0.00 0.00 0.31 0.00 0.00 61.69 62.34 3ciy s THR 376 Cb 0.00 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.29 3ciy s THR 376 CO 0.00 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.55 3ciy n GLY 377 N 3.93 3.10 3.56 4.40 0.00 -1.26 -3.35 105.19 115.58 3ciy n GLY 377 Ca 0.15 -1.07 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 3ciy n GLY 377 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ciy s LEU 378 N 0.00 3.11 -0.01 0.99 1.43 -1.13 -4.49 118.68 118.58 3ciy s LEU 378 Ca 0.00 -0.46 0.20 0.00 -1.03 0.00 0.00 54.13 52.84 3ciy s LEU 378 Cb 0.00 -2.56 0.58 0.00 0.03 0.00 0.00 46.19 44.24 3ciy s LEU 378 CO 0.00 -2.96 1.48 1.33 0.23 0.00 0.00 176.35 176.43 3ciy n VAL 379 N 8.04 0.92 0.00 -1.59 0.24 -1.26 -3.93 118.33 120.74 3ciy n VAL 379 Ca 0.41 -0.88 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 3ciy n VAL 379 Cb 0.46 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 3ciy n VAL 379 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3ciy n SER 380 N 1.36 1.67 -4.62 -1.34 7.64 -1.25 -4.27 113.62 112.81 3ciy n SER 380 Ca 0.22 -0.29 -0.54 0.00 1.01 0.00 0.00 58.87 59.26 3ciy n SER 380 Cb 0.57 0.91 -0.07 0.00 -1.01 0.00 0.00 64.21 64.61 3ciy n SER 380 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3ciy n LEU 381 N -1.08 2.43 0.00 -3.43 0.00 -0.73 -4.40 117.00 109.79 3ciy n LEU 381 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 56.01 56.88 3ciy n LEU 381 Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 43.42 42.22 3ciy n LEU 381 CO 0.00 -0.46 -0.32 2.29 0.00 0.00 0.00 177.39 178.90 3ciy n LYS 382 N 6.43 2.36 -3.85 1.96 2.85 -0.84 -2.55 118.16 124.54 3ciy n LYS 382 Ca 0.31 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 57.30 3ciy n LYS 382 Cb 0.17 -0.82 -0.17 0.00 -0.65 0.00 0.00 35.03 33.57 3ciy n LYS 382 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3ciy s TYR 383 N -1.60 1.37 -0.05 5.58 4.12 -0.50 -0.61 117.35 125.66 3ciy s TYR 383 Ca 0.00 -0.82 0.02 0.00 0.02 0.00 0.00 57.07 56.29 3ciy s TYR 383 Cb 0.00 -1.16 0.01 0.00 -1.52 0.00 0.00 41.96 39.29 3ciy s TYR 383 CO 0.00 -0.54 -0.09 -1.17 0.02 0.00 0.00 175.55 173.77 3ciy s LEU 384 N 1.74 1.60 -0.06 -1.29 2.96 -0.61 -1.70 118.68 121.33 3ciy s LEU 384 Ca 0.02 -0.21 0.04 0.00 -0.22 0.00 0.00 54.13 53.76 3ciy s LEU 384 Cb -0.14 -0.63 -0.00 0.00 0.50 0.00 0.00 46.19 45.91 3ciy s LEU 384 CO -0.07 0.02 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.23 3ciy s SER 385 N 0.57 2.54 -0.30 3.68 0.15 -0.98 -2.57 113.70 116.79 3ciy s SER 385 Ca -0.10 -0.43 0.19 0.00 0.70 0.00 0.00 55.95 56.31 3ciy s SER 385 Cb -0.13 -0.90 0.48 0.00 -1.71 0.00 0.00 66.02 63.76 3ciy s SER 385 CO 0.02 0.16 1.03 0.18 1.20 0.00 0.00 173.24 175.82 3ciy n LEU 386 N 3.31 1.68 -4.66 3.45 4.77 0.57 -2.41 117.00 123.71 3ciy n LEU 386 Ca -0.19 -3.50 -0.43 0.00 -0.03 0.00 0.00 56.01 51.86 3ciy n LEU 386 Cb 0.53 0.40 -0.02 0.00 -2.33 0.00 0.00 43.42 42.00 3ciy n LEU 386 CO 0.26 1.38 1.00 -0.55 -1.33 0.00 0.00 177.39 178.15 3ciy s SER 387 N -3.42 7.02 -1.36 -1.43 0.15 -1.20 -3.42 113.70 110.04 3ciy s SER 387 Ca 0.28 1.56 -0.03 0.00 0.70 0.00 0.00 55.95 58.46 3ciy s SER 387 Cb 0.40 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 62.19 3ciy s SER 387 CO 0.00 -0.71 0.77 1.17 1.20 0.00 0.00 173.24 175.67 3ciy n LYS 388 N 6.40 -5.10 -0.00 5.44 4.81 -0.65 -2.15 118.16 126.90 3ciy n LYS 388 Ca 0.13 0.62 0.06 0.00 -0.87 0.00 0.00 58.31 58.25 3ciy n LYS 388 Cb 0.45 -5.26 -0.09 0.00 0.02 0.00 0.00 35.03 30.16 3ciy n LYS 388 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 3ciy n THR 389 N -4.38 0.00 -4.40 3.15 -1.04 -1.22 -0.75 114.28 105.64 3ciy n THR 389 Ca -0.22 -0.26 -0.25 0.00 -2.04 0.00 0.00 64.05 61.28 3ciy n THR 389 Cb 0.64 0.45 -0.11 0.00 -1.82 0.00 0.00 70.33 69.48 3ciy n THR 389 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 3ciy s PHE 390 N -2.64 2.15 -0.03 -1.42 0.08 -1.26 -2.51 117.98 112.36 3ciy s PHE 390 Ca -0.02 -0.39 0.02 0.00 0.12 0.00 0.00 56.93 56.66 3ciy s PHE 390 Cb 0.08 -1.06 -0.03 0.00 -0.57 0.00 0.00 43.02 41.44 3ciy s PHE 390 CO 0.51 0.47 0.00 0.25 -0.10 0.00 0.00 175.22 176.34 3ciy n THR 391 N 0.21 0.19 -1.51 0.64 -2.24 -0.98 -4.76 114.28 105.83 3ciy n THR 391 Ca -0.12 -0.11 -0.00 0.00 -2.27 0.00 0.00 64.05 61.55 3ciy n THR 391 Cb 0.57 -0.87 0.20 0.00 -2.10 0.00 0.00 70.33 68.13 3ciy n THR 391 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3ciy n SER 392 N -2.20 2.19 -2.44 3.42 7.64 -0.67 -4.76 113.62 116.81 3ciy n SER 392 Ca -0.05 -3.82 -0.32 0.00 1.01 0.00 0.00 58.87 55.68 3ciy n SER 392 Cb 0.58 -0.60 0.05 0.00 -1.01 0.00 0.00 64.21 63.23 3ciy n SER 392 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3ciy n LEU 393 N -1.12 7.32 -0.33 -3.43 0.00 -1.24 -4.71 117.00 113.49 3ciy n LEU 393 Ca 0.28 -4.26 0.21 0.00 0.00 0.00 0.00 56.01 52.25 3ciy n LEU 393 Cb 0.91 -1.05 0.43 0.00 0.00 0.00 0.00 43.42 43.71 3ciy n LEU 393 CO 0.11 1.54 1.07 1.56 0.00 0.00 0.00 177.39 181.67 3ciy h GLN 394 N 2.31 0.28 -5.00 1.96 7.50 -1.85 -3.40 115.11 116.90 3ciy h GLN 394 Ca 0.52 -0.02 -0.58 0.00 0.50 0.00 0.00 58.65 59.07 3ciy h GLN 394 Cb 0.60 -0.06 -0.33 0.00 0.05 0.00 0.00 27.48 27.74 3ciy h GLN 394 CO 1.34 0.19 -0.84 0.99 -1.50 0.00 0.00 178.83 179.00 3ciy s THR 395 N -5.73 1.51 -0.39 -0.54 2.01 -1.26 -1.69 115.64 109.55 3ciy s THR 395 Ca -0.10 -0.71 -0.25 0.00 0.31 0.00 0.00 61.69 60.93 3ciy s THR 395 Cb 0.29 -1.33 0.02 0.00 0.01 0.00 0.00 72.50 71.49 3ciy s THR 395 CO 0.79 0.44 0.90 -0.76 -0.69 0.00 0.00 174.62 175.29 3ciy s LEU 396 N 0.40 4.02 0.38 4.42 1.43 -0.89 -5.04 118.68 123.40 3ciy s LEU 396 Ca -0.13 0.44 0.07 0.00 -1.03 0.00 0.00 54.13 53.48 3ciy s LEU 396 Cb -0.15 -3.20 -0.00 0.00 0.03 0.00 0.00 46.19 42.86 3ciy s LEU 396 CO 0.05 -0.88 0.49 0.42 0.23 0.00 0.00 176.35 176.66 3ciy s THR 397 N 3.47 3.43 -1.42 5.49 -4.23 -1.26 -2.36 115.64 118.76 3ciy s THR 397 Ca 0.37 -1.06 0.15 0.00 -1.18 0.00 0.00 61.69 59.97 3ciy s THR 397 Cb -0.12 -3.17 0.25 0.00 1.34 0.00 0.00 72.50 70.80 3ciy s THR 397 CO 0.20 -0.08 1.40 -0.46 -0.54 0.00 0.00 174.62 175.15 3ciy n ASN 398 N -1.70 0.00 -0.69 3.99 6.94 -1.26 -1.80 115.26 120.73 3ciy n ASN 398 Ca 0.04 0.08 0.06 0.00 -0.02 0.00 0.00 54.58 54.74 3ciy n ASN 398 Cb 0.59 -0.29 0.16 0.00 -2.36 0.00 0.00 39.78 37.88 3ciy n ASN 398 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3ciy n GLU 399 N -1.29 2.84 0.08 -3.83 1.02 -1.26 -4.65 120.64 113.54 3ciy n GLU 399 Ca 0.07 -2.08 -0.04 0.00 -0.02 0.00 0.00 57.16 55.09 3ciy n GLU 399 Cb 0.12 -1.29 -0.02 0.00 -0.02 0.00 0.00 31.44 30.23 3ciy n GLU 399 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3ciy h THR 400 N 2.19 0.00 -0.32 2.62 2.02 -1.67 -3.34 112.91 114.41 3ciy h THR 400 Ca 0.00 -0.32 -0.15 0.00 0.77 0.00 0.00 66.41 66.71 3ciy h THR 400 Cb 0.75 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.07 3ciy h THR 400 CO 0.00 0.00 0.19 0.49 0.37 0.00 0.00 175.52 176.57 3ciy n PHE 401 N -3.51 0.99 -0.09 3.16 3.72 -1.26 -4.27 117.46 116.19 3ciy n PHE 401 Ca -0.03 -0.86 -0.03 0.00 -0.05 0.00 0.00 57.45 56.49 3ciy n PHE 401 Cb 0.09 -0.45 0.21 0.00 -0.94 0.00 0.00 39.48 38.39 3ciy n PHE 401 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 3ciy h VAL 402 N 0.47 1.22 -0.88 -4.37 3.04 -1.83 -2.92 116.25 110.99 3ciy h VAL 402 Ca 0.19 -0.87 0.12 0.00 -1.01 0.00 0.00 66.70 65.13 3ciy h VAL 402 Cb 1.54 0.80 -0.08 0.00 -2.01 0.00 0.00 31.29 31.54 3ciy h VAL 402 CO 0.34 0.31 0.50 0.28 -1.01 0.00 0.00 177.57 178.00 3ciy h SER 403 N 0.71 0.69 0.00 3.17 0.02 -1.74 -0.58 113.55 115.81 3ciy h SER 403 Ca 0.15 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3ciy h SER 403 Cb 0.35 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3ciy h SER 403 CO 0.01 0.35 0.00 0.18 -1.14 0.00 0.00 176.83 176.23 3ciy n LEU 404 N -4.76 1.08 0.16 5.07 4.77 -1.10 -4.04 117.00 118.18 3ciy n LEU 404 Ca 0.16 -0.54 -0.14 0.00 -0.03 0.00 0.00 56.01 55.46 3ciy n LEU 404 Cb 0.36 -0.43 -0.08 0.00 -2.33 0.00 0.00 43.42 40.94 3ciy n LEU 404 CO 0.25 0.24 0.77 0.00 -1.33 0.00 0.00 177.39 177.33 3ciy h ALA 405 N 1.88 -0.34 -0.44 -1.18 0.00 -1.23 -3.08 119.26 114.87 3ciy h ALA 405 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3ciy h ALA 405 Cb 0.48 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3ciy h ALA 405 CO 0.00 -0.68 0.00 0.72 0.00 0.00 0.00 179.25 179.29 3ciy n HIS 406 N -5.23 1.38 -3.87 0.00 8.25 -1.26 -4.84 115.22 109.65 3ciy n HIS 406 Ca -0.10 -0.50 -0.36 0.00 -0.26 0.00 0.00 57.72 56.51 3ciy n HIS 406 Cb 0.16 -0.33 -0.11 0.00 1.12 0.00 0.00 29.99 30.83 3ciy n HIS 406 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3ciy s SER 407 N -0.64 5.41 -0.50 0.41 0.01 -1.17 -4.51 113.70 112.72 3ciy s SER 407 Ca 0.39 -0.07 -0.25 0.00 1.31 0.00 0.00 55.95 57.33 3ciy s SER 407 Cb 0.28 -1.95 -0.23 0.00 0.21 0.00 0.00 66.02 64.33 3ciy s SER 407 CO 0.14 0.06 1.81 -0.81 0.41 0.00 0.00 173.24 174.84 3ciy n PRO 408 N 4.32 0.99 -2.80 12.44 -0.04 -1.13 -4.90 135.00 143.88 3ciy n PRO 408 Ca -0.16 -1.55 -0.42 0.00 -0.04 0.00 0.00 63.50 61.34 3ciy n PRO 408 Cb 0.52 -2.77 -0.03 0.00 -0.04 0.00 0.00 33.50 31.18 3ciy n PRO 408 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ciy s LEU 409 N 0.75 4.23 -0.10 1.53 1.43 -1.06 -3.57 118.68 121.89 3ciy s LEU 409 Ca 0.61 1.38 0.05 0.00 -1.03 0.00 0.00 54.13 55.13 3ciy s LEU 409 Cb 0.15 -3.39 -0.09 0.00 0.03 0.00 0.00 46.19 42.88 3ciy s LEU 409 CO 0.20 -0.39 -0.03 0.18 0.23 0.00 0.00 176.35 176.54 3ciy n LEU 410 N 4.91 1.34 -4.37 1.79 4.32 0.22 -1.30 117.00 123.92 3ciy n LEU 410 Ca 0.06 -0.03 -0.32 0.00 -0.02 0.00 0.00 56.01 55.71 3ciy n LEU 410 Cb 0.49 -0.06 -0.15 0.00 -1.62 0.00 0.00 43.42 42.08 3ciy n LEU 410 CO 0.50 0.43 -0.53 -0.89 -1.22 0.00 0.00 177.39 175.68 3ciy s THR 411 N -2.22 2.42 -0.28 -5.08 2.01 -0.82 0.22 115.64 111.89 3ciy s THR 411 Ca -0.09 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.95 3ciy s THR 411 Cb 0.03 -1.89 0.15 0.00 0.01 0.00 0.00 72.50 70.81 3ciy s THR 411 CO 0.32 0.58 0.40 -0.22 -0.69 0.00 0.00 174.62 175.01 3ciy s LEU 412 N -0.61 -0.73 -0.24 4.42 2.96 -0.47 -1.57 118.68 122.44 3ciy s LEU 412 Ca 0.09 -0.28 -0.15 0.00 -0.22 0.00 0.00 54.13 53.57 3ciy s LEU 412 Cb -0.11 1.08 -0.04 0.00 0.50 0.00 0.00 46.19 47.63 3ciy s LEU 412 CO -0.00 -0.35 0.37 0.21 -1.32 0.00 0.00 176.35 175.27 3ciy s ASN 413 N 2.54 6.32 -0.08 3.68 3.84 -1.06 -0.81 114.94 129.36 3ciy s ASN 413 Ca 0.10 0.37 0.12 0.00 0.21 0.00 0.00 52.86 53.66 3ciy s ASN 413 Cb -0.13 -2.21 0.18 0.00 -0.55 0.00 0.00 41.25 38.53 3ciy s ASN 413 CO -0.28 -0.13 1.07 0.18 -2.79 0.00 0.00 177.10 175.16 3ciy n LEU 414 N 4.94 1.93 -4.73 3.21 4.77 0.49 -0.31 117.00 127.30 3ciy n LEU 414 Ca -0.09 -2.49 -0.36 0.00 -0.03 0.00 0.00 56.01 53.04 3ciy n LEU 414 Cb 0.51 -0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.41 3ciy n LEU 414 CO 0.38 0.58 0.89 0.42 -1.33 0.00 0.00 177.39 178.33 3ciy s THR 415 N -2.01 2.03 -1.14 -5.08 -4.23 -1.19 -3.82 115.64 100.19 3ciy s THR 415 Ca 0.20 0.02 -0.02 0.00 -1.18 0.00 0.00 61.69 60.70 3ciy s THR 415 Cb 0.17 -2.93 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 3ciy s THR 415 CO 0.02 -0.00 0.97 0.29 -0.54 0.00 0.00 174.62 175.35 3ciy n LYS 416 N -2.09 -4.93 0.00 3.99 5.02 -0.77 -1.64 118.16 117.73 3ciy n LYS 416 Ca 0.16 0.85 0.00 0.00 -2.02 0.00 0.00 58.31 57.30 3ciy n LYS 416 Cb 0.48 -5.84 0.00 0.00 -0.02 0.00 0.00 35.03 29.65 3ciy n LYS 416 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3ciy n ASN 417 N -3.16 0.39 -0.16 4.39 3.02 -1.25 -1.79 115.26 116.69 3ciy n ASN 417 Ca -0.21 -0.76 -0.02 0.00 -0.03 0.00 0.00 54.58 53.57 3ciy n ASN 417 Cb 0.65 0.20 -0.01 0.00 -0.61 0.00 0.00 39.78 40.02 3ciy n ASN 417 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3ciy n HIS 418 N -0.20 0.00 -1.66 3.10 8.25 -1.26 -4.67 115.22 118.77 3ciy n HIS 418 Ca 0.00 0.00 -0.50 0.00 -0.26 0.00 0.00 57.72 56.96 3ciy n HIS 418 Cb 0.07 -0.83 -0.05 0.00 1.12 0.00 0.00 29.99 30.29 3ciy n HIS 418 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3ciy n ILE 419 N -2.77 0.22 0.01 1.59 5.41 -1.26 -4.25 119.36 118.30 3ciy n ILE 419 Ca -0.02 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.69 3ciy n ILE 419 Cb 0.15 -1.38 -0.00 0.00 -0.71 0.00 0.00 39.64 37.70 3ciy n ILE 419 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3ciy n SER 420 N 4.44 0.11 -3.67 4.38 3.41 -0.68 0.13 113.62 121.74 3ciy n SER 420 Ca 0.21 -0.50 -0.09 0.00 -0.26 0.00 0.00 58.87 58.23 3ciy n SER 420 Cb 0.23 1.00 -0.09 0.00 -0.26 0.00 0.00 64.21 65.09 3ciy n SER 420 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3ciy s LYS 421 N -1.04 0.54 -0.28 4.33 2.20 -1.25 -0.47 119.74 123.78 3ciy s LYS 421 Ca 0.00 0.99 0.01 0.00 -0.36 0.00 0.00 55.97 56.61 3ciy s LYS 421 Cb 0.00 0.05 0.05 0.00 -1.51 0.00 0.00 37.83 36.43 3ciy s LYS 421 CO 0.01 -0.15 -0.06 0.42 -0.36 0.00 0.00 175.35 175.20 3ciy s ILE 422 N 1.50 2.55 0.94 5.43 -1.09 -1.26 -2.10 121.20 127.16 3ciy s ILE 422 Ca -0.10 -1.49 -0.12 0.00 -2.23 0.00 0.00 60.65 56.71 3ciy s ILE 422 Cb -0.07 -2.47 0.15 0.00 -1.58 0.00 0.00 42.46 38.50 3ciy s ILE 422 CO -0.16 -0.04 1.13 0.00 -1.23 0.00 0.00 174.94 174.64 3ciy s ALA 423 N 1.18 1.56 0.53 9.38 0.00 -0.99 -4.81 121.76 128.60 3ciy s ALA 423 Ca -0.07 -0.51 -0.21 0.00 0.00 0.00 0.00 51.96 51.17 3ciy s ALA 423 Cb -0.20 -3.05 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 3ciy s ALA 423 CO -0.03 -2.44 1.17 0.09 0.00 0.00 0.00 175.76 174.55 3ciy n ASN 424 N -3.88 1.86 -1.55 0.00 4.13 -1.26 -2.88 115.26 111.68 3ciy n ASN 424 Ca 0.06 0.95 -0.17 0.00 1.68 0.00 0.00 54.58 57.10 3ciy n ASN 424 Cb 0.59 -1.48 -0.07 0.00 -1.54 0.00 0.00 39.78 37.28 3ciy n ASN 424 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ciy n GLY 425 N 0.99 1.52 0.31 7.41 0.00 -1.23 -4.45 105.19 109.75 3ciy n GLY 425 Ca 0.11 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.30 3ciy n GLY 425 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ciy h THR 426 N 0.00 0.38 -0.06 2.61 2.02 -1.76 -2.33 112.91 113.76 3ciy h THR 426 Ca -0.35 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.83 3ciy h THR 426 Cb 1.13 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 3ciy h THR 426 CO 0.51 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.89 3ciy n PHE 427 N -3.63 0.08 -0.45 3.16 3.72 -1.26 -4.51 117.46 114.56 3ciy n PHE 427 Ca -0.02 -0.25 0.42 0.00 -0.05 0.00 0.00 57.45 57.54 3ciy n PHE 427 Cb 0.12 -0.02 0.77 0.00 -0.94 0.00 0.00 39.48 39.41 3ciy n PHE 427 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ciy h SER 428 N 0.73 0.00 1.56 4.37 4.64 -1.34 0.20 113.55 123.71 3ciy h SER 428 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 3ciy h SER 428 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 3ciy h SER 428 CO 0.00 0.00 -0.45 -0.50 -0.87 0.00 0.00 176.83 175.01 3ciy h TRP 429 N 0.00 0.00 -0.22 4.77 4.06 -1.86 -3.36 115.95 119.35 3ciy h TRP 429 Ca 0.69 0.00 -0.64 0.00 2.06 0.00 0.00 58.89 61.01 3ciy h TRP 429 Cb 2.83 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 30.98 3ciy h TRP 429 CO 0.00 0.41 3.19 1.28 -3.56 0.00 0.00 178.44 179.76 3ciy n LEU 430 N -3.19 8.32 -0.19 -4.49 4.32 0.71 -4.57 117.00 117.91 3ciy n LEU 430 Ca 0.02 -4.35 -0.02 0.00 -0.02 0.00 0.00 56.01 51.64 3ciy n LEU 430 Cb 0.70 -1.51 0.05 0.00 -1.62 0.00 0.00 43.42 41.04 3ciy n LEU 430 CO 0.39 2.04 0.74 1.23 -1.22 0.00 0.00 177.39 180.57 3ciy h GLY 431 N 6.52 0.37 -0.99 -0.72 0.00 -1.74 -2.21 103.07 104.31 3ciy h GLY 431 Ca 0.78 0.21 0.00 0.00 0.00 0.00 0.00 47.33 48.33 3ciy h GLY 431 CO 1.59 -0.22 0.00 -1.06 0.00 0.00 0.00 176.54 176.84 3ciy n GLN 432 N -5.41 1.65 -1.77 4.80 6.02 -1.26 -3.58 117.38 117.84 3ciy n GLN 432 Ca 0.06 -1.01 -0.42 0.00 -0.01 0.00 0.00 57.00 55.62 3ciy n GLN 432 Cb 0.31 -1.24 -0.02 0.00 1.02 0.00 0.00 30.24 30.31 3ciy n GLN 432 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3ciy s LEU 433 N -1.07 4.34 -0.06 1.08 2.96 -0.42 -4.35 118.68 121.17 3ciy s LEU 433 Ca 0.21 2.95 -0.03 0.00 -0.22 0.00 0.00 54.13 57.04 3ciy s LEU 433 Cb 0.11 -3.63 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 3ciy s LEU 433 CO 0.15 -0.93 -0.08 0.54 -1.32 0.00 0.00 176.35 174.71 3ciy n ARG 434 N 2.34 0.13 -3.84 1.98 1.74 -0.12 -3.51 116.66 115.38 3ciy n ARG 434 Ca 0.09 0.05 -0.36 0.00 -0.77 0.00 0.00 57.85 56.86 3ciy n ARG 434 Cb 0.37 -0.72 -0.13 0.00 -1.02 0.00 0.00 32.46 30.96 3ciy n ARG 434 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ciy s ILE 435 N -2.11 3.31 -0.05 0.55 1.01 0.13 0.15 121.20 124.20 3ciy s ILE 435 Ca -0.08 -1.35 0.05 0.00 0.00 0.00 0.00 60.65 59.26 3ciy s ILE 435 Cb 0.03 -2.92 -0.02 0.00 0.01 0.00 0.00 42.46 39.55 3ciy s ILE 435 CO 0.10 -0.19 -0.18 -0.22 0.00 0.00 0.00 174.94 174.46 3ciy s LEU 436 N 1.30 2.54 -0.22 2.97 0.20 -1.08 -1.36 118.68 123.02 3ciy s LEU 436 Ca -0.03 -0.28 -0.02 0.00 0.69 0.00 0.00 54.13 54.49 3ciy s LEU 436 Cb -0.20 -1.50 0.06 0.00 -0.43 0.00 0.00 46.19 44.13 3ciy s LEU 436 CO 0.00 0.33 0.01 -0.62 -0.29 0.00 0.00 176.35 175.78 3ciy s ASP 437 N -0.62 3.27 -0.40 3.68 3.68 0.01 -2.65 116.67 123.64 3ciy s ASP 437 Ca 0.09 -0.99 0.05 0.00 2.13 0.00 0.00 52.55 53.83 3ciy s ASP 437 Cb -0.11 -0.79 0.46 0.00 -1.45 0.00 0.00 42.92 41.04 3ciy s ASP 437 CO 0.01 -0.29 1.48 0.18 0.13 0.00 0.00 175.17 176.67 3ciy n LEU 438 N 4.92 5.65 -4.92 -1.34 4.77 -0.32 -0.38 117.00 125.38 3ciy n LEU 438 Ca -0.09 -4.48 -0.29 0.00 -0.03 0.00 0.00 56.01 51.12 3ciy n LEU 438 Cb 0.46 -0.57 0.12 0.00 -2.33 0.00 0.00 43.42 41.09 3ciy n LEU 438 CO 0.14 1.80 0.78 -0.83 -1.33 0.00 0.00 177.39 177.96 3ciy s GLY 439 N -2.93 1.67 -1.38 -0.72 0.00 -1.21 -4.33 107.32 98.42 3ciy s GLY 439 Ca 0.54 -0.91 -0.12 0.00 0.00 0.00 0.00 44.72 44.24 3ciy s GLY 439 CO 0.02 -0.34 0.36 1.04 0.00 0.00 0.00 173.10 174.18 3ciy n LEU 440 N -3.39 -1.24 -4.45 0.66 4.77 0.06 -3.22 117.00 110.19 3ciy n LEU 440 Ca 0.11 -1.20 -0.24 0.00 -0.03 0.00 0.00 56.01 54.65 3ciy n LEU 440 Cb 0.60 -1.82 -0.08 0.00 -2.33 0.00 0.00 43.42 39.79 3ciy n LEU 440 CO 0.52 0.56 -0.17 0.20 -1.33 0.00 0.00 177.39 177.17 3ciy s ASN 441 N -4.06 2.45 -0.05 -1.43 0.01 -0.96 -1.86 114.94 109.05 3ciy s ASN 441 Ca 0.18 -1.70 0.17 0.00 -0.71 0.00 0.00 52.86 50.80 3ciy s ASN 441 Cb -0.09 0.54 0.58 0.00 0.41 0.00 0.00 41.25 42.68 3ciy s ASN 441 CO 0.95 -0.98 1.48 1.21 -1.51 0.00 0.00 177.10 178.26 3ciy n GLU 442 N -0.83 2.88 -1.68 -0.60 4.07 0.02 -3.87 120.64 120.63 3ciy n GLU 442 Ca -0.02 -2.33 -0.64 0.00 -0.06 0.00 0.00 57.16 54.11 3ciy n GLU 442 Cb 0.64 -1.64 -0.09 0.00 -0.06 0.00 0.00 31.44 30.29 3ciy n GLU 442 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 3ciy n ILE 443 N 1.12 0.10 -3.40 6.31 5.41 0.12 -4.13 119.36 124.88 3ciy n ILE 443 Ca 0.21 -0.02 -0.27 0.00 1.00 0.00 0.00 62.75 63.67 3ciy n ILE 443 Cb 0.65 -0.74 -0.10 0.00 -0.71 0.00 0.00 39.64 38.73 3ciy n ILE 443 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 3ciy s GLU 444 N 3.54 0.83 0.35 0.38 2.12 0.38 -2.18 118.70 124.13 3ciy s GLU 444 Ca 1.05 -1.95 -0.13 0.00 0.36 0.00 0.00 54.97 54.29 3ciy s GLU 444 Cb -1.36 -1.39 0.04 0.00 0.26 0.00 0.00 34.13 31.68 3ciy s GLU 444 CO 0.75 -1.35 0.69 1.14 -0.54 0.00 0.00 175.26 175.95 3ciy s GLN 445 N 0.26 2.07 -0.37 4.30 -2.07 -1.06 -4.82 119.66 117.96 3ciy s GLN 445 Ca 0.30 -1.44 -0.02 0.00 -1.82 0.00 0.00 55.36 52.38 3ciy s GLN 445 Cb -0.01 0.58 0.09 0.00 -1.09 0.00 0.00 33.01 32.58 3ciy s GLN 445 CO -0.16 -0.94 0.14 -1.59 -1.32 0.00 0.00 175.29 171.42 3ciy s LYS 446 N -2.78 2.04 -0.20 9.60 -2.85 -1.26 -3.17 119.74 121.13 3ciy s LYS 446 Ca 0.19 -1.69 -0.39 0.00 -1.00 0.00 0.00 55.97 53.08 3ciy s LYS 446 Cb -0.04 -3.44 -0.15 0.00 -2.06 0.00 0.00 37.83 32.14 3ciy s LYS 446 CO 0.13 -0.94 1.72 1.28 0.10 0.00 0.00 175.35 177.63 3ciy n LEU 447 N 4.56 2.48 -2.21 2.77 4.77 -1.08 -4.86 117.00 123.43 3ciy n LEU 447 Ca -0.04 1.06 -0.22 0.00 -0.03 0.00 0.00 56.01 56.78 3ciy n LEU 447 Cb 0.42 -1.19 0.02 0.00 -2.33 0.00 0.00 43.42 40.34 3ciy n LEU 447 CO 0.30 -0.44 0.16 -1.54 -1.33 0.00 0.00 177.39 174.54 3ciy n SER 448 N 5.20 4.49 0.00 -1.43 3.41 -1.26 -3.73 113.62 120.30 3ciy n SER 448 Ca 0.25 -3.57 0.00 0.00 -0.26 0.00 0.00 58.87 55.29 3ciy n SER 448 Cb 0.16 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3ciy n SER 448 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ciy n GLY 449 N -0.63 0.80 0.12 5.00 0.00 -1.07 -4.66 105.19 104.75 3ciy n GLY 449 Ca 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.35 3ciy n GLY 449 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3ciy h GLN 450 N 0.13 0.10 0.00 1.61 1.08 -1.86 -3.14 115.11 113.03 3ciy h GLN 450 Ca 0.00 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 3ciy h GLN 450 Cb 0.00 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3ciy h GLN 450 CO 0.00 0.84 0.18 1.05 -0.95 0.00 0.00 178.83 179.95 3ciy h GLU 451 N 0.06 0.00 -0.43 1.46 9.09 -1.84 0.44 114.58 123.36 3ciy h GLU 451 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3ciy h GLU 451 Cb 1.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.49 3ciy h GLU 451 CO 0.11 0.00 0.00 0.91 0.05 0.00 0.00 179.01 180.08 3ciy n TRP 452 N -2.72 0.98 -1.73 2.06 7.02 -1.18 -4.50 117.44 117.36 3ciy n TRP 452 Ca -0.02 -0.65 -0.43 0.00 -1.02 0.00 0.00 57.50 55.38 3ciy n TRP 452 Cb 0.23 -0.19 -0.03 0.00 -2.42 0.00 0.00 31.31 28.90 3ciy n TRP 452 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 3ciy s ARG 453 N -1.84 3.72 0.00 -0.99 3.52 0.15 -2.34 118.95 121.17 3ciy s ARG 453 Ca 0.39 2.23 0.00 0.00 -0.13 0.00 0.00 55.73 58.22 3ciy s ARG 453 Cb 0.26 -4.21 0.00 0.00 -1.56 0.00 0.00 34.95 29.44 3ciy s ARG 453 CO 0.17 -1.43 0.00 0.41 -0.81 0.00 0.00 175.30 173.64 3ciy n GLY 454 N 4.99 0.82 2.68 8.12 0.00 -1.26 -3.06 105.19 117.48 3ciy n GLY 454 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 3ciy n GLY 454 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ciy n LEU 455 N 0.00 7.24 -0.34 0.99 4.77 -0.99 -4.25 117.00 124.43 3ciy n LEU 455 Ca 0.00 -4.42 -0.11 0.00 -0.03 0.00 0.00 56.01 51.45 3ciy n LEU 455 Cb 0.00 -1.55 -0.09 0.00 -2.33 0.00 0.00 43.42 39.44 3ciy n LEU 455 CO 0.00 1.46 0.48 -0.09 -1.33 0.00 0.00 177.39 177.91 3ciy h ARG 456 N 5.60 -0.07 -3.09 3.23 2.43 -1.85 -3.22 114.38 117.42 3ciy h ARG 456 Ca 0.58 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 59.13 3ciy h ARG 456 Cb 0.54 0.02 -0.42 0.00 -0.42 0.00 0.00 29.97 29.69 3ciy h ARG 456 CO 1.75 -0.05 -0.61 0.54 -1.51 0.00 0.00 179.97 180.09 3ciy s ASN 457 N -5.25 4.51 -0.20 -3.80 4.22 -1.25 -4.80 114.94 108.36 3ciy s ASN 457 Ca -0.12 -3.64 -0.08 0.00 -2.14 0.00 0.00 52.86 46.88 3ciy s ASN 457 Cb 0.10 -1.55 -0.04 0.00 1.28 0.00 0.00 41.25 41.04 3ciy s ASN 457 CO 0.58 -0.12 0.09 -0.51 -2.04 0.00 0.00 177.10 175.10 3ciy s ILE 458 N -1.13 4.92 0.00 0.54 -1.16 -1.22 -3.97 121.20 119.19 3ciy s ILE 458 Ca 0.24 0.02 0.00 0.00 -0.51 0.00 0.00 60.65 60.40 3ciy s ILE 458 Cb -0.08 -3.24 0.00 0.00 0.61 0.00 0.00 42.46 39.75 3ciy s ILE 458 CO -0.14 0.43 0.00 0.33 -2.81 0.00 0.00 174.94 172.76 3ciy n PHE 459 N 3.75 0.00 -4.32 3.50 7.35 0.41 -3.30 117.46 124.84 3ciy n PHE 459 Ca -0.16 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.28 3ciy n PHE 459 Cb 0.52 -0.28 -0.12 0.00 0.35 0.00 0.00 39.48 39.94 3ciy n PHE 459 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 3ciy s GLU 460 N -0.61 1.23 -0.48 -4.13 -1.05 -0.92 -0.44 118.70 112.30 3ciy s GLU 460 Ca 0.00 -1.27 0.03 0.00 -0.15 0.00 0.00 54.97 53.58 3ciy s GLU 460 Cb 0.00 -1.50 0.14 0.00 -0.44 0.00 0.00 34.13 32.33 3ciy s GLU 460 CO 0.00 0.34 0.27 0.42 0.95 0.00 0.00 175.26 177.24 3ciy s ILE 461 N -1.36 1.78 -0.32 1.83 1.01 -0.56 -2.63 121.20 120.94 3ciy s ILE 461 Ca 0.11 -2.89 -0.29 0.00 0.00 0.00 0.00 60.65 57.58 3ciy s ILE 461 Cb -0.09 -2.23 -0.00 0.00 0.01 0.00 0.00 42.46 40.15 3ciy s ILE 461 CO 0.05 -0.89 1.44 -0.47 0.00 0.00 0.00 174.94 175.07 3ciy s TYR 462 N 0.03 2.41 -0.10 3.97 5.04 -1.08 -3.04 117.35 124.57 3ciy s TYR 462 Ca 0.19 0.72 0.16 0.00 -2.44 0.00 0.00 57.07 55.69 3ciy s TYR 462 Cb -0.22 -4.08 0.35 0.00 0.35 0.00 0.00 41.96 38.36 3ciy s TYR 462 CO -0.02 -2.14 1.17 -0.11 -1.34 0.00 0.00 175.55 173.10 3ciy n LEU 463 N 8.39 1.77 -4.80 6.97 7.94 -1.10 -1.18 117.00 134.99 3ciy n LEU 463 Ca 0.17 -2.81 -0.35 0.00 -1.11 0.00 0.00 56.01 51.90 3ciy n LEU 463 Cb 0.47 -0.28 -0.06 0.00 0.53 0.00 0.00 43.42 44.07 3ciy n LEU 463 CO 0.66 0.87 0.66 -0.44 -1.11 0.00 0.00 177.39 178.03 3ciy s SER 464 N -2.51 7.10 -0.12 1.96 0.01 -1.25 -4.59 113.70 114.31 3ciy s SER 464 Ca 0.31 1.79 -0.01 0.00 1.31 0.00 0.00 55.95 59.36 3ciy s SER 464 Cb 0.32 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.98 3ciy s SER 464 CO -0.08 -0.24 0.10 -1.22 0.41 0.00 0.00 173.24 172.21 3ciy n TYR 465 N -0.03 -0.28 -4.33 2.43 4.01 0.52 -0.76 117.16 118.72 3ciy n TYR 465 Ca 0.04 0.10 -0.16 0.00 -0.16 0.00 0.00 57.90 57.72 3ciy n TYR 465 Cb 0.52 -2.62 -0.04 0.00 -0.31 0.00 0.00 39.34 36.88 3ciy n TYR 465 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ciy n ASN 466 N -1.65 1.47 -0.02 7.72 4.13 -1.13 -2.25 115.26 123.52 3ciy n ASN 466 Ca -0.01 -2.31 -0.17 0.00 1.68 0.00 0.00 54.58 53.78 3ciy n ASN 466 Cb 0.51 0.54 -0.14 0.00 -1.54 0.00 0.00 39.78 39.15 3ciy n ASN 466 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 3ciy h LYS 467 N 0.00 0.12 -1.95 3.52 1.79 -1.61 -3.40 116.57 115.04 3ciy h LYS 467 Ca -0.20 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.05 3ciy h LYS 467 Cb 0.74 0.08 -0.22 0.00 -1.58 0.00 0.00 32.23 31.25 3ciy h LYS 467 CO 0.33 1.10 0.13 -0.47 -1.08 0.00 0.00 179.45 179.46 3ciy s TYR 468 N -2.31 -0.84 -0.43 -1.35 6.14 -0.92 -4.61 117.35 113.03 3ciy s TYR 468 Ca -0.17 1.90 0.06 0.00 0.64 0.00 0.00 57.07 59.49 3ciy s TYR 468 Cb -0.01 0.40 0.21 0.00 0.42 0.00 0.00 41.96 42.98 3ciy s TYR 468 CO 0.74 -0.41 0.45 1.28 0.64 0.00 0.00 175.55 178.26 3ciy n LEU 469 N 3.22 0.23 -4.71 6.97 4.77 -1.16 -2.57 117.00 123.75 3ciy n LEU 469 Ca -0.16 -4.62 -0.42 0.00 -0.03 0.00 0.00 56.01 50.78 3ciy n LEU 469 Cb 0.56 0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 42.08 3ciy n LEU 469 CO 0.01 1.96 1.24 -1.58 -1.33 0.00 0.00 177.39 177.69 3ciy s GLN 470 N -0.74 4.22 0.25 3.23 0.74 -1.19 -3.89 119.66 122.29 3ciy s GLN 470 Ca 0.34 2.31 0.06 0.00 0.05 0.00 0.00 55.36 58.12 3ciy s GLN 470 Cb 0.10 -3.32 -0.03 0.00 1.10 0.00 0.00 33.01 30.86 3ciy s GLN 470 CO -0.15 -0.63 0.30 -0.51 -0.55 0.00 0.00 175.29 173.75 3ciy s LEU 471 N 1.66 4.07 0.39 3.68 1.43 -0.88 -2.62 118.68 126.43 3ciy s LEU 471 Ca 0.70 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.75 3ciy s LEU 471 Cb -0.41 -2.62 -0.03 0.00 0.03 0.00 0.00 46.19 43.16 3ciy s LEU 471 CO 0.31 -0.08 0.14 -0.94 0.23 0.00 0.00 176.35 176.01 3ciy s SER 472 N -3.93 2.60 0.00 2.29 1.04 -1.24 -4.78 113.70 109.66 3ciy s SER 472 Ca 0.34 -1.66 0.12 0.00 0.48 0.00 0.00 55.95 55.22 3ciy s SER 472 Cb -0.08 0.48 0.53 0.00 0.10 0.00 0.00 66.02 67.05 3ciy s SER 472 CO 0.27 -0.93 1.34 1.07 0.98 0.00 0.00 173.24 175.97 3ciy n THR 473 N -0.86 1.03 -0.14 2.02 5.66 -1.26 -3.00 114.28 117.73 3ciy n THR 473 Ca -0.04 0.26 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 3ciy n THR 473 Cb 0.65 -1.06 0.00 0.00 -1.55 0.00 0.00 70.33 68.37 3ciy n THR 473 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 3ciy n SER 474 N -1.42 0.87 -0.27 1.09 2.88 -1.26 -4.73 113.62 110.77 3ciy n SER 474 Ca 0.04 -1.02 0.21 0.00 -1.33 0.00 0.00 58.87 56.77 3ciy n SER 474 Cb 0.12 0.00 0.39 0.00 -0.75 0.00 0.00 64.21 63.97 3ciy n SER 474 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3ciy n SER 475 N -0.01 0.13 -0.16 -3.46 7.64 -1.16 -1.48 113.62 115.12 3ciy n SER 475 Ca 0.00 1.38 0.02 0.00 1.01 0.00 0.00 58.87 61.28 3ciy n SER 475 Cb 0.04 -0.60 0.02 0.00 -1.01 0.00 0.00 64.21 62.66 3ciy n SER 475 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3ciy n PHE 476 N -4.99 0.04 -0.14 1.43 3.72 -1.26 -2.58 117.46 113.68 3ciy n PHE 476 Ca 0.26 -0.13 0.23 0.00 -0.05 0.00 0.00 57.45 57.76 3ciy n PHE 476 Cb 0.89 -0.01 0.65 0.00 -0.94 0.00 0.00 39.48 40.07 3ciy n PHE 476 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ciy h ALA 477 N 0.69 2.55 0.00 4.37 0.00 -1.52 -0.95 119.26 124.40 3ciy h ALA 477 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ciy h ALA 477 Cb 0.26 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3ciy h ALA 477 CO 0.00 -0.78 -0.06 1.25 0.00 0.00 0.00 179.25 179.66 3ciy h LEU 478 N 0.12 0.00 -6.95 0.00 6.46 -1.78 -3.38 115.31 109.78 3ciy h LEU 478 Ca 0.38 0.00 -0.61 0.00 -0.12 0.00 0.00 57.88 57.53 3ciy h LEU 478 Cb 1.32 0.00 -0.41 0.00 -0.73 0.00 0.00 40.66 40.85 3ciy h LEU 478 CO -0.05 0.06 -0.69 0.68 -0.62 0.00 0.00 178.44 177.82 3ciy s VAL 479 N -3.52 2.05 -0.62 1.05 -7.23 -0.36 -4.89 120.40 106.88 3ciy s VAL 479 Ca 0.03 -3.51 0.07 0.00 -1.81 0.00 0.00 61.98 56.76 3ciy s VAL 479 Cb 0.08 -2.37 0.43 0.00 0.56 0.00 0.00 36.38 35.07 3ciy s VAL 479 CO 0.60 -1.01 1.15 -0.81 -0.31 0.00 0.00 175.10 174.72 3ciy n PRO 480 N 2.58 3.02 0.00 4.82 -0.04 -1.26 -3.77 135.00 140.35 3ciy n PRO 480 Ca 0.18 -1.63 0.12 0.00 -0.04 0.00 0.00 63.50 62.13 3ciy n PRO 480 Cb 0.37 -1.90 0.10 0.00 -0.04 0.00 0.00 33.50 32.04 3ciy n PRO 480 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ciy n SER 481 N 0.32 2.49 -4.74 3.54 7.64 -1.26 -4.39 113.62 117.23 3ciy n SER 481 Ca 0.14 -1.76 -0.42 0.00 1.01 0.00 0.00 58.87 57.85 3ciy n SER 481 Cb 0.74 0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 64.09 3ciy n SER 481 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3ciy s LEU 482 N -2.18 4.36 -0.15 -3.43 1.43 -1.21 -4.51 118.68 112.99 3ciy s LEU 482 Ca 0.25 2.82 -0.08 0.00 -1.03 0.00 0.00 54.13 56.10 3ciy s LEU 482 Cb 0.19 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.73 3ciy s LEU 482 CO 0.40 -0.85 -0.20 0.00 0.23 0.00 0.00 176.35 175.94 3ciy n GLN 483 N 2.61 0.32 -5.21 1.70 1.13 0.41 -1.96 117.38 116.38 3ciy n GLN 483 Ca 0.09 0.14 -0.32 0.00 -1.94 0.00 0.00 57.00 54.98 3ciy n GLN 483 Cb 0.38 -1.04 -0.16 0.00 0.11 0.00 0.00 30.24 29.53 3ciy n GLN 483 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3ciy s ARG 484 N -2.29 2.59 -0.23 -1.09 0.52 -1.22 -0.38 118.95 116.85 3ciy s ARG 484 Ca -0.21 -0.88 -0.04 0.00 -0.52 0.00 0.00 55.73 54.09 3ciy s ARG 484 Cb 0.08 -2.21 0.08 0.00 0.52 0.00 0.00 34.95 33.42 3ciy s ARG 484 CO 0.27 0.39 0.09 -1.17 0.02 0.00 0.00 175.30 174.90 3ciy s LEU 485 N -0.19 0.89 -0.04 2.53 2.96 -0.66 -1.49 118.68 122.68 3ciy s LEU 485 Ca -0.03 -1.00 -0.12 0.00 -0.22 0.00 0.00 54.13 52.76 3ciy s LEU 485 Cb -0.14 -0.46 -0.05 0.00 0.50 0.00 0.00 46.19 46.05 3ciy s LEU 485 CO 0.03 -0.37 0.33 -0.04 -1.32 0.00 0.00 176.35 174.98 3ciy s MET 486 N 1.98 3.78 -0.30 1.98 -1.94 -1.17 -2.05 119.30 121.58 3ciy s MET 486 Ca 0.04 0.25 0.19 0.00 -1.71 0.00 0.00 55.69 54.46 3ciy s MET 486 Cb -0.16 -3.21 0.47 0.00 2.01 0.00 0.00 34.83 33.93 3ciy s MET 486 CO -0.19 0.71 1.12 1.28 -0.01 0.00 0.00 175.02 177.93 3ciy n LEU 487 N 1.89 0.86 -4.77 -0.03 7.99 0.00 -2.72 117.00 120.23 3ciy n LEU 487 Ca -0.16 -3.34 -0.37 0.00 -0.01 0.00 0.00 56.01 52.13 3ciy n LEU 487 Cb 0.53 0.38 -0.03 0.00 -0.11 0.00 0.00 43.42 44.19 3ciy n LEU 487 CO 0.36 1.38 0.79 -0.60 -1.51 0.00 0.00 177.39 177.81 3ciy s ARG 488 N -2.75 4.11 -0.68 3.23 3.52 -1.26 -4.00 118.95 121.12 3ciy s ARG 488 Ca 0.25 1.69 -0.18 0.00 -0.13 0.00 0.00 55.73 57.36 3ciy s ARG 488 Cb 0.39 -2.62 0.02 0.00 -1.56 0.00 0.00 34.95 31.18 3ciy s ARG 488 CO -0.02 -0.23 0.33 -2.13 -0.81 0.00 0.00 175.30 172.44 3ciy n ARG 489 N 0.03 -0.62 -0.01 5.12 0.63 -0.65 -0.35 116.66 120.80 3ciy n ARG 489 Ca 0.05 -0.19 0.01 0.00 -0.92 0.00 0.00 57.85 56.80 3ciy n ARG 489 Cb 0.48 -1.00 0.02 0.00 0.45 0.00 0.00 32.46 32.40 3ciy n ARG 489 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 3ciy n VAL 490 N -3.19 0.99 -3.96 5.15 0.24 -1.26 -2.83 118.33 113.47 3ciy n VAL 490 Ca -0.07 -1.03 -0.32 0.00 -2.04 0.00 0.00 64.34 60.88 3ciy n VAL 490 Cb 0.31 0.47 -0.01 0.00 -1.47 0.00 0.00 33.84 33.14 3ciy n VAL 490 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ciy n ALA 491 N -0.55 -2.28 -1.61 2.33 0.00 -1.26 -3.00 120.51 114.14 3ciy n ALA 491 Ca 0.02 -0.35 -0.38 0.00 0.00 0.00 0.00 53.44 52.73 3ciy n ALA 491 Cb 0.32 -2.32 0.05 0.00 0.00 0.00 0.00 19.45 17.50 3ciy n ALA 491 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ciy n LEU 492 N -4.50 3.62 -3.82 0.00 4.77 -1.26 -4.13 117.00 111.67 3ciy n LEU 492 Ca -0.22 0.82 -0.12 0.00 -0.03 0.00 0.00 56.01 56.45 3ciy n LEU 492 Cb 0.64 -1.39 -0.13 0.00 -2.33 0.00 0.00 43.42 40.21 3ciy n LEU 492 CO 0.74 -1.85 -0.23 -0.75 -1.33 0.00 0.00 177.39 173.98 3ciy s LYS 493 N -2.72 0.14 -0.49 3.23 2.20 -1.25 -4.88 119.74 115.98 3ciy s LYS 493 Ca 0.75 0.20 -0.02 0.00 -0.36 0.00 0.00 55.97 56.54 3ciy s LYS 493 Cb -0.42 0.04 -0.02 0.00 -1.51 0.00 0.00 37.83 35.92 3ciy s LYS 493 CO 0.48 -0.03 0.44 0.09 -0.36 0.00 0.00 175.35 175.96 3ciy n ASN 494 N 3.15 -4.73 -0.41 1.43 5.03 -1.26 -2.07 115.26 116.41 3ciy n ASN 494 Ca -0.14 -0.23 0.05 0.00 0.87 0.00 0.00 54.58 55.12 3ciy n ASN 494 Cb 0.58 -3.13 0.06 0.00 -1.02 0.00 0.00 39.78 36.27 3ciy n ASN 494 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 3ciy n VAL 495 N -1.99 0.18 1.13 2.41 0.24 -1.26 -4.38 118.33 114.66 3ciy n VAL 495 Ca -0.02 -0.59 0.12 0.00 -2.04 0.00 0.00 64.34 61.81 3ciy n VAL 495 Cb 0.54 1.07 0.28 0.00 -1.47 0.00 0.00 33.84 34.25 3ciy n VAL 495 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3ciy n ASP 496 N 0.50 0.93 -4.77 -1.34 5.75 -1.26 -4.76 116.55 111.60 3ciy n ASP 496 Ca 0.06 -0.74 -0.38 0.00 -0.01 0.00 0.00 54.79 53.73 3ciy n ASP 496 Cb 0.26 0.25 -0.01 0.00 -1.03 0.00 0.00 41.12 40.60 3ciy n ASP 496 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 3ciy s ILE 497 N -2.69 2.97 -0.09 2.12 -0.00 -1.26 -4.63 121.20 117.62 3ciy s ILE 497 Ca 0.19 0.76 0.01 0.00 -0.00 0.00 0.00 60.65 61.61 3ciy s ILE 497 Cb 0.18 -3.41 -0.02 0.00 -0.00 0.00 0.00 42.46 39.21 3ciy s ILE 497 CO 0.60 0.03 -0.11 -0.44 -0.00 0.00 0.00 174.94 175.02 3ciy s SER 498 N -1.18 4.23 1.12 4.36 0.01 -1.26 -3.66 113.70 117.31 3ciy s SER 498 Ca 0.62 -0.19 -0.17 0.00 1.31 0.00 0.00 55.95 57.52 3ciy s SER 498 Cb -0.31 -1.22 0.25 0.00 0.21 0.00 0.00 66.02 64.94 3ciy s SER 498 CO 0.39 0.28 1.13 -2.16 0.41 0.00 0.00 173.24 173.29 3ciy s PRO 499 N -0.34 -0.54 0.13 12.44 0.04 -1.26 -5.02 135.00 140.45 3ciy s PRO 499 Ca 0.04 0.02 -0.31 0.00 0.04 0.00 0.00 61.00 60.79 3ciy s PRO 499 Cb -0.13 -1.67 -0.11 0.00 0.04 0.00 0.00 34.50 32.64 3ciy s PRO 499 CO 0.02 -3.27 1.85 0.45 0.04 0.00 0.00 177.00 176.09 3ciy s SER 500 N -3.94 6.40 0.44 6.66 0.15 -1.24 -4.81 113.70 117.36 3ciy s SER 500 Ca 0.70 2.79 0.20 0.00 0.70 0.00 0.00 55.95 60.33 3ciy s SER 500 Cb -0.11 -2.57 1.06 0.00 -1.71 0.00 0.00 66.02 62.70 3ciy s SER 500 CO 0.56 -1.02 1.54 1.55 1.20 0.00 0.00 173.24 177.07 3ciy h PRO 501 N 8.60 0.00 -0.25 5.44 0.13 -1.81 2.15 132.00 146.26 3ciy h PRO 501 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3ciy h PRO 501 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3ciy h PRO 501 CO 0.95 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.91 3ciy n PHE 502 N -2.35 0.31 -0.27 1.56 3.72 -1.26 -4.12 117.46 115.05 3ciy n PHE 502 Ca -0.01 -0.16 0.04 0.00 -0.05 0.00 0.00 57.45 57.28 3ciy n PHE 502 Cb 0.31 0.00 0.14 0.00 -0.94 0.00 0.00 39.48 38.99 3ciy n PHE 502 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3ciy h ARG 503 N 3.54 0.05 0.00 -1.08 9.65 0.32 0.17 114.38 127.02 3ciy h ARG 503 Ca 0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3ciy h ARG 503 Cb 0.77 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.34 3ciy h ARG 503 CO 0.00 0.03 0.00 -0.35 2.80 0.00 0.00 179.97 182.45 3ciy n PRO 504 N -5.43 0.20 -2.65 0.20 -0.04 -1.26 -4.52 135.00 121.49 3ciy n PRO 504 Ca 0.13 0.31 -0.42 0.00 -0.04 0.00 0.00 63.50 63.48 3ciy n PRO 504 Cb 0.46 -1.81 -0.02 0.00 -0.04 0.00 0.00 33.50 32.10 3ciy n PRO 504 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ciy s LEU 505 N -4.33 3.94 -0.11 1.53 1.43 0.05 -4.70 118.68 116.49 3ciy s LEU 505 Ca 0.07 -1.94 -0.11 0.00 -1.03 0.00 0.00 54.13 51.12 3ciy s LEU 505 Cb 0.11 -2.53 -0.27 0.00 0.03 0.00 0.00 46.19 43.53 3ciy s LEU 505 CO 0.47 -1.29 0.45 0.03 0.23 0.00 0.00 176.35 176.24 3ciy h ARG 506 N 8.81 0.26 0.00 1.70 3.08 -1.80 -3.32 114.38 123.11 3ciy h ARG 506 Ca 0.27 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3ciy h ARG 506 Cb 0.96 0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3ciy h ARG 506 CO 1.38 1.21 0.00 0.09 -1.07 0.00 0.00 179.97 181.58 3ciy n ASN 507 N -3.70 0.00 -4.67 7.04 3.02 -1.26 -4.27 115.26 111.41 3ciy n ASN 507 Ca -0.29 -1.38 -0.42 0.00 -0.03 0.00 0.00 54.58 52.45 3ciy n ASN 507 Cb 0.98 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.13 3ciy n ASN 507 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3ciy s LEU 508 N -1.12 4.27 -0.17 3.41 2.96 -0.83 -4.27 118.68 122.93 3ciy s LEU 508 Ca 0.04 1.98 -0.12 0.00 -0.22 0.00 0.00 54.13 55.81 3ciy s LEU 508 Cb 0.02 -3.55 -0.07 0.00 0.50 0.00 0.00 46.19 43.09 3ciy s LEU 508 CO 0.03 -0.78 -0.27 0.35 -1.32 0.00 0.00 176.35 174.37 3ciy n THR 509 N 5.11 1.27 -3.71 3.68 -2.24 0.48 -2.42 114.28 116.45 3ciy n THR 509 Ca 0.14 -0.09 -0.37 0.00 -2.27 0.00 0.00 64.05 61.46 3ciy n THR 509 Cb 0.44 -1.94 -0.11 0.00 -2.10 0.00 0.00 70.33 66.62 3ciy n THR 509 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ciy s ILE 510 N -2.51 4.82 -0.04 2.28 1.01 -0.47 -0.05 121.20 126.23 3ciy s ILE 510 Ca -0.26 -0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.41 3ciy s ILE 510 Cb 0.08 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 39.29 3ciy s ILE 510 CO 0.35 0.31 -0.10 -0.22 0.00 0.00 0.00 174.94 175.29 3ciy s LEU 511 N 1.53 1.66 -0.14 2.97 0.20 -0.79 -1.66 118.68 122.45 3ciy s LEU 511 Ca 0.06 -0.22 0.01 0.00 0.69 0.00 0.00 54.13 54.67 3ciy s LEU 511 Cb -0.15 -0.64 0.02 0.00 -0.43 0.00 0.00 46.19 44.99 3ciy s LEU 511 CO 0.06 0.04 -0.14 -0.62 -0.29 0.00 0.00 176.35 175.40 3ciy s ASP 512 N 0.48 2.62 -0.30 3.68 -1.08 -0.87 -2.40 116.67 118.80 3ciy s ASP 512 Ca -0.09 -0.47 0.15 0.00 -0.52 0.00 0.00 52.55 51.62 3ciy s ASP 512 Cb -0.12 -1.15 0.48 0.00 -1.46 0.00 0.00 42.92 40.66 3ciy s ASP 512 CO 0.02 -0.04 1.12 0.18 0.52 0.00 0.00 175.17 176.97 3ciy n LEU 513 N 4.64 3.15 -4.86 -1.34 4.77 -0.75 -0.82 117.00 121.80 3ciy n LEU 513 Ca -0.17 -3.98 -0.31 0.00 -0.03 0.00 0.00 56.01 51.52 3ciy n LEU 513 Cb 0.50 0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 3ciy n LEU 513 CO 0.22 1.62 0.52 -0.94 -1.33 0.00 0.00 177.39 177.48 3ciy s SER 514 N -3.63 6.64 -1.32 -1.43 1.04 -1.22 -4.34 113.70 109.45 3ciy s SER 514 Ca 0.38 1.33 -0.02 0.00 0.48 0.00 0.00 55.95 58.12 3ciy s SER 514 Cb 0.38 -2.40 -0.00 0.00 0.10 0.00 0.00 66.02 64.09 3ciy s SER 514 CO -0.02 -0.40 0.62 0.59 0.98 0.00 0.00 173.24 175.02 3ciy n ASN 515 N -1.10 -1.33 0.00 7.02 4.13 0.11 -1.63 115.26 122.47 3ciy n ASN 515 Ca 0.04 -0.89 0.00 0.00 1.68 0.00 0.00 54.58 55.41 3ciy n ASN 515 Cb 0.54 -3.72 0.00 0.00 -1.54 0.00 0.00 39.78 35.06 3ciy n ASN 515 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3ciy n ASN 516 N -3.01 0.15 -3.61 6.41 3.02 -1.20 -2.45 115.26 114.57 3ciy n ASN 516 Ca -0.28 -0.49 -0.21 0.00 -0.03 0.00 0.00 54.58 53.56 3ciy n ASN 516 Cb 0.67 0.54 0.05 0.00 -0.61 0.00 0.00 39.78 40.43 3ciy n ASN 516 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3ciy n ASN 517 N -0.54 -2.43 -4.61 6.41 2.85 -1.20 -4.42 115.26 111.32 3ciy n ASN 517 Ca 0.00 -0.81 -0.43 0.00 -0.11 0.00 0.00 54.58 53.23 3ciy n ASN 517 Cb 0.02 -4.24 -0.03 0.00 1.24 0.00 0.00 39.78 36.77 3ciy n ASN 517 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3ciy s ILE 518 N -3.58 3.17 0.17 -1.44 1.01 -1.20 -4.86 121.20 114.47 3ciy s ILE 518 Ca 0.12 0.18 -0.22 0.00 0.00 0.00 0.00 60.65 60.73 3ciy s ILE 518 Cb -0.03 -3.21 0.08 0.00 0.01 0.00 0.00 42.46 39.31 3ciy s ILE 518 CO 0.80 -0.13 1.60 0.00 0.00 0.00 0.00 174.94 177.22 3ciy h ALA 519 N 13.93 -0.10 -2.62 9.38 0.00 -1.85 -3.40 119.26 134.60 3ciy h ALA 519 Ca -0.39 0.12 0.13 0.00 0.00 0.00 0.00 54.91 54.77 3ciy h ALA 519 Cb 1.22 0.66 -0.03 0.00 0.00 0.00 0.00 17.79 19.64 3ciy h ALA 519 CO 0.98 -0.68 0.54 0.54 0.00 0.00 0.00 179.25 180.63 3ciy s ASN 520 N -5.09 0.01 -0.28 0.00 2.20 -1.26 -4.77 114.94 105.75 3ciy s ASN 520 Ca -0.15 -0.76 -0.26 0.00 -0.94 0.00 0.00 52.86 50.76 3ciy s ASN 520 Cb 0.14 0.56 0.15 0.00 -2.00 0.00 0.00 41.25 40.09 3ciy s ASN 520 CO 0.69 -1.11 1.16 -0.51 -2.94 0.00 0.00 177.10 174.39 3ciy s ILE 521 N -2.15 0.00 0.24 0.54 -1.16 -1.26 -4.56 121.20 112.84 3ciy s ILE 521 Ca 0.21 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.35 3ciy s ILE 521 Cb -0.03 -1.00 -0.04 0.00 0.61 0.00 0.00 42.46 42.00 3ciy s ILE 521 CO 0.06 0.00 0.42 0.54 -2.81 0.00 0.00 174.94 173.16 3ciy s ASN 522 N 0.01 6.36 0.54 4.50 6.03 -1.26 -4.99 114.94 126.13 3ciy s ASN 522 Ca 0.04 0.37 0.32 0.00 -1.03 0.00 0.00 52.86 52.57 3ciy s ASN 522 Cb -0.04 -2.00 1.49 0.00 -3.03 0.00 0.00 41.25 37.67 3ciy s ASN 522 CO -0.08 -0.10 1.88 1.05 -2.03 0.00 0.00 177.10 177.81 3ciy h GLU 523 N 1.64 0.00 -0.96 3.55 4.11 -1.91 -2.15 114.58 118.86 3ciy h GLU 523 Ca -0.49 0.00 0.31 0.00 0.07 0.00 0.00 59.36 59.25 3ciy h GLU 523 Cb 1.20 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.29 3ciy h GLU 523 CO 0.66 0.00 0.36 0.22 0.07 0.00 0.00 179.01 180.32 3ciy h ASP 524 N 0.00 0.14 -2.90 3.06 -0.00 -1.94 -3.42 116.42 111.36 3ciy h ASP 524 Ca 0.43 0.22 -0.59 0.00 -0.00 0.00 0.00 57.03 57.10 3ciy h ASP 524 Cb 1.75 0.27 0.16 0.00 -0.00 0.00 0.00 39.33 41.51 3ciy h ASP 524 CO -0.00 -0.25 -0.25 -0.11 -0.00 0.00 0.00 179.24 178.63 3ciy n LEU 525 N -5.23 1.21 0.00 2.28 7.94 -0.81 -1.71 117.00 120.68 3ciy n LEU 525 Ca 0.29 0.83 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 3ciy n LEU 525 Cb 0.92 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.66 3ciy n LEU 525 CO 0.04 -2.63 0.00 0.18 -1.11 0.00 0.00 177.39 173.87 3ciy n LEU 526 N 0.54 0.57 -4.63 -1.96 4.77 -1.26 -4.89 117.00 110.14 3ciy n LEU 526 Ca 0.11 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.67 3ciy n LEU 526 Cb 0.44 -1.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.08 3ciy n LEU 526 CO 0.53 -0.49 1.49 -0.70 -1.33 0.00 0.00 177.39 176.89 3ciy s GLU 527 N -0.98 3.72 0.00 3.23 2.12 -0.69 -2.87 118.70 123.22 3ciy s GLU 527 Ca 0.00 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.19 3ciy s GLU 527 Cb 0.00 -4.12 0.00 0.00 0.26 0.00 0.00 34.13 30.27 3ciy s GLU 527 CO 0.00 -1.40 0.00 0.41 -0.54 0.00 0.00 175.26 173.73 3ciy n GLY 528 N 4.85 0.68 3.33 -1.50 0.00 -1.26 -4.84 105.19 106.45 3ciy n GLY 528 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 3ciy n GLY 528 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ciy n LEU 529 N 0.00 5.53 0.00 0.99 4.77 -1.14 -4.73 117.00 122.41 3ciy n LEU 529 Ca 0.00 -4.17 0.08 0.00 -0.03 0.00 0.00 56.01 51.89 3ciy n LEU 529 Cb 0.00 -1.67 0.44 0.00 -2.33 0.00 0.00 43.42 39.86 3ciy n LEU 529 CO 0.00 0.59 0.73 1.21 -1.33 0.00 0.00 177.39 178.59 3ciy n GLU 530 N 6.82 0.31 0.00 3.23 4.07 -1.26 -2.47 120.64 131.33 3ciy n GLU 530 Ca 0.45 0.10 0.02 0.00 -0.06 0.00 0.00 57.16 57.68 3ciy n GLU 530 Cb 0.43 -1.50 -0.02 0.00 -0.06 0.00 0.00 31.44 30.29 3ciy n GLU 530 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3ciy n ASN 531 N -1.22 0.50 -4.51 4.31 3.02 -1.26 -4.47 115.26 111.64 3ciy n ASN 531 Ca 0.09 -0.75 -0.48 0.00 -0.03 0.00 0.00 54.58 53.41 3ciy n ASN 531 Cb 0.11 0.78 -0.05 0.00 -0.61 0.00 0.00 39.78 40.01 3ciy n ASN 531 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3ciy n LEU 532 N -0.80 2.57 -0.11 3.41 -0.00 -1.02 -4.31 117.00 116.74 3ciy n LEU 532 Ca 0.01 0.33 -0.20 0.00 -0.00 0.00 0.00 56.01 56.16 3ciy n LEU 532 Cb 0.09 -1.38 -0.07 0.00 -0.00 0.00 0.00 43.42 42.07 3ciy n LEU 532 CO 0.09 -0.71 -1.07 -0.62 -0.00 0.00 0.00 177.39 175.07 3ciy n GLU 533 N 8.40 0.50 -4.18 1.96 1.02 0.92 -2.70 120.64 126.57 3ciy n GLU 533 Ca 0.37 0.21 -0.34 0.00 -0.02 0.00 0.00 57.16 57.38 3ciy n GLU 533 Cb 0.31 -1.35 -0.10 0.00 -0.02 0.00 0.00 31.44 30.28 3ciy n GLU 533 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3ciy s ILE 534 N -2.58 4.50 -0.03 -3.67 1.09 -1.13 0.51 121.20 119.90 3ciy s ILE 534 Ca -0.31 -0.15 0.01 0.00 -1.10 0.00 0.00 60.65 59.10 3ciy s ILE 534 Cb 0.10 -2.98 0.02 0.00 -1.06 0.00 0.00 42.46 38.54 3ciy s ILE 534 CO 0.41 0.51 -0.01 -0.22 -0.10 0.00 0.00 174.94 175.53 3ciy s LEU 535 N 0.04 1.28 -0.11 2.97 2.96 -1.03 -1.89 118.68 122.91 3ciy s LEU 535 Ca 0.04 -0.04 0.04 0.00 -0.22 0.00 0.00 54.13 53.94 3ciy s LEU 535 Cb -0.13 -0.24 0.00 0.00 0.50 0.00 0.00 46.19 46.33 3ciy s LEU 535 CO 0.01 -0.08 -0.23 -1.81 -1.32 0.00 0.00 176.35 172.92 3ciy s ASP 536 N 0.89 3.04 -0.06 3.68 -0.00 -1.01 -1.69 116.67 121.52 3ciy s ASP 536 Ca -0.09 -0.56 0.11 0.00 -0.00 0.00 0.00 52.55 52.01 3ciy s ASP 536 Cb -0.12 -1.39 0.20 0.00 -0.00 0.00 0.00 42.92 41.61 3ciy s ASP 536 CO -0.01 0.14 1.10 0.49 -0.00 0.00 0.00 175.17 176.88 3ciy n PHE 537 N 3.63 0.00 -1.68 4.23 3.72 0.57 -1.81 117.46 126.11 3ciy n PHE 537 Ca -0.19 -0.53 -0.45 0.00 -0.05 0.00 0.00 57.45 56.23 3ciy n PHE 537 Cb 0.53 -0.12 -0.04 0.00 -0.94 0.00 0.00 39.48 38.91 3ciy n PHE 537 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ciy n GLN 538 N -0.44 2.35 -2.68 -1.08 3.00 -1.25 -3.68 117.38 113.60 3ciy n GLN 538 Ca 0.08 0.85 -0.02 0.00 -0.01 0.00 0.00 57.00 57.90 3ciy n GLN 538 Cb 0.76 -2.66 0.00 0.00 0.00 0.00 0.00 30.24 28.35 3ciy n GLN 538 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3ciy n HIS 539 N 4.06 -2.50 -2.18 1.08 8.25 -0.04 0.07 115.22 123.97 3ciy n HIS 539 Ca 0.17 0.97 0.00 0.00 -0.26 0.00 0.00 57.72 58.61 3ciy n HIS 539 Cb 0.31 -3.57 -0.00 0.00 1.12 0.00 0.00 29.99 27.84 3ciy n HIS 539 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3ciy n ASN 540 N -1.20 0.19 -3.70 0.41 3.02 -1.24 -2.92 115.26 109.82 3ciy n ASN 540 Ca 0.03 -1.85 -0.16 0.00 -0.03 0.00 0.00 54.58 52.57 3ciy n ASN 540 Cb 0.46 -0.12 -0.00 0.00 -0.61 0.00 0.00 39.78 39.50 3ciy n ASN 540 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3ciy n ASN 541 N 0.18 -1.07 -1.88 6.41 2.85 -1.25 -3.25 115.26 117.25 3ciy n ASN 541 Ca -0.02 -0.49 -0.09 0.00 -0.11 0.00 0.00 54.58 53.87 3ciy n ASN 541 Cb 0.83 -0.59 0.23 0.00 1.24 0.00 0.00 39.78 41.49 3ciy n ASN 541 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 3ciy n LEU 542 N -2.45 5.65 0.06 1.20 7.94 -0.88 -4.71 117.00 123.80 3ciy n LEU 542 Ca -0.06 -2.95 -0.06 0.00 -1.11 0.00 0.00 56.01 51.83 3ciy n LEU 542 Cb 0.22 -0.73 -0.03 0.00 0.53 0.00 0.00 43.42 43.41 3ciy n LEU 542 CO 0.29 0.79 0.51 0.00 -1.11 0.00 0.00 177.39 177.87 3ciy h ALA 543 N 2.25 -0.77 0.00 1.96 0.00 -1.78 -3.21 119.26 117.71 3ciy h ALA 543 Ca 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3ciy h ALA 543 Cb 2.22 0.55 0.00 0.00 0.00 0.00 0.00 17.79 20.56 3ciy h ALA 543 CO 0.71 -0.80 0.00 2.89 0.00 0.00 0.00 179.25 182.05 3ciy n ARG 544 N -3.46 0.16 0.00 0.00 -4.01 -1.26 -3.18 116.66 104.91 3ciy n ARG 544 Ca -0.03 0.45 0.05 0.00 -1.04 0.00 0.00 57.85 57.27 3ciy n ARG 544 Cb 0.15 -1.85 0.22 0.00 -3.04 0.00 0.00 32.46 27.94 3ciy n ARG 544 CO 0.00 0.00 0.00 1.28 -3.04 0.00 0.00 177.63 175.87 3ciy n LEU 545 N -2.16 0.00 -3.64 2.89 7.99 -1.21 -4.46 117.00 116.41 3ciy n LEU 545 Ca 0.02 0.37 -0.28 0.00 -0.01 0.00 0.00 56.01 56.11 3ciy n LEU 545 Cb 0.19 -0.37 -0.11 0.00 -0.11 0.00 0.00 43.42 43.01 3ciy n LEU 545 CO 0.17 -0.26 -0.21 0.26 -1.51 0.00 0.00 177.39 175.85 3ciy s TRP 546 N -2.75 2.12 0.00 -1.77 0.52 -1.19 -2.38 118.94 113.49 3ciy s TRP 546 Ca 0.07 -2.68 0.00 0.00 0.02 0.00 0.00 56.10 53.51 3ciy s TRP 546 Cb 0.06 -1.74 0.00 0.00 -1.15 0.00 0.00 33.47 30.64 3ciy s TRP 546 CO 0.15 -0.72 0.00 0.09 0.02 0.00 0.00 176.95 176.49 3ciy n ASN 550 N 2.72 0.00 -0.69 2.95 3.02 -1.26 -4.92 115.26 117.08 3ciy n ASN 550 Ca 0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 3ciy n ASN 550 Cb 0.40 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 3ciy n ASN 550 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 3ciy n PRO 551 N 0.00 -0.03 -0.17 3.52 -0.02 -1.26 -3.15 135.00 133.89 3ciy n PRO 551 Ca 0.00 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3ciy n PRO 551 Cb 0.00 -0.08 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 3ciy n PRO 551 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ciy n GLY 552 N 0.61 0.91 0.13 -1.23 0.00 -1.26 -4.90 105.19 99.45 3ciy n GLY 552 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3ciy n GLY 552 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ciy n GLY 553 N -2.17 -1.12 3.69 -0.02 0.00 -1.19 -4.94 105.19 99.44 3ciy n GLY 553 Ca 0.00 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 3ciy n GLY 553 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ciy s PRO 554 N -3.76 4.20 -0.73 1.61 0.04 -1.26 -4.60 135.00 130.49 3ciy s PRO 554 Ca 0.00 2.31 -0.26 0.00 0.04 0.00 0.00 61.00 63.09 3ciy s PRO 554 Cb 0.00 -3.65 -0.13 0.00 0.04 0.00 0.00 34.50 30.76 3ciy s PRO 554 CO 0.00 -0.75 2.42 0.28 0.04 0.00 0.00 177.00 178.99 3ciy n VAL 555 N 4.82 -0.02 -0.78 -0.36 0.31 -1.00 -4.81 118.33 116.50 3ciy n VAL 555 Ca 0.16 -0.56 -0.44 0.00 -0.01 0.00 0.00 64.34 63.49 3ciy n VAL 555 Cb 0.41 -2.13 -0.09 0.00 -0.91 0.00 0.00 33.84 31.11 3ciy n VAL 555 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3ciy n ASN 556 N 17.97 1.66 -4.09 4.52 4.05 -1.26 -4.85 115.26 133.25 3ciy n ASN 556 Ca 0.45 -2.57 -0.29 0.00 0.45 0.00 0.00 54.58 52.62 3ciy n ASN 556 Cb 0.45 -0.76 0.26 0.00 1.23 0.00 0.00 39.78 40.95 3ciy n ASN 556 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 3ciy s PHE 557 N 6.12 0.67 -1.50 1.20 5.36 -1.26 -4.06 117.98 124.51 3ciy s PHE 557 Ca 0.64 0.87 -0.14 0.00 -0.96 0.00 0.00 56.93 57.34 3ciy s PHE 557 Cb 0.15 -3.08 0.10 0.00 -0.34 0.00 0.00 43.02 39.85 3ciy s PHE 557 CO 0.25 -4.20 0.74 1.28 -1.46 0.00 0.00 175.22 171.83 3ciy n LEU 558 N -5.10 -1.92 -4.74 6.12 4.77 -1.26 -4.92 117.00 109.94 3ciy n LEU 558 Ca 0.07 -0.69 -0.41 0.00 -0.03 0.00 0.00 56.01 54.94 3ciy n LEU 558 Cb 0.57 -2.26 -0.04 0.00 -2.33 0.00 0.00 43.42 39.36 3ciy n LEU 558 CO 0.52 0.29 0.85 -0.75 -1.33 0.00 0.00 177.39 176.97 3ciy s LYS 559 N -6.47 4.53 -0.50 3.23 2.20 -1.26 -4.20 119.74 117.27 3ciy s LYS 559 Ca 0.59 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 58.01 3ciy s LYS 559 Cb -0.31 -3.26 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 3ciy s LYS 559 CO 0.72 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 176.09 3ciy n GLY 560 N 2.17 0.23 2.50 5.54 0.00 -1.26 -4.82 105.19 109.55 3ciy n GLY 560 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 3ciy n GLY 560 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ciy n LEU 561 N -1.65 7.51 -0.32 0.99 4.32 -1.26 -4.67 117.00 121.92 3ciy n LEU 561 Ca -0.05 -4.03 0.15 0.00 -0.02 0.00 0.00 56.01 52.06 3ciy n LEU 561 Cb 0.26 -1.50 0.30 0.00 -1.62 0.00 0.00 43.42 40.85 3ciy n LEU 561 CO 0.07 1.49 0.77 -1.54 -1.22 0.00 0.00 177.39 176.97 3ciy n SER 562 N 4.55 -0.08 0.00 -1.43 3.41 -1.26 0.97 113.62 119.78 3ciy n SER 562 Ca 0.66 1.60 0.09 0.00 -0.26 0.00 0.00 58.87 60.95 3ciy n SER 562 Cb 0.27 -0.60 0.51 0.00 -0.26 0.00 0.00 64.21 64.14 3ciy n SER 562 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3ciy n HIS 563 N -5.37 0.00 -2.12 7.33 8.25 -1.26 -3.82 115.22 118.22 3ciy n HIS 563 Ca 0.23 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.27 3ciy n HIS 563 Cb 0.76 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.84 3ciy n HIS 563 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3ciy s LEU 564 N -1.56 4.22 -0.10 2.41 0.20 0.27 -4.23 118.68 119.90 3ciy s LEU 564 Ca 0.26 2.01 -0.09 0.00 0.69 0.00 0.00 54.13 57.00 3ciy s LEU 564 Cb 0.12 -3.53 -0.03 0.00 -0.43 0.00 0.00 46.19 42.32 3ciy s LEU 564 CO 0.20 -0.94 -0.17 1.41 -0.29 0.00 0.00 176.35 176.56 3ciy n HIS 565 N 7.24 0.33 -3.89 5.38 8.25 0.18 -2.53 115.22 130.18 3ciy n HIS 565 Ca 0.17 0.14 -0.35 0.00 -0.26 0.00 0.00 57.72 57.42 3ciy n HIS 565 Cb 0.44 -0.47 -0.14 0.00 1.12 0.00 0.00 29.99 30.94 3ciy n HIS 565 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 3ciy s ILE 566 N -2.00 3.53 -0.11 1.59 2.07 -1.19 0.15 121.20 125.24 3ciy s ILE 566 Ca -0.14 -0.44 -0.01 0.00 -1.41 0.00 0.00 60.65 58.66 3ciy s ILE 566 Cb 0.02 -2.61 -0.03 0.00 0.13 0.00 0.00 42.46 39.97 3ciy s ILE 566 CO 0.20 0.41 -0.07 -0.22 -1.91 0.00 0.00 174.94 173.35 3ciy s LEU 567 N 1.49 3.10 -0.15 8.50 2.96 0.09 -2.45 118.68 132.21 3ciy s LEU 567 Ca 0.06 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 3ciy s LEU 567 Cb -0.14 -1.70 0.03 0.00 0.50 0.00 0.00 46.19 44.87 3ciy s LEU 567 CO -0.02 0.26 -0.12 0.21 -1.32 0.00 0.00 176.35 175.36 3ciy s ASN 568 N -0.22 2.76 -0.08 3.68 3.84 -0.68 -2.17 114.94 122.06 3ciy s ASN 568 Ca 0.03 -0.54 0.19 0.00 0.21 0.00 0.00 52.86 52.74 3ciy s ASN 568 Cb -0.13 -1.14 0.40 0.00 -0.55 0.00 0.00 41.25 39.83 3ciy s ASN 568 CO 0.03 -0.08 1.18 0.18 -2.79 0.00 0.00 177.10 175.61 3ciy n LEU 569 N 4.78 1.63 -4.66 3.21 4.32 -0.27 -0.32 117.00 125.69 3ciy n LEU 569 Ca -0.16 -2.70 -0.41 0.00 -0.02 0.00 0.00 56.01 52.73 3ciy n LEU 569 Cb 0.49 -0.21 0.02 0.00 -1.62 0.00 0.00 43.42 42.10 3ciy n LEU 569 CO 0.20 0.83 0.75 1.21 -1.22 0.00 0.00 177.39 179.17 3ciy n GLU 570 N -0.19 1.63 -3.50 3.23 2.13 -0.98 -3.49 120.64 119.47 3ciy n GLU 570 Ca 0.11 0.58 -0.27 0.00 0.66 0.00 0.00 57.16 58.25 3ciy n GLU 570 Cb 0.94 -2.25 0.01 0.00 0.27 0.00 0.00 31.44 30.42 3ciy n GLU 570 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3ciy n SER 571 N 0.20 -4.41 -0.13 4.31 2.88 0.01 -2.02 113.62 114.46 3ciy n SER 571 Ca 0.08 -0.62 0.03 0.00 -1.33 0.00 0.00 58.87 57.04 3ciy n SER 571 Cb 0.40 -1.40 0.04 0.00 -0.75 0.00 0.00 64.21 62.50 3ciy n SER 571 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3ciy n ASN 572 N -1.48 1.26 0.00 -3.46 4.05 -1.23 -0.86 115.26 113.54 3ciy n ASN 572 Ca -0.22 -2.11 0.00 0.00 0.45 0.00 0.00 54.58 52.70 3ciy n ASN 572 Cb 0.61 -0.17 0.00 0.00 1.23 0.00 0.00 39.78 41.45 3ciy n ASN 572 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3ciy n GLY 573 N -0.56 1.86 3.68 8.20 0.00 -1.26 -2.07 105.19 115.03 3ciy n GLY 573 Ca 0.05 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.57 3ciy n GLY 573 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ciy n LEU 574 N 0.00 3.05 0.00 0.99 4.32 -1.26 -4.57 117.00 119.52 3ciy n LEU 574 Ca 0.00 1.03 0.00 0.00 -0.02 0.00 0.00 56.01 57.02 3ciy n LEU 574 Cb 0.00 -1.33 0.00 0.00 -1.62 0.00 0.00 43.42 40.47 3ciy n LEU 574 CO 0.00 -0.25 -0.27 -0.90 -1.22 0.00 0.00 177.39 174.75 3ciy n ASP 575 N 5.36 2.69 -3.48 -1.43 3.85 -1.22 -0.59 116.55 121.72 3ciy n ASP 575 Ca 0.22 -0.15 -0.11 0.00 -0.71 0.00 0.00 54.79 54.04 3ciy n ASP 575 Cb 0.26 0.83 -0.10 0.00 -1.35 0.00 0.00 41.12 40.76 3ciy n ASP 575 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 3ciy s GLU 576 N -1.37 0.29 -0.42 0.11 2.12 -1.26 -4.34 118.70 113.84 3ciy s GLU 576 Ca 0.00 0.64 -0.24 0.00 0.36 0.00 0.00 54.97 55.73 3ciy s GLU 576 Cb 0.00 -0.31 0.02 0.00 0.26 0.00 0.00 34.13 34.10 3ciy s GLU 576 CO 0.00 -0.50 0.85 0.96 -0.54 0.00 0.00 175.26 176.03 3ciy s ILE 577 N 2.52 4.60 0.82 -3.70 -5.25 -1.26 -4.85 121.20 114.07 3ciy s ILE 577 Ca 0.07 0.77 -0.10 0.00 -0.99 0.00 0.00 60.65 60.39 3ciy s ILE 577 Cb -0.14 -4.33 0.08 0.00 2.95 0.00 0.00 42.46 41.02 3ciy s ILE 577 CO -0.14 -0.66 1.10 -2.16 -1.79 0.00 0.00 174.94 171.30 3ciy s PRO 578 N 3.42 1.89 -0.25 0.37 0.04 -1.26 -4.59 135.00 134.61 3ciy s PRO 578 Ca 0.34 1.22 -0.37 0.00 0.04 0.00 0.00 61.00 62.22 3ciy s PRO 578 Cb -0.12 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.44 3ciy s PRO 578 CO 0.22 -1.92 1.92 1.33 0.04 0.00 0.00 177.00 178.59 3ciy n VAL 579 N -3.71 0.34 -3.69 -0.36 0.24 -1.26 -3.34 118.33 106.56 3ciy n VAL 579 Ca 0.09 -0.13 -0.28 0.00 -2.04 0.00 0.00 64.34 61.99 3ciy n VAL 579 Cb 0.53 -1.52 0.03 0.00 -1.47 0.00 0.00 33.84 31.41 3ciy n VAL 579 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ciy n GLY 580 N 5.01 -0.50 0.32 7.63 0.00 -1.26 -4.87 105.19 111.51 3ciy n GLY 580 Ca 0.30 0.18 0.04 0.00 0.00 0.00 0.00 46.02 46.53 3ciy n GLY 580 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ciy n VAL 581 N -4.58 0.22 -1.37 1.61 0.24 -1.21 -2.86 118.33 110.37 3ciy n VAL 581 Ca 0.01 -0.23 0.08 0.00 -2.04 0.00 0.00 64.34 62.16 3ciy n VAL 581 Cb 0.54 0.11 0.14 0.00 -1.47 0.00 0.00 33.84 33.16 3ciy n VAL 581 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3ciy n PHE 582 N -0.01 0.00 -2.57 6.34 3.72 -1.26 -4.89 117.46 118.79 3ciy n PHE 582 Ca 0.07 -0.99 -0.37 0.00 -0.05 0.00 0.00 57.45 56.11 3ciy n PHE 582 Cb 0.15 -0.16 -0.04 0.00 -0.94 0.00 0.00 39.48 38.48 3ciy n PHE 582 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3ciy s LYS 583 N -2.51 4.33 0.00 -1.08 2.20 -1.14 -3.54 119.74 118.00 3ciy s LYS 583 Ca 0.30 1.54 0.00 0.00 -0.36 0.00 0.00 55.97 57.45 3ciy s LYS 583 Cb 0.28 -2.71 0.00 0.00 -1.51 0.00 0.00 37.83 33.88 3ciy s LYS 583 CO -0.01 -0.00 0.00 0.09 -0.36 0.00 0.00 175.35 175.07 3ciy n ASN 584 N 0.29 -1.33 -4.44 1.43 3.02 -1.26 -4.77 115.26 108.20 3ciy n ASN 584 Ca 0.03 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.14 3ciy n ASN 584 Cb 0.49 -1.24 -0.00 0.00 -0.61 0.00 0.00 39.78 38.41 3ciy n ASN 584 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ciy s LEU 585 N 0.00 5.34 -0.10 3.41 1.43 -1.23 -4.59 118.68 122.94 3ciy s LEU 585 Ca 0.00 -2.94 -0.19 0.00 -1.03 0.00 0.00 54.13 49.96 3ciy s LEU 585 Cb 0.00 -2.36 -0.27 0.00 0.03 0.00 0.00 46.19 43.59 3ciy s LEU 585 CO 0.00 -0.71 0.63 -0.26 0.23 0.00 0.00 176.35 176.24 3ciy h PHE 586 N 7.35 0.37 0.00 0.29 0.04 -1.78 -3.32 116.94 119.89 3ciy h PHE 586 Ca 0.26 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3ciy h PHE 586 Cb 0.90 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.04 3ciy h PHE 586 CO 1.05 1.43 0.00 0.39 -0.60 0.00 0.00 178.31 180.58 3ciy n GLU 587 N -4.10 0.71 -1.90 1.51 1.02 -1.25 -4.37 120.64 112.27 3ciy n GLU 587 Ca -0.21 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.50 3ciy n GLU 587 Cb 0.81 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.73 3ciy n GLU 587 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3ciy s LEU 588 N -1.95 4.17 -0.17 -4.62 0.20 -1.05 -4.33 118.68 110.94 3ciy s LEU 588 Ca 0.32 2.19 -0.09 0.00 0.69 0.00 0.00 54.13 57.24 3ciy s LEU 588 Cb 0.15 -3.53 -0.22 0.00 -0.43 0.00 0.00 46.19 42.15 3ciy s LEU 588 CO 0.25 -1.14 0.20 1.17 -0.29 0.00 0.00 176.35 176.55 3ciy n LYS 589 N 7.52 0.69 -3.68 1.98 3.00 0.39 -3.64 118.16 124.43 3ciy n LYS 589 Ca 0.20 0.32 -0.22 0.00 -0.00 0.00 0.00 58.31 58.60 3ciy n LYS 589 Cb 0.43 -1.68 -0.18 0.00 0.00 0.00 0.00 35.03 33.61 3ciy n LYS 589 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3ciy s SER 590 N -6.96 1.63 -0.10 3.14 0.15 -0.58 0.72 113.70 111.70 3ciy s SER 590 Ca -0.27 -0.17 -0.05 0.00 0.70 0.00 0.00 55.95 56.16 3ciy s SER 590 Cb 0.07 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.09 3ciy s SER 590 CO 0.69 -0.27 0.08 -0.63 1.20 0.00 0.00 173.24 174.31 3ciy s ILE 591 N 2.10 4.97 -0.23 6.45 1.01 -1.14 -0.73 121.20 133.64 3ciy s ILE 591 Ca 0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.65 3ciy s ILE 591 Cb -0.13 -3.14 0.07 0.00 0.01 0.00 0.00 42.46 39.27 3ciy s ILE 591 CO -0.05 0.60 0.06 0.21 0.00 0.00 0.00 174.94 175.76 3ciy s ASN 592 N -1.00 3.17 -0.23 3.58 2.47 -0.92 -2.47 114.94 119.54 3ciy s ASN 592 Ca 0.15 -1.02 0.11 0.00 0.42 0.00 0.00 52.86 52.51 3ciy s ASN 592 Cb -0.12 -0.60 0.44 0.00 -1.45 0.00 0.00 41.25 39.53 3ciy s ASN 592 CO 0.04 -0.35 1.31 0.18 -3.72 0.00 0.00 177.10 174.56 3ciy n LEU 593 N 5.05 3.23 -4.20 3.21 4.77 0.18 -1.11 117.00 128.12 3ciy n LEU 593 Ca -0.07 -3.75 -0.27 0.00 -0.03 0.00 0.00 56.01 51.90 3ciy n LEU 593 Cb 0.46 -0.56 0.24 0.00 -2.33 0.00 0.00 43.42 41.23 3ciy n LEU 593 CO 0.11 1.26 0.20 0.61 -1.33 0.00 0.00 177.39 178.25 3ciy n GLY 594 N -1.13 -3.13 4.40 -0.72 0.00 -1.12 -3.82 105.19 99.67 3ciy n GLY 594 Ca 0.24 -1.30 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 3ciy n GLY 594 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ciy n LEU 595 N -4.01 -1.03 -4.72 0.99 4.77 -0.68 -0.81 117.00 111.51 3ciy n LEU 595 Ca 0.09 -1.13 -0.32 0.00 -0.03 0.00 0.00 56.01 54.61 3ciy n LEU 595 Cb 0.52 -1.71 -0.07 0.00 -2.33 0.00 0.00 43.42 39.83 3ciy n LEU 595 CO 0.39 0.14 -0.24 0.20 -1.33 0.00 0.00 177.39 176.55 3ciy s ASN 596 N -3.21 3.90 -0.85 -1.43 0.01 -1.25 -3.56 114.94 108.54 3ciy s ASN 596 Ca 0.79 -1.69 0.00 0.00 -0.71 0.00 0.00 52.86 51.25 3ciy s ASN 596 Cb -0.45 0.60 0.21 0.00 0.41 0.00 0.00 41.25 42.02 3ciy s ASN 596 CO 0.97 -0.91 0.74 0.59 -1.51 0.00 0.00 177.10 176.99 3ciy n ASN 597 N -1.31 4.00 -3.90 -1.22 4.13 0.24 -3.78 115.26 113.40 3ciy n ASN 597 Ca -0.18 -3.18 -0.31 0.00 1.68 0.00 0.00 54.58 52.60 3ciy n ASN 597 Cb 0.67 -0.98 -0.15 0.00 -1.54 0.00 0.00 39.78 37.78 3ciy n ASN 597 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ciy s LEU 598 N -1.51 3.75 -0.03 3.41 1.43 -1.26 -3.46 118.68 121.01 3ciy s LEU 598 Ca 0.28 -1.96 0.03 0.00 -1.03 0.00 0.00 54.13 51.44 3ciy s LEU 598 Cb -0.05 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 3ciy s LEU 598 CO -0.13 -0.39 0.01 -0.46 0.23 0.00 0.00 176.35 175.61 3ciy n ASN 599 N 4.47 4.12 -4.56 2.29 0.23 -1.25 -3.46 115.26 117.11 3ciy n ASN 599 Ca 0.02 -0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.65 3ciy n ASN 599 Cb 0.42 0.54 -0.03 0.00 -2.08 0.00 0.00 39.78 38.63 3ciy n ASN 599 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3ciy s LYS 600 N -2.08 3.53 -0.44 -3.83 1.02 -1.26 -4.66 119.74 112.02 3ciy s LYS 600 Ca -0.02 -1.01 -0.12 0.00 0.02 0.00 0.00 55.97 54.84 3ciy s LYS 600 Cb 0.01 -5.17 0.07 0.00 -0.52 0.00 0.00 37.83 32.22 3ciy s LYS 600 CO 0.14 -2.19 0.32 -0.51 -0.92 0.00 0.00 175.35 172.19 3ciy s LEU 601 N 5.03 5.35 0.11 3.17 2.01 -1.26 -4.43 118.68 128.66 3ciy s LEU 601 Ca 0.44 -1.41 -0.31 0.00 0.01 0.00 0.00 54.13 52.86 3ciy s LEU 601 Cb -0.01 -2.08 -0.08 0.00 0.01 0.00 0.00 46.19 44.03 3ciy s LEU 601 CO -0.06 -0.58 1.49 -1.61 1.01 0.00 0.00 176.35 176.60 3ciy s GLU 602 N 1.53 4.26 -0.08 1.70 0.41 -1.26 -4.90 118.70 120.35 3ciy s GLU 602 Ca 0.03 2.20 -0.40 0.00 -0.41 0.00 0.00 54.97 56.39 3ciy s GLU 602 Cb -0.23 -3.31 -0.19 0.00 -1.78 0.00 0.00 34.13 28.62 3ciy s GLU 602 CO 0.04 -0.56 1.27 -2.30 -0.49 0.00 0.00 175.26 173.23 3ciy n PRO 603 N 4.38 0.36 -0.47 0.39 -0.02 -1.26 -2.85 135.00 135.53 3ciy n PRO 603 Ca 0.13 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3ciy n PRO 603 Cb 0.41 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3ciy n PRO 603 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ciy n PHE 604 N 2.45 0.00 -0.15 6.00 0.99 -0.96 -4.94 117.46 120.85 3ciy n PHE 604 Ca 0.22 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.64 3ciy n PHE 604 Cb 0.09 -0.15 0.18 0.00 -1.00 0.00 0.00 39.48 38.59 3ciy n PHE 604 CO 0.00 0.00 0.00 -0.84 -0.00 0.00 0.00 176.76 175.92 3ciy h ILE 605 N 0.00 1.23 -3.60 4.37 -2.65 -1.80 -3.38 117.51 111.67 3ciy h ILE 605 Ca 0.00 -0.80 -0.68 0.00 1.03 0.00 0.00 64.86 64.41 3ciy h ILE 605 Cb 0.00 0.61 -0.26 0.00 -2.05 0.00 0.00 36.82 35.11 3ciy h ILE 605 CO 0.00 0.30 -0.62 -0.36 0.03 0.00 0.00 178.15 177.50 3ciy s PHE 606 N -5.28 3.15 0.00 0.16 0.08 -1.26 -4.42 117.98 110.42 3ciy s PHE 606 Ca -0.10 -1.03 0.00 0.00 0.12 0.00 0.00 56.93 55.92 3ciy s PHE 606 Cb 0.16 -2.25 0.00 0.00 -0.57 0.00 0.00 43.02 40.36 3ciy s PHE 606 CO 0.80 -0.59 0.00 -0.25 -0.10 0.00 0.00 175.22 175.08 3ciy n ASP 607 N 4.86 0.63 -0.09 1.36 10.43 -1.26 -4.63 116.55 127.84 3ciy n ASP 607 Ca -0.14 0.00 0.13 0.00 2.57 0.00 0.00 54.79 57.35 3ciy n ASP 607 Cb 0.48 0.00 0.47 0.00 1.84 0.00 0.00 41.12 43.90 3ciy n ASP 607 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 3ciy n ASP 608 N -2.38 0.50 -3.89 -2.24 9.92 -1.26 -4.26 116.55 112.94 3ciy n ASP 608 Ca 0.00 -0.36 -0.43 0.00 -0.53 0.00 0.00 54.79 53.47 3ciy n ASP 608 Cb 0.20 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.67 3ciy n ASP 608 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ciy n GLN 609 N -1.14 3.51 -0.22 -1.24 3.00 -1.26 -4.25 117.38 115.78 3ciy n GLN 609 Ca 0.10 -3.43 0.10 0.00 -0.01 0.00 0.00 57.00 53.77 3ciy n GLN 609 Cb 0.32 -2.98 0.22 0.00 0.00 0.00 0.00 30.24 27.79 3ciy n GLN 609 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 3ciy n THR 610 N 3.66 0.68 -0.03 5.09 -2.24 -1.26 -3.71 114.28 116.45 3ciy n THR 610 Ca 0.41 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3ciy n THR 610 Cb 0.37 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 3ciy n THR 610 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3ciy n SER 611 N 1.29 0.49 -4.53 3.42 2.88 -1.26 -4.66 113.62 111.25 3ciy n SER 611 Ca 0.18 -0.75 -0.46 0.00 -1.33 0.00 0.00 58.87 56.51 3ciy n SER 611 Cb 0.55 0.44 -0.02 0.00 -0.75 0.00 0.00 64.21 64.43 3ciy n SER 611 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3ciy n LEU 612 N -0.44 0.88 -0.01 2.46 7.94 -1.24 -4.74 117.00 121.86 3ciy n LEU 612 Ca 0.00 1.16 0.02 0.00 -1.11 0.00 0.00 56.01 56.08 3ciy n LEU 612 Cb 0.01 -1.18 -0.05 0.00 0.53 0.00 0.00 43.42 42.73 3ciy n LEU 612 CO 0.00 -1.84 -0.59 -1.14 -1.11 0.00 0.00 177.39 172.71 3ciy n ARG 613 N 0.92 0.62 -3.63 1.96 0.63 0.22 -3.91 116.66 113.46 3ciy n ARG 613 Ca 0.13 -0.05 -0.02 0.00 -0.92 0.00 0.00 57.85 56.99 3ciy n ARG 613 Cb 0.29 -1.14 -0.05 0.00 0.45 0.00 0.00 32.46 32.01 3ciy n ARG 613 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3ciy s SER 614 N -2.84 -1.07 0.01 6.15 1.04 -1.19 -0.03 113.70 115.79 3ciy s SER 614 Ca -0.02 1.50 0.03 0.00 0.48 0.00 0.00 55.95 57.94 3ciy s SER 614 Cb 0.04 2.10 -0.04 0.00 0.10 0.00 0.00 66.02 68.22 3ciy s SER 614 CO 0.25 -0.21 -0.03 -0.22 0.98 0.00 0.00 173.24 174.00 3ciy s LEU 615 N 2.64 3.36 -0.13 2.42 2.96 -1.09 -2.87 118.68 125.98 3ciy s LEU 615 Ca -0.06 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 53.73 3ciy s LEU 615 Cb -0.10 -1.95 0.04 0.00 0.50 0.00 0.00 46.19 44.68 3ciy s LEU 615 CO -0.19 0.27 0.03 0.21 -1.32 0.00 0.00 176.35 175.35 3ciy s ASN 616 N -1.61 2.13 -0.11 3.68 3.84 -1.03 -1.38 114.94 120.46 3ciy s ASN 616 Ca 0.19 -0.41 0.21 0.00 0.21 0.00 0.00 52.86 53.06 3ciy s ASN 616 Cb -0.11 -0.45 0.44 0.00 -0.55 0.00 0.00 41.25 40.58 3ciy s ASN 616 CO 0.10 -0.26 1.18 0.18 -2.79 0.00 0.00 177.10 175.51 3ciy n LEU 617 N 5.14 1.76 -4.65 3.21 4.77 0.27 0.47 117.00 127.97 3ciy n LEU 617 Ca -0.07 -2.80 -0.30 0.00 -0.03 0.00 0.00 56.01 52.81 3ciy n LEU 617 Cb 0.49 -0.09 0.17 0.00 -2.33 0.00 0.00 43.42 41.66 3ciy n LEU 617 CO 0.11 0.90 0.64 0.00 -1.33 0.00 0.00 177.39 177.71 3ciy s GLN 618 N -1.57 0.68 -0.50 3.23 -2.07 -1.12 -3.73 119.66 114.58 3ciy s GLN 618 Ca 0.35 1.12 0.00 0.00 -1.82 0.00 0.00 55.36 55.02 3ciy s GLN 618 Cb 0.38 -1.72 0.00 0.00 -1.09 0.00 0.00 33.01 30.58 3ciy s GLN 618 CO -0.11 -2.72 0.00 1.63 -1.32 0.00 0.00 175.29 172.76 3ciy n LYS 619 N -4.25 -2.33 0.00 9.60 5.02 -0.82 -1.68 118.16 123.69 3ciy n LYS 619 Ca 0.08 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 3ciy n LYS 619 Cb 0.54 -4.73 0.00 0.00 -0.02 0.00 0.00 35.03 30.81 3ciy n LYS 619 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3ciy n ASN 620 N -1.21 0.00 -2.31 4.39 4.13 -1.24 -4.08 115.26 114.93 3ciy n ASN 620 Ca -0.06 0.00 -0.19 0.00 1.68 0.00 0.00 54.58 56.00 3ciy n ASN 620 Cb 0.47 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.73 3ciy n ASN 620 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3ciy n LEU 621 N 0.00 4.03 -4.65 3.41 4.32 -1.25 -4.56 117.00 118.30 3ciy n LEU 621 Ca 0.00 -4.46 -0.43 0.00 -0.02 0.00 0.00 56.01 51.10 3ciy n LEU 621 Cb 0.00 -0.16 -0.02 0.00 -1.62 0.00 0.00 43.42 41.62 3ciy n LEU 621 CO 0.00 1.90 1.00 -0.63 -1.22 0.00 0.00 177.39 178.44 3ciy s ILE 622 N -4.55 4.47 -0.08 -0.08 1.01 -1.22 -3.82 121.20 116.92 3ciy s ILE 622 Ca 0.44 1.76 -0.02 0.00 0.00 0.00 0.00 60.65 62.84 3ciy s ILE 622 Cb 0.40 -4.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.65 3ciy s ILE 622 CO -0.02 -0.23 -0.03 0.74 0.00 0.00 0.00 174.94 175.39 3ciy h THR 623 N 5.55 0.00 -3.25 2.92 2.02 -1.83 -3.22 112.91 115.11 3ciy h THR 623 Ca -0.22 -0.77 -0.65 0.00 0.77 0.00 0.00 66.41 65.54 3ciy h THR 623 Cb 1.08 0.00 -0.19 0.00 -1.74 0.00 0.00 68.15 67.30 3ciy h THR 623 CO 0.99 0.00 -0.82 -0.94 0.37 0.00 0.00 175.52 175.12 3ciy s SER 624 N -5.03 3.37 -0.46 4.18 1.04 -1.26 -2.35 113.70 113.19 3ciy s SER 624 Ca -0.03 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 55.55 3ciy s SER 624 Cb 0.00 -0.24 0.12 0.00 0.10 0.00 0.00 66.02 66.00 3ciy s SER 624 CO 0.04 0.11 0.22 -0.69 0.98 0.00 0.00 173.24 173.91 3ciy s VAL 625 N -1.65 2.87 0.52 5.02 1.01 -1.21 -5.01 120.40 121.95 3ciy s VAL 625 Ca 0.20 -2.69 -0.03 0.00 0.00 0.00 0.00 61.98 59.45 3ciy s VAL 625 Cb -0.08 -2.99 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 3ciy s VAL 625 CO 0.09 -0.73 0.79 -1.61 0.00 0.00 0.00 175.10 173.64 3ciy s GLU 626 N 0.41 3.06 0.02 2.72 0.41 -1.26 -4.06 118.70 120.00 3ciy s GLU 626 Ca 0.13 -0.18 -0.05 0.00 -0.41 0.00 0.00 54.97 54.46 3ciy s GLU 626 Cb -0.22 -2.41 -0.29 0.00 -1.78 0.00 0.00 34.13 29.44 3ciy s GLU 626 CO -0.04 -0.46 0.94 -0.22 -0.49 0.00 0.00 175.26 175.00 3ciy h LYS 627 N 0.12 0.29 -0.06 1.61 3.64 -1.95 -2.27 116.57 117.95 3ciy h LYS 627 Ca -0.46 -0.50 0.02 0.00 -1.27 0.00 0.00 60.65 58.44 3ciy h LYS 627 Cb 1.25 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 33.25 3ciy h LYS 627 CO 0.59 1.19 0.09 0.38 -2.27 0.00 0.00 179.45 179.43 3ciy h ASP 628 N 0.08 0.00 0.00 4.20 3.04 -1.99 0.19 116.42 121.94 3ciy h ASP 628 Ca -0.22 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.57 3ciy h ASP 628 Cb 2.02 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.31 3ciy h ASP 628 CO 0.19 0.00 -0.31 0.52 -2.04 0.00 0.00 179.24 177.60 3ciy n VAL 629 N -3.63 0.62 1.51 4.15 0.31 -1.24 -2.27 118.33 117.79 3ciy n VAL 629 Ca -0.01 0.36 0.14 0.00 -0.01 0.00 0.00 64.34 64.82 3ciy n VAL 629 Cb 0.18 -1.88 0.62 0.00 -0.91 0.00 0.00 33.84 31.85 3ciy n VAL 629 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3ciy n PHE 630 N -3.30 0.00 0.00 3.52 3.01 -0.86 -4.35 117.46 115.48 3ciy n PHE 630 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 3ciy n PHE 630 Cb 0.16 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 3ciy n PHE 630 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ciy n GLY 631 N 1.21 -3.14 0.29 1.37 0.00 0.65 -2.09 105.19 103.49 3ciy n GLY 631 Ca 0.17 0.22 0.24 0.00 0.00 0.00 0.00 46.02 46.66 3ciy n GLY 631 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ciy n PRO 632 N -0.73 -0.06 0.09 1.61 -0.02 -1.26 -0.26 135.00 134.37 3ciy n PRO 632 Ca 0.00 1.26 -0.08 0.00 -2.02 0.00 0.00 63.50 62.66 3ciy n PRO 632 Cb 0.00 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 3ciy n PRO 632 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3ciy h PRO 633 N 0.00 0.17 0.00 0.52 0.13 -1.64 -3.13 132.00 128.05 3ciy h PRO 633 Ca 0.70 -0.19 -0.01 0.00 -0.87 0.00 0.00 66.00 65.64 3ciy h PRO 633 Cb 1.77 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.95 3ciy h PRO 633 CO -0.73 0.93 -0.04 0.74 -0.23 0.00 0.00 178.00 178.66 3ciy h PHE 634 N 0.10 0.00 0.00 1.56 -1.00 -0.06 -3.30 116.94 114.24 3ciy h PHE 634 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 3ciy h PHE 634 Cb 1.48 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.04 3ciy h PHE 634 CO 0.03 0.04 0.00 1.04 -1.61 0.00 0.00 178.31 177.81 3ciy n GLN 635 N -3.30 0.00 -0.74 1.51 1.13 -1.07 -3.26 117.38 111.65 3ciy n GLN 635 Ca -0.02 0.86 0.00 0.00 -1.94 0.00 0.00 57.00 55.91 3ciy n GLN 635 Cb 0.19 -1.39 0.26 0.00 0.11 0.00 0.00 30.24 29.40 3ciy n GLN 635 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3ciy n ASN 636 N -2.52 3.80 -4.67 1.08 3.02 -1.26 -5.06 115.26 109.66 3ciy n ASN 636 Ca 0.00 -3.30 -0.38 0.00 -0.03 0.00 0.00 54.58 50.87 3ciy n ASN 636 Cb 0.00 -0.64 0.05 0.00 -0.61 0.00 0.00 39.78 38.58 3ciy n ASN 636 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3ciy n LEU 637 N -0.59 4.42 -0.13 3.41 7.94 -1.20 -4.81 117.00 126.04 3ciy n LEU 637 Ca 0.31 0.89 -0.23 0.00 -1.11 0.00 0.00 56.01 55.87 3ciy n LEU 637 Cb 1.10 -1.46 -0.11 0.00 0.53 0.00 0.00 43.42 43.48 3ciy n LEU 637 CO 0.26 -1.31 -1.37 -3.20 -1.11 0.00 0.00 177.39 170.66 3ciy n ASN 638 N -0.82 1.97 -3.66 1.96 4.05 0.96 -4.70 115.26 115.02 3ciy n ASN 638 Ca 0.12 0.10 -0.07 0.00 0.45 0.00 0.00 54.58 55.18 3ciy n ASN 638 Cb 0.46 -0.59 -0.09 0.00 1.23 0.00 0.00 39.78 40.79 3ciy n ASN 638 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 3ciy s SER 639 N -6.92 -0.53 0.23 1.20 1.04 -0.92 -0.86 113.70 106.93 3ciy s SER 639 Ca -0.36 1.13 0.06 0.00 0.48 0.00 0.00 55.95 57.26 3ciy s SER 639 Cb 0.12 1.42 -0.03 0.00 0.10 0.00 0.00 66.02 67.62 3ciy s SER 639 CO 0.52 -0.22 0.27 -0.22 0.98 0.00 0.00 173.24 174.57 3ciy s LEU 640 N 2.35 4.07 -0.28 2.42 2.96 -1.00 -2.66 118.68 126.54 3ciy s LEU 640 Ca -0.05 -0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3ciy s LEU 640 Cb -0.11 -2.62 0.16 0.00 0.50 0.00 0.00 46.19 44.13 3ciy s LEU 640 CO -0.15 -0.03 0.45 -0.62 -1.32 0.00 0.00 176.35 174.69 3ciy s ASP 641 N -3.76 -0.18 -0.26 3.68 3.68 -0.48 -4.30 116.67 115.05 3ciy s ASP 641 Ca 0.33 -0.01 0.19 0.00 2.13 0.00 0.00 52.55 55.19 3ciy s ASP 641 Cb -0.09 1.38 0.49 0.00 -1.45 0.00 0.00 42.92 43.26 3ciy s ASP 641 CO 0.27 -0.32 1.13 0.23 0.13 0.00 0.00 175.17 176.61 3ciy n MET 642 N 5.38 2.16 -2.27 4.34 2.81 -1.26 -0.57 117.12 127.70 3ciy n MET 642 Ca 0.00 -3.63 -0.33 0.00 -1.81 0.00 0.00 57.70 51.93 3ciy n MET 642 Cb 0.50 -1.73 -0.01 0.00 -0.71 0.00 0.00 33.22 31.27 3ciy n MET 642 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 3ciy s ARG 643 N -3.64 3.59 0.00 0.03 1.70 -1.26 -4.01 118.95 115.36 3ciy s ARG 643 Ca 0.33 1.20 0.00 0.00 -0.47 0.00 0.00 55.73 56.80 3ciy s ARG 643 Cb 0.35 -2.07 0.00 0.00 -0.57 0.00 0.00 34.95 32.65 3ciy s ARG 643 CO -0.02 -0.59 0.00 1.19 -1.08 0.00 0.00 175.30 174.80 3ciy n PHE 644 N -1.61 0.00 -2.81 5.89 3.72 -0.23 -1.95 117.46 120.48 3ciy n PHE 644 Ca 0.08 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.19 3ciy n PHE 644 Cb 0.53 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.05 3ciy n PHE 644 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3ciy s ASN 645 N -2.22 6.46 -1.03 4.37 -0.87 -1.26 -4.63 114.94 115.76 3ciy s ASN 645 Ca 0.00 1.08 -0.13 0.00 -1.57 0.00 0.00 52.86 52.24 3ciy s ASN 645 Cb 0.00 -2.30 -0.08 0.00 -0.02 0.00 0.00 41.25 38.85 3ciy s ASN 645 CO 0.00 -0.44 2.16 -2.65 -2.57 0.00 0.00 177.10 173.60 3ciy n PRO 646 N -1.52 2.18 -1.75 -0.60 -0.02 -1.21 -4.76 135.00 127.32 3ciy n PRO 646 Ca 0.02 -1.85 -0.42 0.00 -2.02 0.00 0.00 63.50 59.23 3ciy n PRO 646 Cb 0.54 -2.78 -0.02 0.00 -0.02 0.00 0.00 33.50 31.23 3ciy n PRO 646 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ciy n PHE 647 N 5.58 2.87 -3.49 6.00 3.72 -1.25 -4.23 117.46 126.66 3ciy n PHE 647 Ca 0.51 0.23 -0.42 0.00 -0.05 0.00 0.00 57.45 57.72 3ciy n PHE 647 Cb 0.28 -2.61 -0.10 0.00 -0.94 0.00 0.00 39.48 36.11 3ciy n PHE 647 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3ciy s ASP 648 N 0.56 6.08 -1.53 4.37 3.68 -0.99 0.20 116.67 129.03 3ciy s ASP 648 Ca 0.65 -0.74 -0.11 0.00 2.13 0.00 0.00 52.55 54.48 3ciy s ASP 648 Cb -0.49 -2.15 -0.02 0.00 -1.45 0.00 0.00 42.92 38.81 3ciy s ASP 648 CO 0.47 -0.37 2.62 0.00 0.13 0.00 0.00 175.17 178.02 3ciy s THR 650 N 2.22 0.44 -0.64 0.00 -4.23 -1.26 -4.66 115.64 107.50 3ciy s THR 650 Ca 0.59 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.35 3ciy s THR 650 Cb 0.16 -2.43 0.06 0.00 1.34 0.00 0.00 72.50 71.63 3ciy s THR 650 CO -0.07 0.00 1.33 0.00 -0.54 0.00 0.00 174.62 175.34 3ciy h GLU 652 N 0.00 0.00 0.00 0.00 4.81 -1.98 -3.36 114.58 114.05 3ciy h GLU 652 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3ciy h GLU 652 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 3ciy h GLU 652 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 179.01 177.15 3ciy n SER 653 N -2.68 0.00 0.00 1.04 3.41 -1.20 -4.87 113.62 109.32 3ciy n SER 653 Ca 0.02 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.75 3ciy n SER 653 Cb 0.33 -0.01 0.54 0.00 -0.26 0.00 0.00 64.21 64.81 3ciy n SER 653 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3ciy n ILE 654 N -1.23 0.29 -0.07 -1.33 -5.35 -1.08 -3.30 119.36 107.29 3ciy n ILE 654 Ca 0.00 0.07 -0.05 0.00 -0.27 0.00 0.00 62.75 62.50 3ciy n ILE 654 Cb 0.00 -0.65 -0.04 0.00 -1.74 0.00 0.00 39.64 37.21 3ciy n ILE 654 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 3ciy h SER 655 N 0.00 -0.76 -0.69 7.28 0.02 -1.71 1.32 113.55 119.01 3ciy h SER 655 Ca 0.00 0.10 0.06 0.00 -0.84 0.00 0.00 61.79 61.11 3ciy h SER 655 Cb 0.40 0.31 -0.04 0.00 0.14 0.00 0.00 62.40 63.21 3ciy h SER 655 CO 0.00 -0.15 0.45 -0.25 -1.14 0.00 0.00 176.83 175.74 3ciy h TRP 656 N -0.14 0.72 0.41 3.45 7.01 -1.82 -3.03 115.95 122.56 3ciy h TRP 656 Ca 0.03 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 3ciy h TRP 656 Cb 0.23 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 3ciy h TRP 656 CO -0.68 0.39 -0.20 0.35 -2.79 0.00 0.00 178.44 175.50 3ciy h PHE 657 N 0.72 -0.52 -1.05 2.65 3.57 -1.33 -2.71 116.94 118.27 3ciy h PHE 657 Ca 0.29 -0.01 0.31 0.00 3.53 0.00 0.00 57.97 62.09 3ciy h PHE 657 Cb 0.24 0.17 -0.13 0.00 2.79 0.00 0.00 35.95 39.02 3ciy h PHE 657 CO -0.00 -0.22 0.63 0.28 -2.23 0.00 0.00 178.31 176.77 3ciy h VAL 658 N -1.05 0.37 0.29 1.41 2.07 0.17 0.40 116.25 119.92 3ciy h VAL 658 Ca -0.06 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3ciy h VAL 658 Cb 0.53 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 3ciy h VAL 658 CO 0.09 0.07 -0.14 0.78 0.02 0.00 0.00 177.57 178.39 3ciy h ASN 659 N 0.37 -0.33 -0.88 0.57 2.35 -1.56 -1.79 115.58 114.30 3ciy h ASN 659 Ca 0.70 -0.16 0.23 0.00 -0.55 0.00 0.00 56.30 56.53 3ciy h ASN 659 Cb 1.66 0.09 -0.14 0.00 0.05 0.00 0.00 38.32 39.97 3ciy h ASN 659 CO -0.50 -0.01 0.29 -0.25 -1.65 0.00 0.00 177.43 175.31 3ciy h TRP 660 N -0.67 0.44 -0.01 1.19 7.01 -0.63 0.35 115.95 123.64 3ciy h TRP 660 Ca -0.04 0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.02 3ciy h TRP 660 Cb 0.47 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.46 3ciy h TRP 660 CO 0.01 -0.17 -0.05 0.82 -2.79 0.00 0.00 178.44 176.26 3ciy h ILE 661 N 0.26 0.87 -1.01 2.65 2.04 -1.02 0.23 117.51 121.53 3ciy h ILE 661 Ca 0.56 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.44 3ciy h ILE 661 Cb 1.12 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.02 3ciy h ILE 661 CO -0.62 0.00 0.67 -1.13 0.00 0.00 0.00 178.15 177.07 3ciy h ASN 662 N -0.08 1.14 -0.35 1.72 -0.73 0.40 -3.24 115.58 114.43 3ciy h ASN 662 Ca 0.02 -0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.12 3ciy h ASN 662 Cb 0.11 -0.28 -0.03 0.00 0.27 0.00 0.00 38.32 38.39 3ciy h ASN 662 CO -0.06 0.81 0.02 0.00 -0.37 0.00 0.00 177.43 177.84 3ciy n GLN 663 N -4.40 3.00 -4.24 6.67 10.64 0.74 -5.01 117.38 124.79 3ciy n GLN 663 Ca 0.12 -2.95 -0.18 0.00 -1.83 0.00 0.00 57.00 52.17 3ciy n GLN 663 Cb 0.03 -1.92 -0.11 0.00 -0.86 0.00 0.00 30.24 27.38 3ciy n GLN 663 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 3ciy s THR 664 N -2.91 1.33 -0.33 -0.39 -1.32 0.79 -4.98 115.64 107.83 3ciy s THR 664 Ca 0.45 -1.75 0.06 0.00 -1.21 0.00 0.00 61.69 59.24 3ciy s THR 664 Cb 0.37 -1.56 0.46 0.00 -1.51 0.00 0.00 72.50 70.26 3ciy s THR 664 CO 0.09 -0.44 1.27 1.41 -2.21 0.00 0.00 174.62 174.74 3ciy n HIS 665 N 0.47 2.79 -2.98 9.09 8.25 -1.26 -4.88 115.22 126.69 3ciy n HIS 665 Ca -0.15 -2.29 -0.41 0.00 -0.26 0.00 0.00 57.72 54.60 3ciy n HIS 665 Cb 0.57 -0.45 -0.05 0.00 1.12 0.00 0.00 29.99 31.19 3ciy n HIS 665 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3ciy s THR 666 N -4.62 4.89 -0.26 1.59 2.01 -1.26 -4.96 115.64 113.03 3ciy s THR 666 Ca 0.52 1.37 -0.36 0.00 0.31 0.00 0.00 61.69 63.53 3ciy s THR 666 Cb 0.42 -4.05 -0.13 0.00 0.01 0.00 0.00 72.50 68.75 3ciy s THR 666 CO 0.03 -0.05 1.97 -3.20 -0.69 0.00 0.00 174.62 172.69 3ciy n ASN 667 N 5.91 2.58 -3.86 3.53 2.85 -0.04 -4.69 115.26 121.53 3ciy n ASN 667 Ca 0.03 0.76 -0.30 0.00 -0.11 0.00 0.00 54.58 54.96 3ciy n ASN 667 Cb 0.48 -1.26 -0.15 0.00 1.24 0.00 0.00 39.78 40.09 3ciy n ASN 667 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3ciy s ILE 668 N 5.32 1.51 0.70 -1.44 1.01 -1.26 -2.38 121.20 124.66 3ciy s ILE 668 Ca 1.02 -1.82 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 3ciy s ILE 668 Cb -0.87 -2.12 0.02 0.00 0.01 0.00 0.00 42.46 39.49 3ciy s ILE 668 CO 0.55 -0.64 1.25 -0.55 0.00 0.00 0.00 174.94 175.55 3ciy s SER 669 N 1.30 4.32 -0.44 3.58 0.15 -1.26 -3.41 113.70 117.93 3ciy s SER 669 Ca 0.10 2.50 -0.01 0.00 0.70 0.00 0.00 55.95 59.24 3ciy s SER 669 Cb -0.18 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.54 3ciy s SER 669 CO -0.17 -2.19 0.04 -0.62 1.20 0.00 0.00 173.24 171.50 3ciy n GLU 670 N -2.37 -2.70 0.19 5.44 1.02 -1.26 -4.79 120.64 116.18 3ciy n GLU 670 Ca 0.15 0.21 0.16 0.00 -0.02 0.00 0.00 57.16 57.66 3ciy n GLU 670 Cb 0.49 -4.75 0.79 0.00 -0.02 0.00 0.00 31.44 27.95 3ciy n GLU 670 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3ciy h LEU 671 N -0.07 0.00 -0.21 -4.62 5.85 -1.94 -2.65 115.31 111.67 3ciy h LEU 671 Ca -0.13 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 3ciy h LEU 671 Cb 1.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 3ciy h LEU 671 CO 0.16 0.00 -0.17 0.28 -0.34 0.00 0.00 178.44 178.37 3ciy h SER 672 N 0.00 0.52 0.00 1.25 0.02 -1.89 -3.39 113.55 110.05 3ciy h SER 672 Ca 0.09 -0.45 -0.28 0.00 -0.84 0.00 0.00 61.79 60.30 3ciy h SER 672 Cb 0.45 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 3ciy h SER 672 CO -0.00 0.86 -1.89 0.41 -1.14 0.00 0.00 176.83 175.07 3ciy n THR 673 N -4.47 1.18 -0.13 -2.27 -1.04 -1.03 -4.76 114.28 101.77 3ciy n THR 673 Ca -0.05 -0.20 -0.11 0.00 -2.04 0.00 0.00 64.05 61.65 3ciy n THR 673 Cb 0.38 -1.85 0.07 0.00 -1.82 0.00 0.00 70.33 67.11 3ciy n THR 673 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3ciy n HIS 674 N -3.97 1.33 -1.81 -1.42 8.25 -1.03 -3.99 115.22 112.58 3ciy n HIS 674 Ca -0.35 -1.23 0.06 0.00 -0.26 0.00 0.00 57.72 55.93 3ciy n HIS 674 Cb 0.71 -0.62 0.14 0.00 1.12 0.00 0.00 29.99 31.35 3ciy n HIS 674 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3ciy n TYR 675 N -0.07 0.00 -0.67 4.41 4.02 -1.26 -1.07 117.16 122.52 3ciy n TYR 675 Ca 0.26 -1.11 -0.30 0.00 -0.01 0.00 0.00 57.90 56.73 3ciy n TYR 675 Cb 0.92 -0.20 0.18 0.00 -0.02 0.00 0.00 39.34 40.22 3ciy n TYR 675 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3ciy s LEU 676 N -2.18 2.43 0.22 7.72 1.43 -1.26 -2.44 118.68 124.60 3ciy s LEU 676 Ca 0.35 2.05 -0.02 0.00 -1.03 0.00 0.00 54.13 55.48 3ciy s LEU 676 Cb 0.35 -4.33 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 3ciy s LEU 676 CO -0.08 -3.33 0.42 0.00 0.23 0.00 0.00 176.35 173.59 3ciy n ASN 678 N -0.70 0.39 -3.58 0.00 5.15 0.54 -0.51 115.26 116.55 3ciy n ASN 678 Ca -0.04 -0.69 -0.12 0.00 -0.60 0.00 0.00 54.58 53.13 3ciy n ASN 678 Cb 0.54 0.94 -0.06 0.00 -0.53 0.00 0.00 39.78 40.67 3ciy n ASN 678 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3ciy s THR 679 N -1.57 0.00 0.43 -0.44 -1.32 -1.10 -4.80 115.64 106.84 3ciy s THR 679 Ca 0.03 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.46 3ciy s THR 679 Cb 0.05 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.13 3ciy s THR 679 CO 0.26 0.00 0.59 -2.65 -2.21 0.00 0.00 174.62 170.61 3ciy n PRO 680 N 1.05 -0.23 -0.34 7.08 -0.02 -1.26 0.14 135.00 141.42 3ciy n PRO 680 Ca -0.12 -1.18 -0.02 0.00 -2.02 0.00 0.00 63.50 60.15 3ciy n PRO 680 Cb 0.57 -0.52 0.02 0.00 -0.02 0.00 0.00 33.50 33.55 3ciy n PRO 680 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3ciy n HIS 681 N -2.55 -0.04 0.30 6.00 -0.00 -1.26 -0.55 115.22 117.13 3ciy n HIS 681 Ca 0.08 1.07 0.18 0.00 0.46 0.00 0.00 57.72 59.51 3ciy n HIS 681 Cb 0.29 -0.78 0.84 0.00 -0.12 0.00 0.00 29.99 30.22 3ciy n HIS 681 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3ciy h HIS 682 N 0.00 0.00 -0.38 1.57 3.86 -2.00 -2.84 115.15 115.35 3ciy h HIS 682 Ca 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3ciy h HIS 682 Cb 0.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.96 3ciy h HIS 682 CO -0.78 0.00 0.00 0.66 0.86 0.00 0.00 177.93 178.67 3ciy n TYR 683 N -2.89 0.59 -2.26 2.45 4.01 0.29 -4.97 117.16 114.39 3ciy n TYR 683 Ca -0.01 -0.54 -0.41 0.00 -0.16 0.00 0.00 57.90 56.79 3ciy n TYR 683 Cb 0.19 -0.06 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 3ciy n TYR 683 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3ciy s TYR 684 N -1.20 3.27 -1.64 -0.72 6.14 -0.90 -2.79 117.35 119.50 3ciy s TYR 684 Ca 0.28 1.52 0.00 0.00 0.64 0.00 0.00 57.07 59.51 3ciy s TYR 684 Cb 0.16 -3.52 0.00 0.00 0.42 0.00 0.00 41.96 39.02 3ciy s TYR 684 CO 0.17 -1.35 0.00 0.41 0.64 0.00 0.00 175.55 175.42 3ciy n GLY 685 N 1.03 -0.41 3.58 8.97 0.00 0.33 -4.91 105.19 113.78 3ciy n GLY 685 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3ciy n GLY 685 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ciy s PHE 686 N -2.93 3.19 -0.30 1.61 0.40 -1.12 -4.81 117.98 114.02 3ciy s PHE 686 Ca 0.00 -0.07 -0.37 0.00 -0.60 0.00 0.00 56.93 55.89 3ciy s PHE 686 Cb 0.00 -2.13 -0.13 0.00 0.51 0.00 0.00 43.02 41.27 3ciy s PHE 686 CO 0.00 -0.00 1.99 -2.30 0.70 0.00 0.00 175.22 175.61 3ciy n PRO 687 N 3.97 1.19 -0.33 0.24 -0.02 -1.26 -1.97 135.00 136.80 3ciy n PRO 687 Ca -0.16 0.39 0.20 0.00 -2.02 0.00 0.00 63.50 61.90 3ciy n PRO 687 Cb 0.52 -2.30 0.41 0.00 -0.02 0.00 0.00 33.50 32.11 3ciy n PRO 687 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3ciy h LEU 688 N 9.92 0.52 -0.34 2.45 5.85 -1.78 -2.12 115.31 129.82 3ciy h LEU 688 Ca -0.36 0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.59 3ciy h LEU 688 Cb 1.32 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.40 3ciy h LEU 688 CO 0.99 -0.03 -0.03 0.07 -0.34 0.00 0.00 178.44 179.10 3ciy h LYS 689 N 0.42 0.05 -3.13 1.25 2.10 -1.84 -3.21 116.57 112.22 3ciy h LYS 689 Ca 0.67 -0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 58.68 3ciy h LYS 689 Cb 1.40 -0.01 0.02 0.00 -0.90 0.00 0.00 32.23 32.74 3ciy h LYS 689 CO -0.55 0.04 3.66 1.28 -2.00 0.00 0.00 179.45 181.88 3ciy n LEU 690 N -5.22 8.18 -3.93 7.07 4.77 -0.80 -4.79 117.00 122.29 3ciy n LEU 690 Ca 0.01 -4.17 -0.31 0.00 -0.03 0.00 0.00 56.01 51.51 3ciy n LEU 690 Cb 0.18 -1.51 -0.15 0.00 -2.33 0.00 0.00 43.42 39.61 3ciy n LEU 690 CO 0.20 1.82 -0.36 0.12 -1.33 0.00 0.00 177.39 177.84 3ciy s PHE 691 N 2.41 2.82 -0.43 -1.77 2.19 -1.21 -4.92 117.98 117.07 3ciy s PHE 691 Ca 0.65 -2.29 -0.27 0.00 0.33 0.00 0.00 56.93 55.34 3ciy s PHE 691 Cb 0.17 -2.18 -0.03 0.00 -1.31 0.00 0.00 43.02 39.67 3ciy s PHE 691 CO -0.06 -0.88 1.93 0.16 1.83 0.00 0.00 175.22 178.21 3ciy s ASP 692 N 1.24 5.47 -0.16 6.13 -4.77 -1.26 -4.81 116.67 118.50 3ciy s ASP 692 Ca 0.05 1.03 0.06 0.00 -3.30 0.00 0.00 52.55 50.39 3ciy s ASP 692 Cb -0.19 -2.52 0.41 0.00 -1.09 0.00 0.00 42.92 39.53 3ciy s ASP 692 CO -0.12 -2.09 1.26 0.35 0.70 0.00 0.00 175.17 175.27 3ciy n THR 693 N 7.46 1.68 0.57 2.11 -2.24 -1.26 -4.13 114.28 118.47 3ciy n THR 693 Ca 0.24 -0.82 0.11 0.00 -2.27 0.00 0.00 64.05 61.32 3ciy n THR 693 Cb 0.49 -0.49 0.45 0.00 -2.10 0.00 0.00 70.33 68.68 3ciy n THR 693 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ciy n SER 694 N 0.12 0.43 -0.87 3.42 3.41 -1.26 -2.52 113.62 116.35 3ciy n SER 694 Ca 0.20 0.58 0.09 0.00 -0.26 0.00 0.00 58.87 59.48 3ciy n SER 694 Cb 0.87 -0.68 0.15 0.00 -0.26 0.00 0.00 64.21 64.29 3ciy n SER 694 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ciy n SER 695 N -1.95 2.95 -4.45 4.04 2.88 -1.26 -4.98 113.62 110.86 3ciy n SER 695 Ca 0.04 -1.86 -0.31 0.00 -1.33 0.00 0.00 58.87 55.41 3ciy n SER 695 Cb 0.28 -0.16 -0.13 0.00 -0.75 0.00 0.00 64.21 63.45 3ciy n SER 695 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81