#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 -5.76 1.50 0.00 0.00 -1.04 0.24 -4.98 114.28 104.25 3ciy n THR 29 Ca 0.13 -0.79 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 3ciy n THR 29 Cb 0.58 -0.86 0.00 0.00 -1.82 0.00 0.00 70.33 68.24 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 -2.96 0.00 -2.35 12.58 0.31 -1.24 -4.78 118.33 119.89 3ciy n VAL 30 Ca -0.29 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3ciy n VAL 30 Cb 1.10 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.03 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 14.00 -2.43 -2.31 5.55 5.12 -1.26 -3.69 116.66 131.63 3ciy n ARG 31 Ca 0.00 2.09 -0.03 0.00 -1.93 0.00 0.00 57.85 57.98 3ciy n ARG 31 Cb 0.00 -4.09 0.01 0.00 -1.16 0.00 0.00 32.46 27.22 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 0.45 -0.37 -0.92 -1.55 4.02 -1.26 -4.31 117.16 113.22 3ciy n TYR 32 Ca 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 3ciy n TYR 32 Cb 0.01 -2.34 0.00 0.00 -0.02 0.00 0.00 39.34 36.99 3ciy n TYR 32 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3ciy n ASN 33 N -0.95 -2.52 -3.74 7.72 5.03 -1.26 -4.85 115.26 114.69 3ciy n ASN 33 Ca -0.04 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.12 3ciy n ASN 33 Cb 0.52 -1.41 -0.14 0.00 -1.02 0.00 0.00 39.78 37.74 3ciy n ASN 33 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 3ciy s VAL 34 N -2.08 1.40 -0.67 2.41 -7.23 -1.21 0.29 120.40 113.30 3ciy s VAL 34 Ca 0.00 -2.36 -0.26 0.00 -1.81 0.00 0.00 61.98 57.56 3ciy s VAL 34 Cb 0.00 -2.00 0.04 0.00 0.56 0.00 0.00 36.38 34.99 3ciy s VAL 34 CO 0.00 -0.83 1.14 0.00 -0.31 0.00 0.00 175.10 175.10 3ciy s ALA 35 N 0.60 2.93 -0.35 1.32 0.00 0.92 -4.17 121.76 123.00 3ciy s ALA 35 Ca 0.16 -1.38 -0.15 0.00 0.00 0.00 0.00 51.96 50.58 3ciy s ALA 35 Cb -0.23 -4.06 -0.01 0.00 0.00 0.00 0.00 23.12 18.82 3ciy s ALA 35 CO -0.05 -2.95 0.36 0.34 0.00 0.00 0.00 175.76 173.47 3ciy s ASP 36 N 3.48 6.18 -0.47 0.00 -1.08 -1.24 0.12 116.67 123.66 3ciy s ASP 36 Ca 0.32 -0.28 -0.09 0.00 -0.52 0.00 0.00 52.55 51.98 3ciy s ASP 36 Cb -0.11 -2.20 0.12 0.00 -1.46 0.00 0.00 42.92 39.27 3ciy s ASP 36 CO 0.16 -0.36 0.34 0.00 0.52 0.00 0.00 175.17 175.83 3ciy n SER 38 N 4.90 -0.39 -4.60 0.00 7.64 -1.26 -4.02 113.62 115.89 3ciy n SER 38 Ca -0.08 -0.11 -0.42 0.00 1.01 0.00 0.00 58.87 59.27 3ciy n SER 38 Cb 0.41 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 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 -0.31 1.16 0.00 1.43 3.76 -1.25 -4.63 115.29 115.45 3ciy s HIS 39 Ca 0.00 0.64 0.00 0.00 -0.15 0.00 0.00 55.06 55.55 3ciy s HIS 39 Cb 0.00 -3.90 0.00 0.00 1.11 0.00 0.00 32.58 29.79 3ciy s HIS 39 CO 0.00 -3.93 0.14 1.28 -0.85 0.00 0.00 174.74 171.39 3ciy n LEU 40 N 12.11 0.29 -1.12 0.89 4.32 -1.23 -4.99 117.00 127.27 3ciy n LEU 40 Ca 0.30 -0.52 -0.12 0.00 -0.02 0.00 0.00 56.01 55.65 3ciy n LEU 40 Cb 0.46 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.23 3ciy n LEU 40 CO 0.66 0.07 -0.13 1.17 -1.22 0.00 0.00 177.39 177.94 3ciy n LYS 41 N -0.46 -0.89 -1.66 3.23 0.00 -1.26 -4.91 118.16 112.19 3ciy n LYS 41 Ca 0.00 0.78 -0.49 0.00 0.00 0.00 0.00 58.31 58.60 3ciy n LYS 41 Cb 0.02 -4.86 -0.05 0.00 0.00 0.00 0.00 35.03 30.14 3ciy n LYS 41 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3ciy n LEU 42 N -1.53 2.86 -0.10 3.14 4.77 -1.26 -4.69 117.00 120.20 3ciy n LEU 42 Ca -0.13 1.06 -0.19 0.00 -0.03 0.00 0.00 56.01 56.72 3ciy n LEU 42 Cb 0.49 -1.34 -0.10 0.00 -2.33 0.00 0.00 43.42 40.13 3ciy n LEU 42 CO 0.18 -0.37 -0.39 0.71 -1.33 0.00 0.00 177.39 176.19 3ciy h THR 43 N 4.26 0.91 -3.98 -5.08 1.35 -1.92 -2.99 112.91 105.47 3ciy h THR 43 Ca -0.47 -2.06 -0.54 0.00 -0.55 0.00 0.00 66.41 62.80 3ciy h THR 43 Cb 1.28 2.09 -0.31 0.00 -1.73 0.00 0.00 68.15 69.48 3ciy h THR 43 CO 0.89 0.31 -0.83 -1.38 -0.25 0.00 0.00 175.52 174.26 3ciy s HIS 44 N -2.32 1.59 -0.65 4.73 0.00 -1.26 -4.44 115.29 112.93 3ciy s HIS 44 Ca -0.26 -0.42 -0.33 0.00 -3.00 0.00 0.00 55.06 51.05 3ciy s HIS 44 Cb 0.04 -1.07 -0.16 0.00 -4.00 0.00 0.00 32.58 27.40 3ciy s HIS 44 CO 0.55 -0.13 2.43 1.51 -1.00 0.00 0.00 174.74 178.11 3ciy n ILE 45 N 3.06 0.03 -2.63 -5.38 0.00 -1.26 -4.89 119.36 108.28 3ciy n ILE 45 Ca -0.17 -0.24 -0.35 0.00 0.00 0.00 0.00 62.75 61.98 3ciy n ILE 45 Cb 0.53 -1.28 -0.05 0.00 0.00 0.00 0.00 39.64 38.84 3ciy n ILE 45 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3ciy s PRO 46 N 7.71 4.18 -0.39 9.51 0.04 -1.26 -5.04 135.00 149.74 3ciy s PRO 46 Ca 1.19 1.38 0.03 0.00 0.04 0.00 0.00 61.00 63.65 3ciy s PRO 46 Cb -0.96 -2.44 0.16 0.00 0.04 0.00 0.00 34.50 31.30 3ciy s PRO 46 CO 0.47 -0.10 0.38 0.16 0.04 0.00 0.00 177.00 177.94 3ciy s ASP 47 N -1.76 1.23 0.48 6.66 -4.77 -1.26 -5.15 116.67 112.10 3ciy s ASP 47 Ca 0.59 -2.09 0.06 0.00 -3.30 0.00 0.00 52.55 47.81 3ciy s ASP 47 Cb -0.18 0.30 0.03 0.00 -1.09 0.00 0.00 42.92 41.97 3ciy s ASP 47 CO 0.23 -0.22 0.66 -1.81 0.70 0.00 0.00 175.17 174.73 3ciy s ASP 48 N 0.95 5.47 0.44 2.11 1.01 -1.26 -5.00 116.67 120.39 3ciy s ASP 48 Ca 0.23 -0.32 0.36 0.00 0.71 0.00 0.00 52.55 53.53 3ciy s ASP 48 Cb -0.10 -0.65 1.24 0.00 1.01 0.00 0.00 42.92 44.43 3ciy s ASP 48 CO -0.06 -0.95 1.18 0.18 0.21 0.00 0.00 175.17 175.73 3ciy n LEU 49 N -2.05 0.00 -2.81 1.23 7.99 -1.26 -4.02 117.00 116.08 3ciy n LEU 49 Ca 0.09 0.74 -0.04 0.00 -0.01 0.00 0.00 56.01 56.79 3ciy n LEU 49 Cb 0.59 -0.36 -0.01 0.00 -0.11 0.00 0.00 43.42 43.54 3ciy n LEU 49 CO 0.41 -0.74 1.08 -2.65 -1.51 0.00 0.00 177.39 173.97 3ciy n PRO 50 N -3.38 0.43 0.21 3.23 -0.02 -1.26 -4.13 135.00 130.09 3ciy n PRO 50 Ca 0.32 -0.51 0.11 0.00 -2.02 0.00 0.00 63.50 61.40 3ciy n PRO 50 Cb 1.52 -1.90 0.19 0.00 -0.02 0.00 0.00 33.50 33.28 3ciy n PRO 50 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3ciy h SER 51 N 6.80 0.00 -1.17 2.55 4.64 -1.79 -3.37 113.55 121.23 3ciy h SER 51 Ca 0.09 0.00 -0.70 0.00 -0.47 0.00 0.00 61.79 60.71 3ciy h SER 51 Cb 0.11 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.09 3ciy h SER 51 CO 0.86 0.08 2.02 -3.20 -0.87 0.00 0.00 176.83 175.72 3ciy n ASN 52 N -3.12 4.98 -3.31 4.97 5.15 -1.26 -4.57 115.26 118.10 3ciy n ASN 52 Ca 0.03 -2.93 -0.08 0.00 -0.60 0.00 0.00 54.58 51.00 3ciy n ASN 52 Cb 0.54 -1.70 0.01 0.00 -0.53 0.00 0.00 39.78 38.10 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 3.48 0.00 0.00 -1.44 -0.00 -1.26 -4.25 121.20 117.72 3ciy s ILE 53 Ca 0.51 -0.99 0.00 0.00 -0.00 0.00 0.00 60.65 60.17 3ciy s ILE 53 Cb 0.03 -2.53 0.00 0.00 -0.00 0.00 0.00 42.46 39.96 3ciy s ILE 53 CO 0.05 0.00 0.43 0.35 -0.00 0.00 0.00 174.94 175.77 3ciy n THR 54 N -0.50 0.12 -3.58 8.37 -2.24 0.84 -3.71 114.28 113.57 3ciy n THR 54 Ca -0.07 -0.15 -0.17 0.00 -2.27 0.00 0.00 64.05 61.40 3ciy n THR 54 Cb 0.60 1.21 -0.07 0.00 -2.10 0.00 0.00 70.33 69.96 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 -0.12 0.01 -0.13 2.28 1.01 0.84 0.18 120.40 124.47 3ciy s VAL 55 Ca 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.85 3ciy s VAL 55 Cb 0.00 -0.92 0.06 0.00 0.00 0.00 0.00 36.38 35.52 3ciy s VAL 55 CO 0.00 -0.05 0.27 -0.22 0.00 0.00 0.00 175.10 175.10 3ciy s LEU 56 N -0.99 -0.15 -0.31 3.92 1.98 -1.08 0.31 118.68 122.36 3ciy s LEU 56 Ca -0.10 0.60 -0.15 0.00 -2.89 0.00 0.00 54.13 51.60 3ciy s LEU 56 Cb -0.02 0.75 -0.03 0.00 0.66 0.00 0.00 46.19 47.56 3ciy s LEU 56 CO 0.08 -0.22 0.35 0.21 -1.89 0.00 0.00 176.35 174.88 3ciy s ASN 57 N 2.14 6.20 0.00 3.68 3.84 0.33 -1.00 114.94 130.13 3ciy s ASN 57 Ca -0.02 -0.00 0.02 0.00 0.21 0.00 0.00 52.86 53.07 3ciy s ASN 57 Cb -0.12 -2.20 -0.01 0.00 -0.55 0.00 0.00 41.25 38.38 3ciy s ASN 57 CO -0.09 -0.26 0.25 0.18 -2.79 0.00 0.00 177.10 174.39 3ciy n LEU 58 N 5.35 0.47 -4.52 3.21 4.77 0.20 0.84 117.00 127.32 3ciy n LEU 58 Ca -0.09 -0.68 -0.38 0.00 -0.03 0.00 0.00 56.01 54.83 3ciy n LEU 58 Cb 0.50 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 3ciy n LEU 58 CO 0.39 0.11 0.22 0.41 -1.33 0.00 0.00 177.39 177.19 3ciy n THR 59 N -0.63 2.72 -2.88 -5.08 -1.04 0.80 -3.68 114.28 104.50 3ciy n THR 59 Ca 0.01 -0.49 -0.11 0.00 -2.04 0.00 0.00 64.05 61.42 3ciy n THR 59 Cb 0.03 -0.84 0.06 0.00 -1.82 0.00 0.00 70.33 67.76 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 -1.81 -1.42 -3.74 -1.42 8.25 -1.23 -4.30 115.22 109.54 3ciy n HIS 60 Ca 0.12 0.59 -0.10 0.00 -0.26 0.00 0.00 57.72 58.08 3ciy n HIS 60 Cb 0.48 -3.92 -0.06 0.00 1.12 0.00 0.00 29.99 27.61 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 -3.80 -0.09 -0.44 0.41 -0.87 -1.24 -3.54 114.94 105.38 3ciy s ASN 61 Ca 0.03 -0.49 -0.26 0.00 -1.57 0.00 0.00 52.86 50.57 3ciy s ASN 61 Cb -0.00 0.43 0.02 0.00 -0.02 0.00 0.00 41.25 41.68 3ciy s ASN 61 CO 0.47 -0.82 0.96 -1.10 -2.57 0.00 0.00 177.10 174.03 3ciy s GLN 62 N -3.84 3.65 -0.15 -0.60 -0.21 -1.13 -4.45 119.66 112.93 3ciy s GLN 62 Ca 0.05 0.34 0.02 0.00 0.02 0.00 0.00 55.36 55.79 3ciy s GLN 62 Cb 0.03 -3.89 0.01 0.00 1.00 0.00 0.00 33.01 30.16 3ciy s GLN 62 CO -0.10 -1.17 -0.19 -0.51 -2.12 0.00 0.00 175.29 171.20 3ciy s LEU 63 N 3.78 2.24 0.02 2.90 1.02 -1.26 -4.16 118.68 123.21 3ciy s LEU 63 Ca 0.39 -0.56 -0.13 0.00 0.02 0.00 0.00 54.13 53.84 3ciy s LEU 63 Cb -0.10 -1.49 -0.07 0.00 0.02 0.00 0.00 46.19 44.55 3ciy s LEU 63 CO 0.25 0.07 1.18 -0.09 0.02 0.00 0.00 176.35 177.78 3ciy h ARG 64 N 7.40 -0.46 -2.66 1.70 2.43 -1.78 -3.28 114.38 117.74 3ciy h ARG 64 Ca -0.34 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 58.98 3ciy h ARG 64 Cb 1.18 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.78 3ciy h ARG 64 CO 0.57 -0.30 0.38 -0.98 -1.51 0.00 0.00 179.97 178.13 3ciy s ARG 65 N -3.99 1.53 -0.55 0.20 3.03 -1.26 -3.90 118.95 114.00 3ciy s ARG 65 Ca -0.07 -0.88 -0.19 0.00 2.03 0.00 0.00 55.73 56.62 3ciy s ARG 65 Cb 0.01 0.50 0.08 0.00 -1.03 0.00 0.00 34.95 34.50 3ciy s ARG 65 CO 0.21 -0.71 0.68 -0.51 -1.13 0.00 0.00 175.30 173.84 3ciy s LEU 66 N -3.00 5.11 -0.57 -1.89 1.43 -1.26 -4.90 118.68 113.61 3ciy s LEU 66 Ca 0.13 -1.14 -0.27 0.00 -1.03 0.00 0.00 54.13 51.83 3ciy s LEU 66 Cb -0.04 -2.39 -0.09 0.00 0.03 0.00 0.00 46.19 43.70 3ciy s LEU 66 CO 0.05 -1.02 2.46 -2.65 0.23 0.00 0.00 176.35 175.43 3ciy n PRO 67 N 6.33 0.88 0.10 1.29 -0.02 -1.26 -4.79 135.00 137.53 3ciy n PRO 67 Ca -0.08 -0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.47 3ciy n PRO 67 Cb 0.44 -3.13 0.35 0.00 -0.02 0.00 0.00 33.50 31.14 3ciy n PRO 67 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3ciy n PRO 68 N 8.92 0.08 -0.00 0.52 -0.04 -1.26 -2.00 135.00 141.22 3ciy n PRO 68 Ca 0.42 0.57 0.05 0.00 -0.04 0.00 0.00 63.50 64.50 3ciy n PRO 68 Cb 0.46 -1.81 -0.07 0.00 -0.04 0.00 0.00 33.50 32.04 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 -1.95 0.00 1.48 0.52 -2.24 -1.26 -4.15 114.28 106.67 3ciy n THR 69 Ca -0.01 -0.25 0.01 0.00 -2.27 0.00 0.00 64.05 61.53 3ciy n THR 69 Cb 0.06 0.58 0.04 0.00 -2.10 0.00 0.00 70.33 68.90 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 -1.59 0.00 -2.45 3.42 4.13 -0.85 -3.61 115.26 114.31 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 0.21 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 38.50 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 -0.53 3.10 -0.08 3.10 3.72 -1.26 -4.45 117.46 121.06 3ciy n PHE 71 Ca 0.01 -2.68 -0.09 0.00 -0.05 0.00 0.00 57.45 54.63 3ciy n PHE 71 Cb 0.00 -0.92 -0.11 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 -0.70 1.06 0.50 4.37 -1.04 -1.24 -4.25 114.28 112.97 3ciy n THR 72 Ca 0.53 -0.57 0.11 0.00 -2.04 0.00 0.00 64.05 62.07 3ciy n THR 72 Cb 0.61 -0.78 0.44 0.00 -1.82 0.00 0.00 70.33 68.78 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 -2.72 0.14 -3.66 -2.82 0.63 -1.26 -3.71 116.66 103.27 3ciy n ARG 73 Ca -0.28 0.32 -0.28 0.00 -0.92 0.00 0.00 57.85 56.69 3ciy n ARG 73 Cb 0.95 -1.74 -0.12 0.00 0.45 0.00 0.00 32.46 32.00 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 -3.18 2.10 -1.05 -0.14 1.51 -1.26 -4.48 117.35 110.85 3ciy s TYR 74 Ca 0.06 -2.62 0.16 0.00 -1.01 0.00 0.00 57.07 53.66 3ciy s TYR 74 Cb 0.10 -1.78 0.53 0.00 -0.11 0.00 0.00 41.96 40.71 3ciy s TYR 74 CO 0.39 -0.73 1.45 0.45 -1.11 0.00 0.00 175.55 176.00 3ciy n SER 75 N 2.90 3.84 -0.03 2.29 2.88 -1.24 -4.44 113.62 119.82 3ciy n SER 75 Ca 0.19 -2.30 0.01 0.00 -1.33 0.00 0.00 58.87 55.44 3ciy n SER 75 Cb 0.39 -0.43 -0.10 0.00 -0.75 0.00 0.00 64.21 63.31 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 0.74 1.08 -1.65 -1.46 1.13 -1.26 -4.81 117.38 111.15 3ciy n GLN 76 Ca 0.20 -0.07 -0.52 0.00 -1.94 0.00 0.00 57.00 54.66 3ciy n GLN 76 Cb 0.68 -1.32 -0.06 0.00 0.11 0.00 0.00 30.24 29.65 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 -2.18 2.26 -0.03 1.08 4.77 -1.24 -4.45 117.00 117.21 3ciy n LEU 77 Ca -0.10 1.09 -0.11 0.00 -0.03 0.00 0.00 56.01 56.86 3ciy n LEU 77 Cb 0.59 -1.23 -0.14 0.00 -2.33 0.00 0.00 43.42 40.30 3ciy n LEU 77 CO 0.27 -0.66 -0.65 0.00 -1.33 0.00 0.00 177.39 175.03 3ciy n ALA 78 N 3.87 1.41 -2.87 -1.18 0.00 0.48 -4.21 120.51 118.00 3ciy n ALA 78 Ca 0.21 -0.81 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 3ciy n ALA 78 Cb 0.20 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 18.84 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 -2.58 0.10 -0.04 0.00 -4.36 -1.11 0.60 121.20 113.80 3ciy s ILE 79 Ca -0.08 -0.80 -0.02 0.00 -0.26 0.00 0.00 60.65 59.48 3ciy s ILE 79 Cb 0.08 -1.10 0.03 0.00 1.25 0.00 0.00 42.46 42.72 3ciy s ILE 79 CO 0.81 -0.44 0.07 -1.48 0.24 0.00 0.00 174.94 174.14 3ciy s LEU 80 N -2.45 0.25 -1.14 0.37 2.34 -0.74 -2.63 118.68 114.67 3ciy s LEU 80 Ca -0.00 0.10 -0.21 0.00 0.06 0.00 0.00 54.13 54.08 3ciy s LEU 80 Cb 0.01 -0.08 0.06 0.00 -0.56 0.00 0.00 46.19 45.62 3ciy s LEU 80 CO -0.07 -0.23 1.58 -0.62 -1.06 0.00 0.00 176.35 175.94 3ciy s ASP 81 N 2.03 6.63 -0.58 1.48 -1.08 -0.17 -2.79 116.67 122.19 3ciy s ASP 81 Ca 0.03 -1.88 0.06 0.00 -0.52 0.00 0.00 52.55 50.24 3ciy s ASP 81 Cb -0.12 -2.57 0.23 0.00 -1.46 0.00 0.00 42.92 38.99 3ciy s ASP 81 CO -0.03 -1.38 0.62 0.00 0.52 0.00 0.00 175.17 174.90 3ciy n ALA 82 N 8.74 3.51 -2.32 3.66 0.00 -1.07 0.61 120.51 133.63 3ciy n ALA 82 Ca 0.40 -4.31 -0.19 0.00 0.00 0.00 0.00 53.44 49.34 3ciy n ALA 82 Cb 0.49 -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 -1.82 2.16 -1.38 0.00 0.00 -1.21 -3.59 107.32 101.47 3ciy s GLY 83 Ca 0.36 -1.79 -0.04 0.00 0.00 0.00 0.00 44.72 43.25 3ciy s GLY 83 CO -0.08 -1.56 0.46 0.69 0.00 0.00 0.00 173.10 172.62 3ciy n PHE 84 N -0.60 -1.60 -4.17 1.90 3.72 -0.01 -3.51 117.46 113.18 3ciy n PHE 84 Ca 0.03 0.40 -0.14 0.00 -0.05 0.00 0.00 57.45 57.68 3ciy n PHE 84 Cb 0.64 -4.00 -0.11 0.00 -0.94 0.00 0.00 39.48 35.07 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 -2.68 1.42 -1.21 4.37 0.01 -1.23 -4.03 114.94 111.59 3ciy s ASN 85 Ca 0.23 -0.80 -0.17 0.00 -0.71 0.00 0.00 52.86 51.41 3ciy s ASN 85 Cb -0.10 0.01 0.11 0.00 0.41 0.00 0.00 41.25 41.68 3ciy s ASN 85 CO 0.28 -0.26 1.55 -0.44 -1.51 0.00 0.00 177.10 176.73 3ciy s SER 86 N -2.41 6.88 -0.35 -1.22 0.01 -1.24 -4.32 113.70 111.06 3ciy s SER 86 Ca 0.05 -2.53 -0.09 0.00 1.31 0.00 0.00 55.95 54.69 3ciy s SER 86 Cb -0.03 -2.50 0.03 0.00 0.21 0.00 0.00 66.02 63.73 3ciy s SER 86 CO -0.00 -1.04 0.15 -0.63 0.41 0.00 0.00 173.24 172.13 3ciy s ILE 87 N 3.19 4.17 0.05 1.44 1.01 -1.25 -4.15 121.20 125.66 3ciy s ILE 87 Ca 0.47 -0.94 -0.26 0.00 0.00 0.00 0.00 60.65 59.92 3ciy s ILE 87 Cb 0.00 -3.32 -0.14 0.00 0.01 0.00 0.00 42.46 39.02 3ciy s ILE 87 CO 0.02 -0.17 1.40 0.77 0.00 0.00 0.00 174.94 176.96 3ciy h SER 88 N 8.32 -0.89 -5.33 3.58 4.64 -1.88 -2.81 113.55 119.19 3ciy h SER 88 Ca -0.25 0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.00 3ciy h SER 88 Cb 1.10 0.26 -0.09 0.00 -0.31 0.00 0.00 62.40 63.36 3ciy h SER 88 CO 0.63 -0.53 -0.17 -1.59 -0.87 0.00 0.00 176.83 174.30 3ciy s LYS 89 N -5.05 1.62 -0.03 4.77 0.00 -1.26 -2.74 119.74 117.05 3ciy s LYS 89 Ca -0.13 -1.41 0.01 0.00 0.00 0.00 0.00 55.97 54.44 3ciy s LYS 89 Cb 0.02 0.45 0.02 0.00 0.00 0.00 0.00 37.83 38.32 3ciy s LYS 89 CO 0.42 -0.67 -0.04 -1.17 0.00 0.00 0.00 175.35 173.89 3ciy s LEU 90 N -3.08 1.46 0.24 2.77 2.96 -1.26 -4.47 118.68 117.30 3ciy s LEU 90 Ca 0.26 -0.11 -0.11 0.00 -0.22 0.00 0.00 54.13 53.94 3ciy s LEU 90 Cb -0.00 -0.40 -0.07 0.00 0.50 0.00 0.00 46.19 46.22 3ciy s LEU 90 CO 0.12 -0.03 0.58 -1.61 -1.32 0.00 0.00 176.35 174.09 3ciy s GLU 91 N 0.69 3.85 0.00 1.98 8.01 -1.26 -4.78 118.70 127.19 3ciy s GLU 91 Ca -0.09 0.36 0.00 0.00 0.01 0.00 0.00 54.97 55.25 3ciy s GLU 91 Cb -0.12 -2.64 0.00 0.00 -4.31 0.00 0.00 34.13 27.06 3ciy s GLU 91 CO -0.00 0.31 0.94 -2.30 0.01 0.00 0.00 175.26 174.22 3ciy n PRO 92 N -0.08 0.00 -0.06 0.39 -0.02 -1.26 -2.92 135.00 131.04 3ciy n PRO 92 Ca 0.00 0.44 -0.10 0.00 -2.02 0.00 0.00 63.50 61.83 3ciy n PRO 92 Cb 0.52 -1.53 -0.03 0.00 -0.02 0.00 0.00 33.50 32.45 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 0.33 -0.15 -0.52 4.39 -1.90 -3.11 114.58 113.63 3ciy h GLU 93 Ca 0.00 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.71 3ciy h GLU 93 Cb 0.05 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 3ciy h GLU 93 CO 0.00 0.26 0.36 -0.07 -1.16 0.00 0.00 179.01 178.40 3ciy h LEU 94 N 0.31 0.00 0.00 1.33 4.07 -1.69 -1.81 115.31 117.51 3ciy h LEU 94 Ca 0.09 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.81 3ciy h LEU 94 Cb 0.01 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.71 3ciy h LEU 94 CO -0.02 0.00 -1.26 0.00 -1.08 0.00 0.00 178.44 176.08 3ciy h GLN 96 N 0.00 0.00 0.00 0.00 3.07 -1.46 -3.27 115.11 113.45 3ciy h GLN 96 Ca -0.11 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.49 3ciy h GLN 96 Cb 1.86 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 29.40 3ciy h GLN 96 CO 0.11 0.00 -0.66 0.82 0.09 0.00 0.00 178.83 179.19 3ciy h ILE 97 N 0.00 1.23 -2.27 1.86 1.08 -1.58 -3.36 117.51 114.47 3ciy h ILE 97 Ca 0.00 -2.48 -0.59 0.00 -0.39 0.00 0.00 64.86 61.40 3ciy h ILE 97 Cb 0.85 2.44 -0.41 0.00 -3.07 0.00 0.00 36.82 36.63 3ciy h ILE 97 CO 0.00 0.65 -0.79 0.18 -0.69 0.00 0.00 178.15 177.50 3ciy n LEU 98 N -3.40 2.15 -0.06 1.44 7.99 -1.24 -4.79 117.00 119.09 3ciy n LEU 98 Ca 0.01 -5.08 0.16 0.00 -0.01 0.00 0.00 56.01 51.09 3ciy n LEU 98 Cb 0.75 -0.16 0.58 0.00 -0.11 0.00 0.00 43.42 44.48 3ciy n LEU 98 CO 0.42 2.00 1.19 -0.65 -1.51 0.00 0.00 177.39 178.84 3ciy h PRO 99 N 4.41 0.23 -4.94 3.23 0.11 -1.72 -3.26 132.00 130.07 3ciy h PRO 99 Ca 0.16 -0.01 -0.71 0.00 0.11 0.00 0.00 66.00 65.54 3ciy h PRO 99 Cb 0.76 -0.05 -0.17 0.00 0.11 0.00 0.00 31.00 31.65 3ciy h PRO 99 CO 0.66 0.15 1.20 -0.51 -0.21 0.00 0.00 178.00 179.29 3ciy s LEU 100 N -9.10 4.96 -0.12 2.35 1.02 -1.26 -4.71 118.68 111.81 3ciy s LEU 100 Ca -0.07 -2.57 -0.04 0.00 0.02 0.00 0.00 54.13 51.47 3ciy s LEU 100 Cb 0.20 -2.41 0.06 0.00 0.02 0.00 0.00 46.19 44.06 3ciy s LEU 100 CO 0.74 -0.90 0.22 -0.22 0.02 0.00 0.00 176.35 176.21 3ciy s LEU 101 N 2.19 -0.20 -0.19 1.79 0.20 -1.23 -3.70 118.68 117.54 3ciy s LEU 101 Ca 0.39 0.41 -0.04 0.00 0.69 0.00 0.00 54.13 55.58 3ciy s LEU 101 Cb -0.03 0.51 -0.11 0.00 -0.43 0.00 0.00 46.19 46.13 3ciy s LEU 101 CO -0.03 -0.25 -0.21 0.29 -0.29 0.00 0.00 176.35 175.85 3ciy n LYS 102 N 5.34 0.45 -4.03 1.98 5.02 0.20 -2.23 118.16 124.88 3ciy n LYS 102 Ca -0.05 0.15 -0.34 0.00 -2.02 0.00 0.00 58.31 56.04 3ciy n LYS 102 Cb 0.50 -1.30 -0.14 0.00 -0.02 0.00 0.00 35.03 34.06 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 -2.37 3.05 -0.33 -0.18 1.01 -1.10 0.63 120.40 121.11 3ciy s VAL 103 Ca -0.27 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.12 3ciy s VAL 103 Cb 0.09 -2.36 0.08 0.00 0.00 0.00 0.00 36.38 34.19 3ciy s VAL 103 CO 0.39 0.46 0.05 -0.22 0.00 0.00 0.00 175.10 175.78 3ciy s LEU 104 N 1.34 4.45 -0.40 3.92 2.96 -0.60 -1.79 118.68 128.55 3ciy s LEU 104 Ca 0.04 -1.80 -0.17 0.00 -0.22 0.00 0.00 54.13 51.99 3ciy s LEU 104 Cb -0.14 -1.68 0.01 0.00 0.50 0.00 0.00 46.19 44.88 3ciy s LEU 104 CO -0.05 -0.36 0.43 0.21 -1.32 0.00 0.00 176.35 175.27 3ciy s ASN 105 N 1.24 6.20 -0.35 3.68 2.47 -1.12 -1.19 114.94 125.87 3ciy s ASN 105 Ca 0.03 -0.56 0.15 0.00 0.42 0.00 0.00 52.86 52.90 3ciy s ASN 105 Cb -0.20 -2.22 0.45 0.00 -1.45 0.00 0.00 41.25 37.82 3ciy s ASN 105 CO -0.05 -0.54 0.99 0.18 -3.72 0.00 0.00 177.10 173.96 3ciy n LEU 106 N 5.59 2.29 -4.89 3.21 4.32 0.20 -2.60 117.00 125.12 3ciy n LEU 106 Ca -0.07 -4.13 -0.30 0.00 -0.02 0.00 0.00 56.01 51.49 3ciy n LEU 106 Cb 0.48 0.20 -0.04 0.00 -1.62 0.00 0.00 43.42 42.44 3ciy n LEU 106 CO 0.45 1.75 0.17 0.00 -1.22 0.00 0.00 177.39 178.55 3ciy s GLN 107 N -3.22 3.68 -1.23 3.23 -2.07 -1.14 -4.13 119.66 114.79 3ciy s GLN 107 Ca 0.33 0.07 -0.03 0.00 -1.82 0.00 0.00 55.36 53.91 3ciy s GLN 107 Cb 0.44 -2.69 0.00 0.00 -1.09 0.00 0.00 33.01 29.68 3ciy s GLN 107 CO -0.02 0.30 1.05 0.72 -1.32 0.00 0.00 175.29 176.01 3ciy n HIS 108 N -0.49 -2.39 -4.54 9.60 8.25 -1.25 -0.83 115.22 123.56 3ciy n HIS 108 Ca -0.01 0.95 -0.27 0.00 -0.26 0.00 0.00 57.72 58.13 3ciy n HIS 108 Cb 0.53 -5.01 -0.08 0.00 1.12 0.00 0.00 29.99 26.55 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 -3.99 2.96 0.00 0.41 -0.87 -0.22 -3.26 114.94 109.97 3ciy s ASN 109 Ca 0.20 -1.69 0.00 0.00 -1.57 0.00 0.00 52.86 49.80 3ciy s ASN 109 Cb -0.09 0.53 0.00 0.00 -0.02 0.00 0.00 41.25 41.68 3ciy s ASN 109 CO 0.72 -0.94 0.23 -0.62 -2.57 0.00 0.00 177.10 173.92 3ciy n GLU 110 N -0.96 0.00 -3.40 -0.60 -0.58 -1.14 -3.01 120.64 110.95 3ciy n GLU 110 Ca -0.07 0.18 -0.17 0.00 -0.42 0.00 0.00 57.16 56.68 3ciy n GLU 110 Cb 0.65 -0.85 0.00 0.00 -0.57 0.00 0.00 31.44 30.67 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 -1.03 -0.68 -0.15 -4.62 4.77 -1.07 -4.21 117.00 110.01 3ciy n LEU 111 Ca 0.00 -0.57 -0.08 0.00 -0.03 0.00 0.00 56.01 55.33 3ciy n LEU 111 Cb 0.00 -0.83 0.01 0.00 -2.33 0.00 0.00 43.42 40.27 3ciy n LEU 111 CO 0.00 0.28 1.03 0.28 -1.33 0.00 0.00 177.39 177.66 3ciy h SER 112 N 0.25 0.53 -4.73 -1.43 0.02 -1.74 -3.39 113.55 103.05 3ciy h SER 112 Ca -0.35 -0.05 -0.21 0.00 -0.84 0.00 0.00 61.79 60.35 3ciy h SER 112 Cb 0.74 -0.13 -0.15 0.00 0.14 0.00 0.00 62.40 62.99 3ciy h SER 112 CO 0.22 0.42 -0.70 0.00 -1.14 0.00 0.00 176.83 175.63 3ciy s GLN 113 N -6.03 0.77 -0.13 3.45 -2.07 -1.26 -4.08 119.66 110.30 3ciy s GLN 113 Ca -0.13 -1.27 -0.30 0.00 -1.82 0.00 0.00 55.36 51.84 3ciy s GLN 113 Cb 0.11 -0.13 0.12 0.00 -1.09 0.00 0.00 33.01 32.02 3ciy s GLN 113 CO 0.74 -0.03 0.98 -1.50 -1.32 0.00 0.00 175.29 174.16 3ciy s ILE 114 N -3.50 0.00 0.39 3.63 2.07 -1.26 -4.95 121.20 117.58 3ciy s ILE 114 Ca 0.09 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.37 3ciy s ILE 114 Cb 0.05 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.61 3ciy s ILE 114 CO -0.05 0.00 0.11 -0.94 -1.91 0.00 0.00 174.94 172.15 3ciy s SER 115 N -1.43 2.71 0.46 4.50 1.04 -1.26 -4.66 113.70 115.05 3ciy s SER 115 Ca 0.00 -1.62 0.30 0.00 0.48 0.00 0.00 55.95 55.11 3ciy s SER 115 Cb -0.01 0.41 1.40 0.00 0.10 0.00 0.00 66.02 67.92 3ciy s SER 115 CO -0.01 -0.88 1.69 -2.24 0.98 0.00 0.00 173.24 172.78 3ciy h ASP 116 N 1.85 0.23 -0.62 7.02 3.04 -1.84 -2.61 116.42 123.48 3ciy h ASP 116 Ca -0.36 0.09 0.13 0.00 -3.24 0.00 0.00 57.03 53.64 3ciy h ASP 116 Cb 1.27 0.06 -0.10 0.00 -1.04 0.00 0.00 39.33 39.52 3ciy h ASP 116 CO 0.59 -0.06 0.07 1.56 -2.04 0.00 0.00 179.24 179.36 3ciy h GLN 117 N 0.14 0.18 -1.20 4.15 1.08 -1.95 -3.08 115.11 114.43 3ciy h GLN 117 Ca 0.73 -0.01 0.36 0.00 -1.45 0.00 0.00 58.65 58.28 3ciy h GLN 117 Cb 2.38 -0.04 -0.11 0.00 -0.05 0.00 0.00 27.48 29.66 3ciy h GLN 117 CO -0.28 0.12 0.79 0.00 -0.95 0.00 0.00 178.83 178.51 3ciy h THR 118 N 0.18 0.31 -0.11 -0.54 1.03 -1.77 -2.50 112.91 109.51 3ciy h THR 118 Ca 0.33 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.66 3ciy h THR 118 Cb 0.53 0.09 0.00 0.00 -1.07 0.00 0.00 68.15 67.70 3ciy h THR 118 CO -0.48 0.04 0.00 0.49 -0.01 0.00 0.00 175.52 175.56 3ciy n PHE 119 N -4.61 0.15 -0.07 0.00 3.72 -1.17 -4.22 117.46 111.26 3ciy n PHE 119 Ca 0.31 -0.46 0.24 0.00 -0.05 0.00 0.00 57.45 57.50 3ciy n PHE 119 Cb 1.19 -0.04 0.71 0.00 -0.94 0.00 0.00 39.48 40.41 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 0.73 0.60 -0.23 -4.37 2.07 -1.44 0.72 116.25 114.32 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 0.55 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 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 -4.24 0.29 -3.52 1.57 3.01 -1.26 -4.65 117.46 108.66 3ciy n PHE 121 Ca 0.14 -0.15 -0.40 0.00 1.01 0.00 0.00 57.45 58.05 3ciy n PHE 121 Cb 0.78 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.20 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 2.85 0.00 0.58 0.00 -2.24 -1.26 -3.92 114.28 110.29 3ciy n THR 123 Ca 0.19 -0.14 0.11 0.00 -2.27 0.00 0.00 64.05 61.94 3ciy n THR 123 Cb 0.39 0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 69.50 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 -1.44 0.60 -4.66 3.42 3.02 -1.26 -4.15 115.26 110.78 3ciy n ASN 124 Ca 0.03 -0.36 -0.47 0.00 -0.03 0.00 0.00 54.58 53.74 3ciy n ASN 124 Cb 0.27 1.04 -0.04 0.00 -0.61 0.00 0.00 39.78 40.43 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 -1.90 2.87 -0.01 3.41 7.94 -0.95 -4.51 117.00 123.86 3ciy n LEU 125 Ca 0.01 1.09 0.01 0.00 -1.11 0.00 0.00 56.01 56.01 3ciy n LEU 125 Cb 0.43 -1.39 -0.03 0.00 0.53 0.00 0.00 43.42 42.96 3ciy n LEU 125 CO 0.42 -0.40 -0.56 0.35 -1.11 0.00 0.00 177.39 176.08 3ciy n THR 126 N 3.29 0.05 -3.78 1.96 -2.24 0.21 -2.03 114.28 111.73 3ciy n THR 126 Ca 0.17 -0.11 -0.25 0.00 -2.27 0.00 0.00 64.05 61.60 3ciy n THR 126 Cb 0.27 0.15 -0.17 0.00 -2.10 0.00 0.00 70.33 68.48 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 0.77 -0.23 -0.78 2.12 -0.26 0.84 118.70 118.91 3ciy s GLU 127 Ca -0.02 -0.10 -0.01 0.00 0.36 0.00 0.00 54.97 55.21 3ciy s GLU 127 Cb 0.02 -1.38 0.03 0.00 0.26 0.00 0.00 34.13 33.06 3ciy s GLU 127 CO 0.17 -0.39 -0.10 -1.17 -0.54 0.00 0.00 175.26 173.23 3ciy s LEU 128 N 1.90 2.93 -0.23 2.70 2.96 -0.42 -1.55 118.68 126.96 3ciy s LEU 128 Ca 0.03 -0.83 -0.04 0.00 -0.22 0.00 0.00 54.13 53.07 3ciy s LEU 128 Cb -0.14 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 3ciy s LEU 128 CO -0.06 -0.09 -0.02 -0.62 -1.32 0.00 0.00 176.35 174.23 3ciy s ASP 129 N 1.30 4.44 -0.29 3.68 3.68 -0.33 -2.02 116.67 127.14 3ciy s ASP 129 Ca 0.01 -0.45 -0.03 0.00 2.13 0.00 0.00 52.55 54.21 3ciy s ASP 129 Cb -0.16 -1.76 0.11 0.00 -1.45 0.00 0.00 42.92 39.66 3ciy s ASP 129 CO -0.07 -0.05 0.17 -0.76 0.13 0.00 0.00 175.17 174.60 3ciy s LEU 130 N 1.48 0.37 -0.20 -1.34 1.43 -0.28 0.61 118.68 120.74 3ciy s LEU 130 Ca 0.05 -1.20 0.01 0.00 -1.03 0.00 0.00 54.13 51.96 3ciy s LEU 130 Cb -0.15 -0.14 -0.13 0.00 0.03 0.00 0.00 46.19 45.80 3ciy s LEU 130 CO -0.02 -0.42 -0.18 0.80 0.23 0.00 0.00 176.35 176.76 3ciy n MET 131 N 5.21 0.49 -3.54 1.70 1.56 -1.26 -3.27 117.12 118.01 3ciy n MET 131 Ca -0.04 0.12 -0.27 0.00 -0.27 0.00 0.00 57.70 57.24 3ciy n MET 131 Cb 0.43 -1.39 -0.10 0.00 2.15 0.00 0.00 33.22 34.31 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 -3.12 2.03 -0.03 6.12 7.64 -1.26 -3.99 113.62 121.01 3ciy n SER 132 Ca -0.35 -3.02 0.01 0.00 1.01 0.00 0.00 58.87 56.52 3ciy n SER 132 Cb 0.87 -0.67 0.01 0.00 -1.01 0.00 0.00 64.21 63.41 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 1.73 1.24 -3.90 6.43 4.13 -1.16 -1.06 115.26 122.66 3ciy n ASN 133 Ca 0.25 -1.74 -0.26 0.00 1.68 0.00 0.00 54.58 54.51 3ciy n ASN 133 Cb 0.42 -0.05 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 -0.38 -2.01 -4.41 6.41 3.41 -1.25 -3.82 113.62 111.57 3ciy n SER 134 Ca 0.01 -0.73 -0.45 0.00 -0.26 0.00 0.00 58.87 57.44 3ciy n SER 134 Cb 0.39 -0.88 -0.01 0.00 -0.26 0.00 0.00 64.21 63.45 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 -4.14 5.28 0.39 -1.33 1.01 0.46 -4.60 121.20 118.28 3ciy s ILE 135 Ca 0.25 -2.57 0.07 0.00 0.00 0.00 0.00 60.65 58.40 3ciy s ILE 135 Cb -0.14 -4.75 0.28 0.00 0.01 0.00 0.00 42.46 37.87 3ciy s ILE 135 CO 0.55 -1.41 2.01 0.45 0.00 0.00 0.00 174.94 176.54 3ciy h HIS 136 N 7.51 0.64 -3.65 3.97 3.86 -1.64 -3.31 115.15 122.52 3ciy h HIS 136 Ca 0.22 0.02 -0.28 0.00 -1.16 0.00 0.00 60.37 59.16 3ciy h HIS 136 Cb 0.93 -0.21 -0.15 0.00 1.06 0.00 0.00 27.41 29.04 3ciy h HIS 136 CO 1.02 0.37 -0.69 0.15 0.86 0.00 0.00 177.93 179.64 3ciy s LYS 137 N -5.58 1.00 -0.05 2.45 1.02 -1.26 -3.38 119.74 113.94 3ciy s LYS 137 Ca -0.09 -1.44 -0.02 0.00 0.02 0.00 0.00 55.97 54.44 3ciy s LYS 137 Cb 0.18 -0.37 0.03 0.00 -0.52 0.00 0.00 37.83 37.16 3ciy s LYS 137 CO 0.75 -0.03 0.08 0.42 -0.92 0.00 0.00 175.35 175.66 3ciy s ILE 138 N -3.53 -0.14 0.20 2.17 1.01 -1.26 -4.82 121.20 114.82 3ciy s ILE 138 Ca 0.17 0.41 0.07 0.00 0.00 0.00 0.00 60.65 61.30 3ciy s ILE 138 Cb 0.05 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.29 3ciy s ILE 138 CO -0.00 0.17 0.06 -0.75 0.00 0.00 0.00 174.94 174.42 3ciy s LYS 139 N 2.17 2.58 2.74 2.79 2.20 -1.26 -4.90 119.74 126.07 3ciy s LYS 139 Ca 0.04 -1.10 0.00 0.00 -0.36 0.00 0.00 55.97 54.55 3ciy s LYS 139 Cb -0.12 -2.42 0.00 0.00 -1.51 0.00 0.00 37.83 33.78 3ciy s LYS 139 CO -0.04 0.44 0.00 0.45 -0.36 0.00 0.00 175.35 175.84 3ciy n SER 140 N -0.49 -2.38 -3.66 1.43 2.88 -1.26 -4.36 113.62 105.77 3ciy n SER 140 Ca -0.08 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.17 3ciy n SER 140 Cb 0.56 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.93 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 -2.31 3.60 -0.28 -3.46 3.02 -1.26 -3.99 115.26 110.58 3ciy n ASN 141 Ca 0.00 -3.34 0.34 0.00 -0.03 0.00 0.00 54.58 51.55 3ciy n ASN 141 Cb 0.00 -0.74 0.72 0.00 -0.61 0.00 0.00 39.78 39.15 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 4.77 0.00 -0.71 3.52 0.11 -1.77 -2.31 132.00 135.61 3ciy h PRO 142 Ca 0.18 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.78 3ciy h PRO 142 Cb 0.70 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.45 3ciy h PRO 142 CO 0.81 0.00 -0.51 1.19 -0.21 0.00 0.00 178.00 179.28 3ciy n PHE 143 N -3.95 2.52 0.70 0.65 3.01 -1.26 -4.43 117.46 114.69 3ciy n PHE 143 Ca 0.24 -2.25 0.01 0.00 1.01 0.00 0.00 57.45 56.47 3ciy n PHE 143 Cb 1.27 -0.50 0.07 0.00 -0.01 0.00 0.00 39.48 40.31 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 -0.80 0.35 -0.02 -1.08 3.00 -0.87 -3.05 118.16 115.69 3ciy n LYS 144 Ca 0.44 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.69 3ciy n LYS 144 Cb 0.91 -1.11 -0.02 0.00 0.00 0.00 0.00 35.03 34.81 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 -0.61 0.56 -4.59 3.14 3.02 -1.26 -5.00 115.26 110.51 3ciy n ASN 145 Ca 0.02 0.09 -0.45 0.00 -0.03 0.00 0.00 54.58 54.20 3ciy n ASN 145 Cb 0.01 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 38.92 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 -3.34 1.96 -0.00 3.52 6.02 -1.17 -4.69 117.38 119.68 3ciy n GLN 146 Ca -0.10 0.61 0.02 0.00 -0.01 0.00 0.00 57.00 57.51 3ciy n GLN 146 Cb 0.51 -2.95 -0.03 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 8.12 2.28 -0.21 -1.09 4.76 -1.26 -4.39 118.16 126.37 3ciy n LYS 147 Ca 0.30 -0.03 0.06 0.00 -2.87 0.00 0.00 58.31 55.77 3ciy n LYS 147 Cb 0.37 -0.95 0.18 0.00 -1.84 0.00 0.00 35.03 32.79 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 -1.44 3.10 -4.53 4.39 4.13 -1.26 -4.24 115.26 115.41 3ciy n ASN 148 Ca -0.00 -2.04 -0.43 0.00 1.68 0.00 0.00 54.58 53.79 3ciy n ASN 148 Cb 0.10 -0.28 -0.05 0.00 -1.54 0.00 0.00 39.78 38.02 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 -1.07 4.22 -0.11 3.41 2.96 -0.86 -3.69 118.68 123.54 3ciy s LEU 149 Ca 0.27 -0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 53.88 3ciy s LEU 149 Cb 0.15 -2.92 -0.03 0.00 0.50 0.00 0.00 46.19 43.89 3ciy s LEU 149 CO 0.18 -1.04 -0.16 -0.38 -1.32 0.00 0.00 176.35 173.63 3ciy n ILE 150 N 6.16 1.05 -2.53 6.68 5.41 0.25 -4.31 119.36 132.07 3ciy n ILE 150 Ca 0.02 0.28 -0.42 0.00 1.00 0.00 0.00 62.75 63.63 3ciy n ILE 150 Cb 0.48 -2.14 -0.03 0.00 -0.71 0.00 0.00 39.64 37.23 3ciy n ILE 150 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3ciy s LYS 151 N -2.04 4.53 -0.42 0.38 1.02 -1.17 -2.09 119.74 119.96 3ciy s LYS 151 Ca -0.14 1.66 0.04 0.00 0.02 0.00 0.00 55.97 57.56 3ciy s LYS 151 Cb 0.02 -3.34 0.17 0.00 -0.52 0.00 0.00 37.83 34.15 3ciy s LYS 151 CO 0.20 -0.07 0.39 -1.17 -0.92 0.00 0.00 175.35 173.79 3ciy s LEU 152 N 0.47 0.70 -0.40 3.17 1.98 0.02 -1.30 118.68 123.33 3ciy s LEU 152 Ca 0.53 -2.57 -0.24 0.00 -2.89 0.00 0.00 54.13 48.96 3ciy s LEU 152 Cb -0.27 0.08 0.02 0.00 0.66 0.00 0.00 46.19 46.67 3ciy s LEU 152 CO 0.31 -0.18 0.81 -0.62 -1.89 0.00 0.00 176.35 174.78 3ciy s ASP 153 N 0.47 6.52 -0.49 3.68 -1.08 -0.86 -2.06 116.67 122.86 3ciy s ASP 153 Ca 0.29 0.23 0.03 0.00 -0.52 0.00 0.00 52.55 52.58 3ciy s ASP 153 Cb -0.02 -2.40 0.16 0.00 -1.46 0.00 0.00 42.92 39.19 3ciy s ASP 153 CO -0.13 -0.82 0.34 -0.22 0.52 0.00 0.00 175.17 174.85 3ciy s LEU 154 N 3.25 2.63 0.11 -1.34 0.20 0.73 -1.13 118.68 123.14 3ciy s LEU 154 Ca 0.32 -3.05 0.04 0.00 0.69 0.00 0.00 54.13 52.13 3ciy s LEU 154 Cb -0.12 -0.92 -0.04 0.00 -0.43 0.00 0.00 46.19 44.68 3ciy s LEU 154 CO 0.20 -0.19 -0.11 -0.44 -0.29 0.00 0.00 176.35 175.51 3ciy s SER 155 N -0.15 1.65 -1.96 3.68 0.01 -1.20 -3.82 113.70 111.90 3ciy s SER 155 Ca 0.25 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.68 3ciy s SER 155 Cb -0.09 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.12 3ciy s SER 155 CO -0.11 -0.23 0.00 1.57 0.41 0.00 0.00 173.24 174.88 3ciy n HIS 156 N 0.48 -0.09 -0.44 2.43 -0.00 -0.77 -4.26 115.22 112.57 3ciy n HIS 156 Ca -0.15 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 57.66 3ciy n HIS 156 Cb 0.58 -3.24 0.30 0.00 -0.00 0.00 0.00 29.99 27.62 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 -1.10 4.00 0.00 0.26 5.03 -1.26 -4.15 115.26 118.04 3ciy n ASN 157 Ca -0.19 -2.19 0.00 0.00 0.87 0.00 0.00 54.58 53.07 3ciy n ASN 157 Cb 0.62 -0.47 0.00 0.00 -1.02 0.00 0.00 39.78 38.92 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 1.14 0.61 3.75 7.41 0.00 -1.26 0.18 105.19 117.01 3ciy n GLY 158 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.25 -4.22 118.68 120.56 3ciy s LEU 159 Ca 0.00 2.96 0.13 0.00 0.01 0.00 0.00 54.13 57.23 3ciy s LEU 159 Cb 0.00 -3.64 -0.14 0.00 0.01 0.00 0.00 46.19 42.42 3ciy s LEU 159 CO 0.00 -0.92 0.53 -0.24 1.01 0.00 0.00 176.35 176.73 3ciy n SER 160 N 2.16 0.65 -4.12 2.29 2.88 -1.22 -1.87 113.62 114.39 3ciy n SER 160 Ca 0.08 -0.77 -0.09 0.00 -1.33 0.00 0.00 58.87 56.76 3ciy n SER 160 Cb 0.37 1.02 -0.10 0.00 -0.75 0.00 0.00 64.21 64.75 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 -2.25 0.75 -0.05 -3.46 0.15 -1.26 -4.05 113.70 103.52 3ciy s SER 161 Ca 0.04 -1.01 0.12 0.00 0.70 0.00 0.00 55.95 55.80 3ciy s SER 161 Cb 0.10 0.16 -0.23 0.00 -1.71 0.00 0.00 66.02 64.33 3ciy s SER 161 CO 0.52 -0.55 0.62 0.35 1.20 0.00 0.00 173.24 175.39 3ciy n THR 162 N 0.04 1.61 -1.56 6.45 -2.24 -1.26 -4.95 114.28 112.37 3ciy n THR 162 Ca -0.13 -0.79 -0.50 0.00 -2.27 0.00 0.00 64.05 60.36 3ciy n THR 162 Cb 0.61 -1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 67.75 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 -3.05 1.00 -0.26 -0.78 4.81 -1.12 -4.87 118.16 113.88 3ciy n LYS 163 Ca -0.18 0.36 0.01 0.00 -0.87 0.00 0.00 58.31 57.63 3ciy n LYS 163 Cb 1.06 -1.84 0.02 0.00 0.02 0.00 0.00 35.03 34.28 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 2.02 0.43 0.00 3.14 4.77 -1.26 -4.85 117.00 121.25 3ciy n LEU 164 Ca 0.16 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 3ciy n LEU 164 Cb 0.23 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3ciy n LEU 164 CO 0.61 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 3ciy n GLY 165 N -0.21 2.19 0.00 -0.72 0.00 -1.26 -4.42 105.19 100.79 3ciy n GLY 165 Ca 0.02 -1.08 0.05 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.01 0.00 -3.58 2.61 -2.24 -1.26 -4.60 114.28 104.20 3ciy n THR 166 Ca 0.00 -0.25 -0.20 0.00 -2.27 0.00 0.00 64.05 61.33 3ciy n THR 166 Cb 0.00 0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 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 -2.61 1.48 -0.70 3.38 0.00 -1.26 -4.81 107.32 102.79 3ciy s GLY 167 Ca -0.00 -1.36 -0.24 0.00 0.00 0.00 0.00 44.72 43.12 3ciy s GLY 167 CO 0.43 -1.30 1.10 0.14 0.00 0.00 0.00 173.10 173.47 3ciy s VAL 168 N -2.14 4.08 0.15 1.40 1.01 -1.26 -4.60 120.40 119.03 3ciy s VAL 168 Ca 0.42 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.35 3ciy s VAL 168 Cb -0.09 -4.79 -0.00 0.00 0.00 0.00 0.00 36.38 31.49 3ciy s VAL 168 CO 0.31 -1.63 0.04 0.00 0.00 0.00 0.00 175.10 173.82 3ciy n GLN 169 N 8.40 0.94 -2.90 2.72 10.64 -1.03 -4.86 117.38 131.28 3ciy n GLN 169 Ca -0.00 -1.24 -0.09 0.00 -1.83 0.00 0.00 57.00 53.84 3ciy n GLN 169 Cb 0.47 0.61 0.04 0.00 -0.86 0.00 0.00 30.24 30.50 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 -5.29 -0.25 2.61 7.99 -1.26 -4.70 117.00 116.10 3ciy n LEU 170 Ca -0.03 -0.44 -0.10 0.00 -0.01 0.00 0.00 56.01 55.43 3ciy n LEU 170 Cb 0.22 -2.79 -0.08 0.00 -0.11 0.00 0.00 43.42 40.65 3ciy n LEU 170 CO 0.12 -0.20 0.49 -0.33 -1.51 0.00 0.00 177.39 175.95 3ciy h GLU 171 N -0.53 -0.13 -4.18 3.23 4.39 -1.83 -3.33 114.58 112.19 3ciy h GLU 171 Ca -0.36 0.01 -0.67 0.00 0.34 0.00 0.00 59.36 58.68 3ciy h GLU 171 Cb 1.18 0.03 -0.38 0.00 -0.10 0.00 0.00 28.75 29.48 3ciy h GLU 171 CO 0.33 -0.09 -0.62 -0.80 -1.16 0.00 0.00 179.01 176.68 3ciy s ASN 172 N -4.88 4.82 -0.06 1.42 0.01 -1.26 -4.32 114.94 110.66 3ciy s ASN 172 Ca -0.11 -2.44 0.04 0.00 -0.71 0.00 0.00 52.86 49.65 3ciy s ASN 172 Cb 0.08 -1.70 -0.00 0.00 0.41 0.00 0.00 41.25 40.04 3ciy s ASN 172 CO 0.51 -0.38 -0.19 -0.22 -1.51 0.00 0.00 177.10 175.31 3ciy s LEU 173 N 0.53 1.94 0.00 0.60 2.96 -1.25 -4.10 118.68 119.35 3ciy s LEU 173 Ca 0.13 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3ciy s LEU 173 Cb -0.22 -1.12 0.01 0.00 0.50 0.00 0.00 46.19 45.36 3ciy s LEU 173 CO -0.05 0.15 0.42 0.00 -1.32 0.00 0.00 176.35 175.56 3ciy n GLN 174 N 3.28 1.65 -3.45 1.98 6.02 -1.12 -3.66 117.38 122.07 3ciy n GLN 174 Ca -0.19 -0.44 -0.07 0.00 -0.01 0.00 0.00 57.00 56.29 3ciy n GLN 174 Cb 0.53 -0.90 -0.08 0.00 1.02 0.00 0.00 30.24 30.81 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 -0.55 0.37 -0.47 -1.09 2.02 -0.89 -1.17 118.70 116.93 3ciy s GLU 175 Ca 0.02 0.81 0.02 0.00 0.02 0.00 0.00 54.97 55.83 3ciy s GLU 175 Cb 0.02 -0.02 0.12 0.00 0.10 0.00 0.00 34.13 34.36 3ciy s GLU 175 CO 0.05 -0.48 0.22 -1.17 0.02 0.00 0.00 175.26 173.91 3ciy s LEU 176 N 2.62 4.79 -0.39 1.80 2.96 -1.01 -0.79 118.68 128.65 3ciy s LEU 176 Ca 0.08 -2.55 -0.22 0.00 -0.22 0.00 0.00 54.13 51.22 3ciy s LEU 176 Cb -0.14 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.85 3ciy s LEU 176 CO -0.15 -0.36 0.71 -0.76 -1.32 0.00 0.00 176.35 174.47 3ciy s LEU 177 N 0.37 4.25 -0.36 -0.68 1.02 -0.87 -2.36 118.68 120.05 3ciy s LEU 177 Ca 0.14 0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.36 3ciy s LEU 177 Cb -0.22 -2.88 0.14 0.00 0.02 0.00 0.00 46.19 43.25 3ciy s LEU 177 CO -0.04 -0.73 0.21 -0.76 0.02 0.00 0.00 176.35 175.05 3ciy s LEU 178 N 2.96 1.10 0.16 1.79 1.43 -1.13 -0.19 118.68 124.79 3ciy s LEU 178 Ca 0.27 -2.20 -0.02 0.00 -1.03 0.00 0.00 54.13 51.15 3ciy s LEU 178 Cb -0.14 -0.44 -0.04 0.00 0.03 0.00 0.00 46.19 45.60 3ciy s LEU 178 CO 0.18 -0.31 0.10 0.00 0.23 0.00 0.00 176.35 176.55 3ciy s ALA 179 N 1.04 0.91 -1.73 4.21 0.00 -1.26 -3.07 121.76 121.85 3ciy s ALA 179 Ca 0.18 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.63 3ciy s ALA 179 Cb -0.23 1.05 0.00 0.00 0.00 0.00 0.00 23.12 23.94 3ciy s ALA 179 CO 0.00 -0.54 0.00 1.63 0.00 0.00 0.00 175.76 176.86 3ciy n LYS 180 N -0.16 -1.54 -3.01 0.00 5.02 0.32 -1.84 118.16 116.94 3ciy n LYS 180 Ca -0.03 1.05 -0.19 0.00 -2.02 0.00 0.00 58.31 57.11 3ciy n LYS 180 Cb 0.64 -5.42 0.05 0.00 -0.02 0.00 0.00 35.03 30.28 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 -1.18 2.11 -2.47 4.39 3.02 -1.26 -3.51 115.26 116.37 3ciy n ASN 181 Ca -0.16 -2.51 -0.30 0.00 -0.03 0.00 0.00 54.58 51.58 3ciy n ASN 181 Cb 0.62 -0.33 0.02 0.00 -0.61 0.00 0.00 39.78 39.49 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 -2.09 3.23 -2.56 3.52 5.02 -0.78 -3.91 118.16 120.58 3ciy n LYS 182 Ca 0.12 -4.07 -0.42 0.00 -2.02 0.00 0.00 58.31 51.92 3ciy n LYS 182 Cb 0.57 -2.27 -0.03 0.00 -0.02 0.00 0.00 35.03 33.28 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 -5.16 4.31 -0.14 -0.18 1.09 -1.25 -4.44 121.20 115.44 3ciy s ILE 183 Ca 0.51 1.74 0.19 0.00 -1.10 0.00 0.00 60.65 61.99 3ciy s ILE 183 Cb 0.42 -4.11 -0.16 0.00 -1.06 0.00 0.00 42.46 37.55 3ciy s ILE 183 CO -0.18 0.18 0.71 0.18 -0.10 0.00 0.00 174.94 175.73 3ciy n LEU 184 N 3.51 0.58 -3.80 2.97 4.32 -1.26 -3.33 117.00 120.00 3ciy n LEU 184 Ca 0.06 0.24 -0.03 0.00 -0.02 0.00 0.00 56.01 56.26 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 0.78 0.00 -1.22 0.00 0.00 177.39 177.57 3ciy s ALA 185 N -3.09 -1.65 -0.06 -1.18 0.00 -1.26 -2.15 121.76 112.37 3ciy s ALA 185 Ca -0.04 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 51.91 3ciy s ALA 185 Cb 0.10 0.67 0.01 0.00 0.00 0.00 0.00 23.12 23.89 3ciy s ALA 185 CO 0.83 -1.05 -0.15 -0.51 0.00 0.00 0.00 175.76 174.88 3ciy s LEU 186 N -3.13 1.77 0.24 0.00 1.02 -1.18 -4.82 118.68 112.59 3ciy s LEU 186 Ca 0.16 -0.33 0.11 0.00 0.02 0.00 0.00 54.13 54.09 3ciy s LEU 186 Cb -0.01 -0.91 -0.05 0.00 0.02 0.00 0.00 46.19 45.24 3ciy s LEU 186 CO 0.03 0.08 -0.17 -0.13 0.02 0.00 0.00 176.35 176.18 3ciy s ARG 187 N 0.43 1.78 0.00 1.70 0.52 -1.26 -1.37 118.95 120.74 3ciy s ARG 187 Ca -0.11 -1.59 0.13 0.00 -0.52 0.00 0.00 55.73 53.64 3ciy s ARG 187 Cb -0.14 -1.90 0.69 0.00 0.52 0.00 0.00 34.95 34.12 3ciy s ARG 187 CO 0.04 0.37 1.32 0.45 0.02 0.00 0.00 175.30 177.49 3ciy n SER 188 N -0.35 0.00 -0.12 0.23 2.88 -1.26 -2.98 113.62 112.02 3ciy n SER 188 Ca -0.08 -0.01 -0.24 0.00 -1.33 0.00 0.00 58.87 57.22 3ciy n SER 188 Cb 0.58 -0.23 -0.09 0.00 -0.75 0.00 0.00 64.21 63.72 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 -1.23 0.53 -0.07 -1.46 1.02 -1.26 -3.87 120.64 114.30 3ciy n GLU 189 Ca 0.07 0.20 0.07 0.00 -0.02 0.00 0.00 57.16 57.48 3ciy n GLU 189 Cb 0.09 -1.39 0.28 0.00 -0.02 0.00 0.00 31.44 30.40 3ciy n GLU 189 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3ciy n GLU 190 N -3.86 1.44 -0.02 3.49 0.28 -1.23 -3.58 120.64 117.16 3ciy n GLU 190 Ca -0.46 -0.68 0.00 0.00 -0.16 0.00 0.00 57.16 55.86 3ciy n GLU 190 Cb 0.87 -1.26 -0.06 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 -0.03 0.00 0.00 -1.84 7.99 -1.16 -2.81 117.00 119.15 3ciy n LEU 191 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.11 3ciy n LEU 191 Cb 0.19 0.08 0.00 0.00 -0.11 0.00 0.00 43.42 43.58 3ciy n LEU 191 CO 0.08 0.08 0.43 -1.84 -1.51 0.00 0.00 177.39 174.63 3ciy n GLU 192 N -1.99 0.00 0.00 3.23 0.28 -1.23 -2.82 120.64 118.11 3ciy n GLU 192 Ca -0.06 0.35 0.03 0.00 -0.16 0.00 0.00 57.16 57.32 3ciy n GLU 192 Cb 0.44 -1.52 0.21 0.00 1.43 0.00 0.00 31.44 32.00 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 -1.34 0.00 -3.90 -1.84 1.16 -1.26 -3.93 117.46 106.35 3ciy n PHE 193 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.25 3ciy n PHE 193 Cb 0.02 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.76 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 -1.75 4.97 -0.17 5.98 1.43 -1.13 -2.47 118.68 125.54 3ciy s LEU 194 Ca 0.10 -2.19 -0.15 0.00 -1.03 0.00 0.00 54.13 50.87 3ciy s LEU 194 Cb 0.05 -1.72 -0.10 0.00 0.03 0.00 0.00 46.19 44.44 3ciy s LEU 194 CO 0.08 -0.44 0.01 1.23 0.23 0.00 0.00 176.35 177.46 3ciy h GLY 195 N 7.70 0.00 -0.04 -3.19 0.00 -1.82 -3.19 103.07 102.54 3ciy h GLY 195 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 3ciy h GLY 195 CO 0.61 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.31 3ciy n ASN 196 N -4.54 2.27 -4.69 0.19 0.23 -1.26 -3.99 115.26 103.47 3ciy n ASN 196 Ca -0.18 -2.75 -0.42 0.00 -0.53 0.00 0.00 54.58 50.69 3ciy n ASN 196 Cb 0.45 -0.30 -0.03 0.00 -2.08 0.00 0.00 39.78 37.82 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 -2.29 6.93 -0.35 0.53 0.01 -1.26 -4.84 113.70 112.43 3ciy s SER 197 Ca 0.23 2.04 0.02 0.00 1.31 0.00 0.00 55.95 59.55 3ciy s SER 197 Cb 0.20 -2.56 0.10 0.00 0.21 0.00 0.00 66.02 63.96 3ciy s SER 197 CO 0.02 -0.64 0.08 -0.55 0.41 0.00 0.00 173.24 172.56 3ciy s SER 198 N 1.59 4.88 -0.04 2.44 0.15 -1.26 -1.99 113.70 119.48 3ciy s SER 198 Ca 0.61 -2.05 -0.29 0.00 0.70 0.00 0.00 55.95 54.91 3ciy s SER 198 Cb -0.30 -1.68 -0.02 0.00 -1.71 0.00 0.00 66.02 62.31 3ciy s SER 198 CO 0.26 -0.41 0.97 -0.76 1.20 0.00 0.00 173.24 174.50 3ciy s LEU 199 N 0.99 4.32 -0.05 3.45 1.43 -0.77 -4.43 118.68 123.62 3ciy s LEU 199 Ca 0.09 1.58 -0.07 0.00 -1.03 0.00 0.00 54.13 54.70 3ciy s LEU 199 Cb -0.20 -3.53 -0.29 0.00 0.03 0.00 0.00 46.19 42.20 3ciy s LEU 199 CO -0.07 -0.31 0.67 -0.09 0.23 0.00 0.00 176.35 176.78 3ciy h ARG 200 N 6.90 0.31 -3.27 1.70 2.43 -1.56 -2.00 114.38 118.89 3ciy h ARG 200 Ca -0.38 -0.53 -0.49 0.00 -0.81 0.00 0.00 59.98 57.77 3ciy h ARG 200 Cb 1.19 0.20 -0.40 0.00 -0.42 0.00 0.00 29.97 30.54 3ciy h ARG 200 CO 0.78 1.20 -0.76 0.21 -1.51 0.00 0.00 179.97 179.90 3ciy s LYS 201 N -2.59 0.33 -0.41 0.20 2.20 -0.31 -0.85 119.74 118.31 3ciy s LYS 201 Ca -0.15 -0.25 -0.03 0.00 -0.36 0.00 0.00 55.97 55.19 3ciy s LYS 201 Cb 0.06 -1.95 0.11 0.00 -1.51 0.00 0.00 37.83 34.54 3ciy s LYS 201 CO 0.84 -0.66 0.21 -1.17 -0.36 0.00 0.00 175.35 174.21 3ciy s LEU 202 N 2.01 5.27 0.34 5.43 2.96 -1.17 -2.40 118.68 131.11 3ciy s LEU 202 Ca 0.01 -2.01 -0.26 0.00 -0.22 0.00 0.00 54.13 51.65 3ciy s LEU 202 Cb -0.16 -1.84 -0.10 0.00 0.50 0.00 0.00 46.19 44.58 3ciy s LEU 202 CO -0.09 -0.55 0.97 -0.62 -1.32 0.00 0.00 176.35 174.74 3ciy s ASP 203 N 1.88 7.22 -0.39 3.68 3.68 -1.00 -2.35 116.67 129.40 3ciy s ASP 203 Ca 0.08 1.88 0.10 0.00 2.13 0.00 0.00 52.55 56.74 3ciy s ASP 203 Cb -0.23 -2.58 0.40 0.00 -1.45 0.00 0.00 42.92 39.06 3ciy s ASP 203 CO -0.04 -0.15 1.29 0.18 0.13 0.00 0.00 175.17 176.57 3ciy n LEU 204 N 0.42 -1.37 -4.92 -1.34 4.77 -0.00 -2.86 117.00 111.71 3ciy n LEU 204 Ca 0.03 -3.51 -0.26 0.00 -0.03 0.00 0.00 56.01 52.23 3ciy n LEU 204 Cb 0.50 0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.71 3ciy n LEU 204 CO 0.44 1.85 0.43 -0.44 -1.33 0.00 0.00 177.39 178.35 3ciy s SER 205 N -1.52 6.04 0.00 -1.43 0.01 -1.03 -4.21 113.70 111.56 3ciy s SER 205 Ca 0.23 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.27 3ciy s SER 205 Cb 0.41 -2.02 0.00 0.00 0.21 0.00 0.00 66.02 64.62 3ciy s SER 205 CO -0.07 -0.70 0.00 -1.20 0.41 0.00 0.00 173.24 171.68 3ciy n SER 206 N -2.30 0.00 -4.68 2.44 7.64 -0.07 0.12 113.62 116.77 3ciy n SER 206 Ca 0.01 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.47 3ciy n SER 206 Cb 0.56 -2.20 -0.02 0.00 -1.01 0.00 0.00 64.21 61.54 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 -1.85 7.05 -1.20 6.43 0.01 -1.25 -4.53 114.94 119.59 3ciy s ASN 207 Ca 0.00 1.71 -0.14 0.00 -0.71 0.00 0.00 52.86 53.72 3ciy s ASN 207 Cb 0.00 -2.55 -0.06 0.00 0.41 0.00 0.00 41.25 39.05 3ciy s ASN 207 CO 0.00 -0.62 2.27 -0.81 -1.51 0.00 0.00 177.10 176.43 3ciy n PRO 208 N 5.65 2.51 -2.60 -0.60 -0.04 -1.21 -4.50 135.00 134.21 3ciy n PRO 208 Ca 0.12 -2.10 -0.42 0.00 -0.04 0.00 0.00 63.50 61.05 3ciy n PRO 208 Cb 0.46 -2.94 -0.03 0.00 -0.04 0.00 0.00 33.50 30.95 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 1.13 4.42 -0.00 1.53 1.43 -1.23 -4.41 118.68 121.54 3ciy s LEU 209 Ca 0.53 1.86 0.03 0.00 -1.03 0.00 0.00 54.13 55.53 3ciy s LEU 209 Cb 0.14 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 3ciy s LEU 209 CO -0.02 -0.27 0.08 0.29 0.23 0.00 0.00 176.35 176.66 3ciy n LYS 210 N 3.41 1.15 -3.71 1.70 5.02 -0.91 -4.85 118.16 119.96 3ciy n LYS 210 Ca 0.06 -0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.19 3ciy n LYS 210 Cb 0.48 -0.99 -0.09 0.00 -0.02 0.00 0.00 35.03 34.41 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 -2.04 0.55 -0.76 1.97 -1.05 -1.25 -5.00 118.70 111.12 3ciy s GLU 211 Ca -0.01 0.66 -0.03 0.00 -0.15 0.00 0.00 54.97 55.44 3ciy s GLU 211 Cb 0.02 0.27 0.19 0.00 -0.44 0.00 0.00 34.13 34.17 3ciy s GLU 211 CO 0.12 -0.07 0.62 -0.06 0.95 0.00 0.00 175.26 176.83 3ciy s PHE 212 N 0.26 3.65 0.04 4.83 0.08 -1.26 -3.13 117.98 122.45 3ciy s PHE 212 Ca -0.00 -2.84 -0.38 0.00 0.12 0.00 0.00 56.93 53.82 3ciy s PHE 212 Cb -0.03 -3.24 -0.19 0.00 -0.57 0.00 0.00 43.02 38.99 3ciy s PHE 212 CO 0.01 -0.79 1.08 0.45 -0.10 0.00 0.00 175.22 175.86 3ciy n SER 213 N 2.93 0.26 -4.45 1.36 2.88 -0.47 -4.77 113.62 111.35 3ciy n SER 213 Ca 0.15 1.15 -0.46 0.00 -1.33 0.00 0.00 58.87 58.38 3ciy n SER 213 Cb 0.38 -0.99 -0.02 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 1.66 0.40 -2.26 -1.46 -0.04 -1.26 -2.08 135.00 129.96 3ciy n PRO 214 Ca 0.19 0.14 -0.16 0.00 -0.04 0.00 0.00 63.50 63.63 3ciy n PRO 214 Cb 0.12 -1.26 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 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 1.80 -0.19 0.18 0.55 0.00 -1.26 -4.29 105.19 101.99 3ciy n GLY 215 Ca 0.15 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.32 0.00 0.20 0.00 3.72 -1.26 -4.67 117.46 115.13 3ciy n PHE 217 Ca 0.09 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.55 3ciy n PHE 217 Cb 0.12 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 38.94 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 -0.90 0.06 0.00 -1.08 1.13 -1.23 -1.07 117.38 114.30 3ciy n GLN 218 Ca 0.00 0.47 0.12 0.00 -1.94 0.00 0.00 57.00 55.65 3ciy n GLN 218 Cb 0.11 -1.66 0.15 0.00 0.11 0.00 0.00 30.24 28.94 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 -1.79 0.00 -3.31 5.09 -2.24 -1.25 -4.87 114.28 105.92 3ciy n THR 219 Ca 0.01 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.32 3ciy n THR 219 Cb 0.08 0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 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 -2.77 5.12 0.02 2.28 1.01 -0.23 -4.51 121.20 122.12 3ciy s ILE 220 Ca 0.15 1.01 -0.05 0.00 0.00 0.00 0.00 60.65 61.76 3ciy s ILE 220 Cb 0.18 -3.83 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 3ciy s ILE 220 CO 0.67 0.37 1.09 1.23 0.00 0.00 0.00 174.94 178.29 3ciy h GLY 221 N 6.30 -2.33 -6.47 6.18 0.00 -1.38 -3.41 103.07 101.96 3ciy h GLY 221 Ca -0.43 1.06 -0.16 0.00 0.00 0.00 0.00 47.33 47.80 3ciy h GLY 221 CO 0.73 -0.83 -0.49 0.54 0.00 0.00 0.00 176.54 176.49 3ciy s LYS 222 N -3.40 0.34 -0.46 4.80 1.02 -1.02 -4.95 119.74 116.07 3ciy s LYS 222 Ca -0.02 0.50 -0.12 0.00 0.02 0.00 0.00 55.97 56.35 3ciy s LYS 222 Cb 0.02 -0.52 0.09 0.00 -0.52 0.00 0.00 37.83 36.90 3ciy s LYS 222 CO 0.10 -0.66 0.35 -1.17 -0.92 0.00 0.00 175.35 173.05 3ciy s LEU 223 N 2.53 5.52 -0.01 3.17 2.96 -1.26 -1.85 118.68 129.74 3ciy s LEU 223 Ca 0.12 -1.54 -0.01 0.00 -0.22 0.00 0.00 54.13 52.49 3ciy s LEU 223 Cb -0.15 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 3ciy s LEU 223 CO -0.16 -0.64 0.22 -0.26 -1.32 0.00 0.00 176.35 174.19 3ciy h PHE 224 N 8.59 -0.02 -2.17 5.38 0.04 -1.51 -2.53 116.94 124.72 3ciy h PHE 224 Ca -0.25 -0.00 -0.44 0.00 2.80 0.00 0.00 57.97 60.07 3ciy h PHE 224 Cb 1.09 0.01 0.02 0.00 2.20 0.00 0.00 35.95 39.27 3ciy h PHE 224 CO 0.64 -0.01 -0.21 0.00 -0.60 0.00 0.00 178.31 178.13 3ciy s ALA 225 N -3.02 4.07 -0.13 2.45 0.00 -0.03 -0.58 121.76 124.50 3ciy s ALA 225 Ca -0.00 -1.33 -0.29 0.00 0.00 0.00 0.00 51.96 50.34 3ciy s ALA 225 Cb 0.00 -1.88 0.07 0.00 0.00 0.00 0.00 23.12 21.31 3ciy s ALA 225 CO 0.01 -0.28 0.70 -1.17 0.00 0.00 0.00 175.76 175.02 3ciy s LEU 226 N -4.41 -0.69 -0.35 0.00 2.96 -1.11 -3.07 118.68 112.01 3ciy s LEU 226 Ca 0.49 1.00 0.00 0.00 -0.22 0.00 0.00 54.13 55.40 3ciy s LEU 226 Cb -0.10 2.51 0.14 0.00 0.50 0.00 0.00 46.19 49.24 3ciy s LEU 226 CO 0.35 -0.47 0.24 -0.76 -1.32 0.00 0.00 176.35 174.38 3ciy s LEU 227 N -0.59 0.71 -0.34 -0.68 1.43 -0.99 -2.63 118.68 115.58 3ciy s LEU 227 Ca -0.07 -1.96 0.02 0.00 -1.03 0.00 0.00 54.13 51.09 3ciy s LEU 227 Cb -0.02 -0.19 0.43 0.00 0.03 0.00 0.00 46.19 46.45 3ciy s LEU 227 CO 0.07 -0.31 1.71 0.18 0.23 0.00 0.00 176.35 178.23 3ciy n LEU 228 N 4.22 5.87 -4.58 1.79 4.77 -0.77 -0.82 117.00 127.48 3ciy n LEU 228 Ca 0.10 -3.11 -0.44 0.00 -0.03 0.00 0.00 56.01 52.53 3ciy n LEU 228 Cb 0.39 -0.79 -0.01 0.00 -2.33 0.00 0.00 43.42 40.68 3ciy n LEU 228 CO 0.12 0.97 0.52 0.59 -1.33 0.00 0.00 177.39 178.26 3ciy n ASN 229 N -0.55 1.07 -3.67 -1.43 3.02 -1.25 -3.37 115.26 109.09 3ciy n ASN 229 Ca 0.42 1.12 -0.25 0.00 -0.03 0.00 0.00 54.58 55.84 3ciy n ASN 229 Cb 1.17 -1.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 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 1.07 -4.49 -0.00 6.41 4.05 0.89 -0.89 115.26 122.29 3ciy n ASN 230 Ca 0.10 -0.83 0.00 0.00 0.45 0.00 0.00 54.58 54.30 3ciy n ASN 230 Cb 0.34 -1.47 0.00 0.00 1.23 0.00 0.00 39.78 39.88 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 -2.23 1.44 -3.34 5.20 0.00 -1.22 -1.56 120.51 118.81 3ciy n ALA 231 Ca -0.28 -0.73 -0.25 0.00 0.00 0.00 0.00 53.44 52.18 3ciy n ALA 231 Cb 0.65 -0.01 0.02 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.22 -1.94 -4.06 0.00 6.02 -1.26 -4.06 117.38 111.86 3ciy n GLN 232 Ca 0.00 1.51 -0.34 0.00 -0.01 0.00 0.00 57.00 58.16 3ciy n GLN 232 Cb 0.40 -3.38 -0.10 0.00 1.02 0.00 0.00 30.24 28.18 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 -3.04 3.76 0.47 1.08 1.02 -1.26 -4.88 118.68 115.84 3ciy s LEU 233 Ca 0.25 0.07 -0.12 0.00 0.02 0.00 0.00 54.13 54.35 3ciy s LEU 233 Cb -0.04 -1.94 -0.07 0.00 0.02 0.00 0.00 46.19 44.17 3ciy s LEU 233 CO 0.84 0.19 0.88 0.21 0.02 0.00 0.00 176.35 178.49 3ciy s ASN 234 N 0.27 6.51 0.58 2.29 2.47 -1.26 -3.07 114.94 122.73 3ciy s ASN 234 Ca 0.03 1.31 0.28 0.00 0.42 0.00 0.00 52.86 54.91 3ciy s ASN 234 Cb -0.12 -2.40 1.52 0.00 -1.45 0.00 0.00 41.25 38.79 3ciy s ASN 234 CO 0.01 -0.53 1.97 -0.65 -3.72 0.00 0.00 177.10 174.17 3ciy h PRO 235 N 0.89 0.00 0.00 0.43 0.11 -1.88 0.16 132.00 131.72 3ciy h PRO 235 Ca -0.47 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 3ciy h PRO 235 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3ciy h PRO 235 CO 0.63 0.00 -0.61 1.25 -0.21 0.00 0.00 178.00 179.06 3ciy h HIS 236 N 0.00 0.00 -0.98 0.65 2.76 -1.96 -0.32 115.15 115.29 3ciy h HIS 236 Ca 0.19 0.00 0.21 0.00 -2.20 0.00 0.00 60.37 58.57 3ciy h HIS 236 Cb 0.98 0.00 -0.11 0.00 1.55 0.00 0.00 27.41 29.82 3ciy h HIS 236 CO 0.00 1.14 0.57 -0.07 -1.30 0.00 0.00 177.93 178.27 3ciy h LEU 237 N -1.00 0.68 0.71 0.26 4.07 -1.76 1.79 115.31 120.07 3ciy h LEU 237 Ca -0.16 0.12 -0.03 0.00 0.08 0.00 0.00 57.88 57.88 3ciy h LEU 237 Cb 1.07 0.01 0.01 0.00 1.08 0.00 0.00 40.66 42.83 3ciy h LEU 237 CO -0.10 0.18 -0.34 0.74 -1.08 0.00 0.00 178.44 177.84 3ciy h THR 238 N 0.65 0.01 -0.91 0.22 2.02 -0.81 0.51 112.91 114.60 3ciy h THR 238 Ca 0.60 -0.30 0.23 0.00 0.77 0.00 0.00 66.41 67.70 3ciy h THR 238 Cb 1.03 0.02 -0.13 0.00 -1.74 0.00 0.00 68.15 67.33 3ciy h THR 238 CO -0.43 0.00 0.41 -0.08 0.37 0.00 0.00 175.52 175.79 3ciy h GLU 239 N -1.25 0.40 0.22 6.66 4.81 0.92 -1.92 114.58 124.41 3ciy h GLU 239 Ca -0.10 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3ciy h GLU 239 Cb 0.73 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.03 3ciy h GLU 239 CO 0.16 0.26 -0.10 -0.22 -0.73 0.00 0.00 179.01 178.38 3ciy h LYS 240 N 0.41 -0.28 -1.31 1.92 3.64 0.27 -3.27 116.57 117.95 3ciy h LYS 240 Ca 0.57 0.02 0.42 0.00 -1.27 0.00 0.00 60.65 60.39 3ciy h LYS 240 Cb 1.10 0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 32.86 3ciy h LYS 240 CO -0.53 0.07 0.85 1.25 -2.27 0.00 0.00 179.45 178.82 3ciy h LEU 241 N -0.94 0.25 -0.37 5.20 5.85 0.58 -1.79 115.31 124.09 3ciy h LEU 241 Ca -0.03 0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.90 3ciy h LEU 241 Cb 0.48 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.54 3ciy h LEU 241 CO 0.05 -0.15 -0.25 0.00 -0.34 0.00 0.00 178.44 177.74 3ciy h TRP 243 N -0.20 0.27 0.00 0.00 6.55 -1.48 0.20 115.95 121.30 3ciy h TRP 243 Ca 0.18 0.01 0.00 0.00 0.95 0.00 0.00 58.89 60.03 3ciy h TRP 243 Cb 0.48 -0.09 0.00 0.00 -0.86 0.00 0.00 29.16 28.69 3ciy h TRP 243 CO -0.47 0.13 0.00 0.39 -1.05 0.00 0.00 178.44 177.44 3ciy n GLU 244 N -4.46 0.18 -0.16 0.49 -0.58 -0.79 -1.74 120.64 113.58 3ciy n GLU 244 Ca 0.07 0.25 0.10 0.00 -0.42 0.00 0.00 57.16 57.16 3ciy n GLU 244 Cb 0.37 -1.75 0.28 0.00 -0.57 0.00 0.00 31.44 29.77 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 -2.08 2.49 -4.87 -4.62 4.77 0.70 -4.24 117.00 109.16 3ciy n LEU 245 Ca 0.05 -1.11 -0.30 0.00 -0.03 0.00 0.00 56.01 54.61 3ciy n LEU 245 Cb 0.34 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.26 3ciy n LEU 245 CO 0.25 0.56 0.74 -0.44 -1.33 0.00 0.00 177.39 177.17 3ciy s SER 246 N -1.39 5.50 -0.47 -1.43 0.01 -0.71 -3.87 113.70 111.34 3ciy s SER 246 Ca 0.34 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.83 3ciy s SER 246 Cb 0.19 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.36 3ciy s SER 246 CO 0.27 -1.32 0.00 0.59 0.41 0.00 0.00 173.24 173.19 3ciy n ASN 247 N -3.00 -1.57 -4.98 2.44 3.02 -1.08 -4.88 115.26 105.21 3ciy n ASN 247 Ca 0.07 0.11 -0.20 0.00 -0.03 0.00 0.00 54.58 54.52 3ciy n ASN 247 Cb 0.56 -1.62 -0.01 0.00 -0.61 0.00 0.00 39.78 38.10 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 -1.20 4.42 -0.35 3.41 -4.23 -1.25 -4.99 115.64 111.46 3ciy s THR 248 Ca 0.00 -0.87 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 3ciy s THR 248 Cb 0.00 -3.56 0.13 0.00 1.34 0.00 0.00 72.50 70.41 3ciy s THR 248 CO 0.00 -0.26 1.02 -1.20 -0.54 0.00 0.00 174.62 173.64 3ciy n SER 249 N -1.67 2.70 -4.70 3.99 7.64 -1.26 -4.62 113.62 115.70 3ciy n SER 249 Ca -0.02 -2.25 -0.42 0.00 1.01 0.00 0.00 58.87 57.19 3ciy n SER 249 Cb 0.58 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 63.20 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 -0.84 3.95 -0.06 0.44 2.07 -0.95 -4.08 121.20 121.71 3ciy s ILE 250 Ca 0.10 1.34 -0.01 0.00 -1.41 0.00 0.00 60.65 60.68 3ciy s ILE 250 Cb 0.08 -3.86 -0.04 0.00 0.13 0.00 0.00 42.46 38.77 3ciy s ILE 250 CO 0.02 0.04 -0.06 0.00 -1.91 0.00 0.00 174.94 173.03 3ciy n GLN 251 N 4.76 0.15 -4.35 3.50 6.02 0.25 -4.25 117.38 123.45 3ciy n GLN 251 Ca 0.11 0.04 -0.33 0.00 -0.01 0.00 0.00 57.00 56.81 3ciy n GLN 251 Cb 0.45 -0.98 -0.09 0.00 1.02 0.00 0.00 30.24 30.64 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 -4.94 5.07 -0.16 1.08 -0.87 -1.15 -1.26 114.94 112.73 3ciy s ASN 252 Ca -0.08 0.02 -0.06 0.00 -1.57 0.00 0.00 52.86 51.16 3ciy s ASN 252 Cb 0.03 -1.34 0.07 0.00 -0.02 0.00 0.00 41.25 39.99 3ciy s ASN 252 CO 0.13 0.31 0.34 -0.22 -2.57 0.00 0.00 177.10 175.09 3ciy s LEU 253 N -1.31 -0.24 -0.17 0.60 2.96 -0.77 -2.76 118.68 116.99 3ciy s LEU 253 Ca 0.17 0.77 -0.04 0.00 -0.22 0.00 0.00 54.13 54.81 3ciy s LEU 253 Cb -0.11 1.05 -0.02 0.00 0.50 0.00 0.00 46.19 47.60 3ciy s LEU 253 CO 0.07 -0.21 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.31 3ciy s SER 254 N 2.06 4.72 -0.49 3.68 0.15 -1.08 -1.59 113.70 121.15 3ciy s SER 254 Ca -0.04 -0.19 0.08 0.00 0.70 0.00 0.00 55.95 56.50 3ciy s SER 254 Cb -0.11 -1.78 0.28 0.00 -1.71 0.00 0.00 66.02 62.70 3ciy s SER 254 CO -0.11 0.12 0.68 0.18 1.20 0.00 0.00 173.24 175.31 3ciy n LEU 255 N 3.86 1.94 -4.85 3.45 4.77 -0.73 -1.84 117.00 123.60 3ciy n LEU 255 Ca -0.17 -5.10 -0.37 0.00 -0.03 0.00 0.00 56.01 50.33 3ciy n LEU 255 Cb 0.52 0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.65 3ciy n LEU 255 CO 0.32 2.14 -0.05 0.00 -1.33 0.00 0.00 177.39 178.47 3ciy s ALA 256 N -2.08 3.79 -0.60 -1.18 0.00 -1.26 -4.12 121.76 116.30 3ciy s ALA 256 Ca 0.39 -0.45 -0.02 0.00 0.00 0.00 0.00 51.96 51.88 3ciy s ALA 256 Cb 0.21 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 21.16 3ciy s ALA 256 CO -0.08 0.53 0.59 0.09 0.00 0.00 0.00 175.76 176.89 3ciy n ASN 257 N 2.01 -7.03 -1.81 0.00 3.02 0.14 -0.08 115.26 111.51 3ciy n ASN 257 Ca -0.17 0.01 -0.07 0.00 -0.03 0.00 0.00 54.58 54.32 3ciy n ASN 257 Cb 0.54 -4.74 -0.02 0.00 -0.61 0.00 0.00 39.78 34.95 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 -1.49 -0.36 -1.94 6.41 3.02 -1.18 -2.93 115.26 116.77 3ciy n ASN 258 Ca 0.01 -1.79 -0.23 0.00 -0.03 0.00 0.00 54.58 52.54 3ciy n ASN 258 Cb 0.49 0.76 0.09 0.00 -0.61 0.00 0.00 39.78 40.51 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 -0.23 2.81 -1.17 3.52 3.00 -1.17 -4.50 117.38 119.63 3ciy n GLN 259 Ca 0.02 -3.58 -0.40 0.00 -0.01 0.00 0.00 57.00 53.03 3ciy n GLN 259 Cb 0.23 -2.17 -0.04 0.00 0.00 0.00 0.00 30.24 28.25 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 -0.90 4.70 0.00 1.08 4.32 -1.24 -4.60 117.00 120.36 3ciy n LEU 260 Ca 0.49 -3.10 0.00 0.00 -0.02 0.00 0.00 56.01 53.38 3ciy n LEU 260 Cb 0.92 -1.20 0.01 0.00 -1.62 0.00 0.00 43.42 41.53 3ciy n LEU 260 CO 0.50 0.04 0.51 0.18 -1.22 0.00 0.00 177.39 177.40 3ciy n LEU 261 N 6.72 0.01 -3.58 2.23 4.77 -1.25 -3.68 117.00 122.21 3ciy n LEU 261 Ca 0.50 0.45 -0.06 0.00 -0.03 0.00 0.00 56.01 56.86 3ciy n LEU 261 Cb 0.36 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 3ciy n LEU 261 CO 0.97 -0.45 0.79 0.00 -1.33 0.00 0.00 177.39 177.37 3ciy s ALA 262 N -2.89 -1.88 0.04 -1.18 0.00 -1.26 -0.39 121.76 114.19 3ciy s ALA 262 Ca -0.00 0.95 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 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 0.00 -0.76 -0.02 0.95 0.00 0.00 0.00 175.76 175.92 3ciy s THR 263 N -2.94 0.16 0.38 0.00 -4.23 -0.67 -4.82 115.64 103.53 3ciy s THR 263 Ca 0.08 -1.36 0.05 0.00 -1.18 0.00 0.00 61.69 59.28 3ciy s THR 263 Cb -0.01 -0.90 -0.03 0.00 1.34 0.00 0.00 72.50 72.91 3ciy s THR 263 CO -0.06 -0.75 0.18 -0.94 -0.54 0.00 0.00 174.62 172.52 3ciy s SER 264 N -2.20 2.38 0.36 3.99 1.04 -1.26 -1.09 113.70 116.92 3ciy s SER 264 Ca -0.04 -1.71 0.13 0.00 0.48 0.00 0.00 55.95 54.80 3ciy s SER 264 Cb -0.01 0.54 0.68 0.00 0.10 0.00 0.00 66.02 67.34 3ciy s SER 264 CO -0.06 -0.99 1.80 -0.08 0.98 0.00 0.00 173.24 174.90 3ciy h GLU 265 N 1.91 0.00 0.00 4.02 4.81 -1.74 -2.64 114.58 120.93 3ciy h GLU 265 Ca -0.31 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 0.49 0.40 -0.27 0.66 -0.73 0.00 0.00 179.01 179.56 3ciy h SER 266 N 0.00 0.00 0.00 1.04 4.64 -1.89 -3.23 113.55 114.11 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 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3ciy h SER 266 CO 0.05 0.27 0.00 0.41 -0.87 0.00 0.00 176.83 176.69 3ciy n THR 267 N -3.26 0.00 0.75 2.95 -1.04 -1.00 -2.27 114.28 110.41 3ciy n THR 267 Ca 0.02 1.35 0.02 0.00 -2.04 0.00 0.00 64.05 63.39 3ciy n THR 267 Cb 0.55 -2.18 0.08 0.00 -1.82 0.00 0.00 70.33 66.97 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 -1.86 0.40 -0.12 -1.42 3.72 -1.26 -3.88 117.46 113.05 3ciy n PHE 268 Ca 0.00 -0.15 0.14 0.00 -0.05 0.00 0.00 57.45 57.40 3ciy n PHE 268 Cb 0.00 -0.16 0.52 0.00 -0.94 0.00 0.00 39.48 38.90 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 0.86 0.35 0.41 4.37 4.64 -1.47 -0.72 113.55 121.99 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 0.72 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3ciy h SER 269 CO 0.09 0.19 -0.00 1.23 -0.87 0.00 0.00 176.83 177.47 3ciy h GLY 270 N 0.37 0.00 2.00 -0.77 0.00 -1.77 -2.71 103.07 100.19 3ciy h GLY 270 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 3ciy h GLY 270 CO -0.09 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.86 3ciy h LEU 271 N 0.00 0.00 -1.18 3.11 -0.00 -1.32 -3.34 115.31 112.58 3ciy h LEU 271 Ca -0.00 0.00 0.36 0.00 -0.00 0.00 0.00 57.88 58.24 3ciy h LEU 271 Cb 0.21 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 40.73 3ciy h LEU 271 CO 0.00 0.00 0.67 0.07 -0.00 0.00 0.00 178.44 179.18 3ciy h LYS 272 N 0.00 0.22 -0.06 1.13 2.10 -1.62 1.61 116.57 119.95 3ciy h LYS 272 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3ciy h LYS 272 Cb 0.73 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 3ciy h LYS 272 CO 0.00 0.14 0.00 0.91 -2.00 0.00 0.00 179.45 178.50 3ciy n TRP 273 N -4.91 0.00 -4.12 0.07 8.01 -1.25 -4.85 117.44 110.39 3ciy n TRP 273 Ca 0.33 0.00 -0.27 0.00 -1.31 0.00 0.00 57.50 56.26 3ciy n TRP 273 Cb 1.15 -0.01 -0.02 0.00 -2.01 0.00 0.00 31.31 30.42 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 -0.46 0.00 -3.77 -0.99 -2.24 0.55 -2.62 114.28 104.76 3ciy n THR 274 Ca 0.00 -2.12 -0.29 0.00 -2.27 0.00 0.00 64.05 59.37 3ciy n THR 274 Cb 0.02 0.10 -0.12 0.00 -2.10 0.00 0.00 70.33 68.22 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 -3.92 3.82 -0.35 3.42 3.84 -1.26 -5.01 114.94 115.48 3ciy s ASN 275 Ca 0.20 -3.25 -0.12 0.00 0.21 0.00 0.00 52.86 49.90 3ciy s ASN 275 Cb -0.02 -1.26 -0.01 0.00 -0.55 0.00 0.00 41.25 39.42 3ciy s ASN 275 CO 0.13 -0.17 0.23 -0.76 -2.79 0.00 0.00 177.10 173.74 3ciy s LEU 276 N -0.51 4.54 -0.01 3.21 2.01 -1.26 -4.20 118.68 122.46 3ciy s LEU 276 Ca 0.23 -0.57 -0.00 0.00 0.01 0.00 0.00 54.13 53.80 3ciy s LEU 276 Cb -0.12 -2.10 -0.00 0.00 0.01 0.00 0.00 46.19 43.98 3ciy s LEU 276 CO -0.10 -0.27 -0.00 0.74 1.01 0.00 0.00 176.35 177.73 3ciy h THR 277 N 5.58 0.00 -3.78 5.49 2.02 -1.41 -1.03 112.91 119.78 3ciy h THR 277 Ca -0.30 -0.08 -0.68 0.00 0.77 0.00 0.00 66.41 66.12 3ciy h THR 277 Cb 1.14 0.00 -0.23 0.00 -1.74 0.00 0.00 68.15 67.32 3ciy h THR 277 CO 0.65 0.00 -0.75 -1.58 0.37 0.00 0.00 175.52 174.20 3ciy s GLN 278 N -1.05 2.80 -0.06 6.66 0.74 -1.02 -0.36 119.66 127.36 3ciy s GLN 278 Ca -0.00 -0.66 0.02 0.00 0.05 0.00 0.00 55.36 54.76 3ciy s GLN 278 Cb 0.00 -2.49 0.02 0.00 1.10 0.00 0.00 33.01 31.64 3ciy s GLN 278 CO 0.00 0.52 -0.09 -1.17 -0.55 0.00 0.00 175.29 174.00 3ciy s LEU 279 N -0.44 1.48 -0.07 3.68 2.96 -0.84 -1.84 118.68 123.61 3ciy s LEU 279 Ca 0.06 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.76 3ciy s LEU 279 Cb -0.12 -0.70 -0.02 0.00 0.50 0.00 0.00 46.19 45.85 3ciy s LEU 279 CO 0.02 -0.01 -0.16 -0.62 -1.32 0.00 0.00 176.35 174.25 3ciy s ASP 280 N 0.86 3.80 0.00 3.68 2.15 -0.62 -1.34 116.67 125.21 3ciy s ASP 280 Ca -0.11 -0.30 0.08 0.00 0.43 0.00 0.00 52.55 52.64 3ciy s ASP 280 Cb -0.15 -1.05 0.13 0.00 -0.30 0.00 0.00 42.92 41.56 3ciy s ASP 280 CO 0.01 0.27 1.01 0.18 -0.17 0.00 0.00 175.17 176.48 3ciy n LEU 281 N 2.78 0.26 -4.71 -1.34 4.77 -0.37 -1.78 117.00 116.62 3ciy n LEU 281 Ca -0.17 -1.35 -0.31 0.00 -0.03 0.00 0.00 56.01 54.14 3ciy n LEU 281 Cb 0.52 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.75 3ciy n LEU 281 CO 0.27 0.44 0.70 -0.94 -1.33 0.00 0.00 177.39 176.53 3ciy s SER 282 N -1.23 3.59 -0.86 -1.43 1.04 -1.16 -3.99 113.70 109.66 3ciy s SER 282 Ca 0.10 2.07 -0.04 0.00 0.48 0.00 0.00 55.95 58.56 3ciy s SER 282 Cb 0.12 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.69 3ciy s SER 282 CO -0.05 -2.66 0.64 -1.22 0.98 0.00 0.00 173.24 170.93 3ciy n TYR 283 N -3.87 -2.15 -1.50 5.02 4.02 -0.43 -2.73 117.16 115.53 3ciy n TYR 283 Ca 0.11 0.80 0.01 0.00 -0.01 0.00 0.00 57.90 58.81 3ciy n TYR 283 Cb 0.52 -3.05 0.01 0.00 -0.02 0.00 0.00 39.34 36.80 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 -2.44 0.25 -2.86 7.72 3.02 -1.25 -0.69 115.26 119.02 3ciy n ASN 284 Ca -0.23 -1.73 -0.09 0.00 -0.03 0.00 0.00 54.58 52.50 3ciy n ASN 284 Cb 0.64 -0.14 -0.01 0.00 -0.61 0.00 0.00 39.78 39.66 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 -0.12 -1.41 -4.61 6.41 3.02 -1.26 -3.68 115.26 113.61 3ciy n ASN 285 Ca 0.01 0.17 -0.43 0.00 -0.03 0.00 0.00 54.58 54.30 3ciy n ASN 285 Cb 0.61 -1.31 -0.03 0.00 -0.61 0.00 0.00 39.78 38.43 3ciy n ASN 285 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3ciy s LEU 286 N -5.46 3.54 -0.09 3.41 2.96 -1.24 -4.34 118.68 117.46 3ciy s LEU 286 Ca 0.15 1.77 0.19 0.00 -0.22 0.00 0.00 54.13 56.02 3ciy s LEU 286 Cb -0.09 -3.52 -0.29 0.00 0.50 0.00 0.00 46.19 42.80 3ciy s LEU 286 CO 0.18 -1.81 0.30 1.57 -1.32 0.00 0.00 176.35 175.28 3ciy n HIS 287 N 10.92 0.00 -5.16 5.38 -0.00 0.48 -2.35 115.22 124.49 3ciy n HIS 287 Ca 0.27 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.68 3ciy n HIS 287 Cb 0.45 -0.64 -0.17 0.00 -0.00 0.00 0.00 29.99 29.64 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 -4.70 2.88 -0.52 0.26 1.11 -1.07 -2.82 116.67 111.80 3ciy s ASP 288 Ca -0.08 -0.49 0.06 0.00 0.18 0.00 0.00 52.55 52.22 3ciy s ASP 288 Cb 0.10 -0.93 0.22 0.00 1.07 0.00 0.00 42.92 43.38 3ciy s ASP 288 CO 0.82 0.20 0.55 0.52 1.18 0.00 0.00 175.17 178.44 3ciy n VAL 289 N 3.14 0.50 -0.93 -1.27 0.31 -1.26 -1.67 118.33 117.15 3ciy n VAL 289 Ca -0.18 -4.40 -0.35 0.00 -0.01 0.00 0.00 64.34 59.40 3ciy n VAL 289 Cb 0.52 -1.98 0.07 0.00 -0.91 0.00 0.00 33.84 31.54 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 1.61 -3.71 3.72 2.92 0.00 -0.25 -4.87 105.19 104.61 3ciy n GLY 290 Ca 0.25 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.31 6.63 -1.60 1.61 0.01 -1.26 -2.96 114.94 116.07 3ciy s ASN 291 Ca 0.45 2.58 -0.02 0.00 -0.71 0.00 0.00 52.86 55.16 3ciy s ASN 291 Cb -0.16 -2.60 0.01 0.00 0.41 0.00 0.00 41.25 38.91 3ciy s ASN 291 CO 0.76 -0.78 0.19 0.61 -1.51 0.00 0.00 177.10 176.38 3ciy n GLY 292 N 3.50 -0.51 0.30 0.66 0.00 -1.04 -3.96 105.19 104.14 3ciy n GLY 292 Ca 0.13 0.04 0.19 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.43 0.00 -0.25 1.61 0.02 -1.72 -2.25 113.55 110.53 3ciy h SER 293 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 3ciy h SER 293 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 3ciy h SER 293 CO 0.55 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.73 3ciy n PHE 294 N -3.10 0.39 0.17 3.45 3.72 -1.26 -4.40 117.46 116.43 3ciy n PHE 294 Ca -0.01 -0.55 0.10 0.00 -0.05 0.00 0.00 57.45 56.94 3ciy n PHE 294 Cb 0.23 -0.06 0.52 0.00 -0.94 0.00 0.00 39.48 39.23 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 0.13 0.50 -0.89 4.37 3.41 -0.84 -1.28 113.62 119.01 3ciy n SER 295 Ca 0.10 0.70 0.10 0.00 -0.26 0.00 0.00 58.87 59.51 3ciy n SER 295 Cb 0.43 -0.73 0.27 0.00 -0.26 0.00 0.00 64.21 63.93 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 -2.21 0.47 -2.94 7.33 0.53 -1.26 -4.56 117.16 114.51 3ciy n TYR 296 Ca -0.01 -0.23 -0.28 0.00 -1.02 0.00 0.00 57.90 56.35 3ciy n TYR 296 Cb 0.13 0.00 -0.04 0.00 -1.03 0.00 0.00 39.34 38.41 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 0.94 4.74 -0.29 7.72 4.77 -0.41 -4.14 117.00 130.34 3ciy n LEU 297 Ca 0.18 -5.65 0.00 0.00 -0.03 0.00 0.00 56.01 50.51 3ciy n LEU 297 Cb 0.46 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3ciy n LEU 297 CO 0.13 2.31 0.13 -0.81 -1.33 0.00 0.00 177.39 177.83 3ciy n PRO 298 N -0.16 0.37 0.00 3.23 -0.04 -1.25 -1.67 135.00 135.48 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 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 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 -0.03 0.28 -4.68 3.54 2.88 -1.26 -4.55 113.62 109.80 3ciy n SER 299 Ca 0.00 -0.06 -0.43 0.00 -1.33 0.00 0.00 58.87 57.05 3ciy n SER 299 Cb 0.05 0.17 -0.03 0.00 -0.75 0.00 0.00 64.21 63.65 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 -0.20 3.96 -0.05 2.46 0.00 -0.39 -4.50 117.00 118.28 3ciy n LEU 300 Ca 0.00 0.96 -0.01 0.00 0.00 0.00 0.00 56.01 56.95 3ciy n LEU 300 Cb 0.00 -1.51 -0.14 0.00 0.00 0.00 0.00 43.42 41.78 3ciy n LEU 300 CO 0.00 0.13 -0.92 0.54 0.00 0.00 0.00 177.39 177.14 3ciy n ARG 301 N 6.42 0.97 -4.60 1.96 1.74 0.51 -0.64 116.66 123.02 3ciy n ARG 301 Ca 0.19 -0.07 -0.24 0.00 -0.77 0.00 0.00 57.85 56.97 3ciy n ARG 301 Cb 0.37 -1.43 -0.14 0.00 -1.02 0.00 0.00 32.46 30.24 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 -2.75 1.57 -0.27 -1.55 2.02 -0.65 0.83 117.35 116.55 3ciy s TYR 302 Ca -0.08 -0.34 -0.07 0.00 -0.37 0.00 0.00 57.07 56.21 3ciy s TYR 302 Cb 0.08 -0.95 0.14 0.00 -0.40 0.00 0.00 41.96 40.82 3ciy s TYR 302 CO 0.71 0.05 0.56 -1.17 -1.57 0.00 0.00 175.55 174.13 3ciy s LEU 303 N -0.96 -1.04 -0.28 -1.29 2.96 -0.97 -1.99 118.68 115.11 3ciy s LEU 303 Ca 0.06 1.16 -0.06 0.00 -0.22 0.00 0.00 54.13 55.07 3ciy s LEU 303 Cb -0.08 1.95 0.01 0.00 0.50 0.00 0.00 46.19 48.57 3ciy s LEU 303 CO 0.01 -0.24 0.04 -0.55 -1.32 0.00 0.00 176.35 174.29 3ciy s SER 304 N 2.79 4.91 -0.31 3.68 0.15 -0.45 -2.75 113.70 121.73 3ciy s SER 304 Ca 0.03 -0.70 0.10 0.00 0.70 0.00 0.00 55.95 56.07 3ciy s SER 304 Cb -0.13 -1.83 0.59 0.00 -1.71 0.00 0.00 66.02 62.95 3ciy s SER 304 CO -0.18 -0.16 1.62 0.18 1.20 0.00 0.00 173.24 175.90 3ciy n LEU 305 N 4.82 5.00 -4.53 3.45 4.32 -0.58 -1.23 117.00 128.25 3ciy n LEU 305 Ca -0.15 -3.49 -0.35 0.00 -0.02 0.00 0.00 56.01 52.00 3ciy n LEU 305 Cb 0.48 -0.68 0.09 0.00 -1.62 0.00 0.00 43.42 41.69 3ciy n LEU 305 CO 0.30 1.01 0.27 -0.62 -1.22 0.00 0.00 177.39 177.14 3ciy n GLU 306 N -0.82 0.23 -3.65 3.23 1.02 -1.22 -4.04 120.64 115.39 3ciy n GLU 306 Ca 0.38 0.13 -0.23 0.00 -0.02 0.00 0.00 57.16 57.42 3ciy n GLU 306 Cb 1.21 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 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 -2.78 -1.82 -4.08 -0.32 4.02 0.03 -1.32 117.16 110.89 3ciy n TYR 307 Ca 0.11 0.75 -0.10 0.00 -0.01 0.00 0.00 57.90 58.65 3ciy n TYR 307 Cb 0.50 -2.40 -0.09 0.00 -0.02 0.00 0.00 39.34 37.33 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 -2.82 0.17 -0.86 7.72 0.01 -0.39 -2.04 114.94 116.73 3ciy s ASN 308 Ca 0.01 -1.10 0.00 0.00 -0.71 0.00 0.00 52.86 51.07 3ciy s ASN 308 Cb -0.00 0.37 0.25 0.00 0.41 0.00 0.00 41.25 42.28 3ciy s ASN 308 CO 0.80 -0.83 0.94 0.59 -1.51 0.00 0.00 177.10 177.09 3ciy n ASN 309 N -0.18 4.59 -4.74 -1.22 3.02 -1.07 -2.76 115.26 112.90 3ciy n ASN 309 Ca -0.05 -3.30 -0.39 0.00 -0.03 0.00 0.00 54.58 50.81 3ciy n ASN 309 Cb 0.64 -0.98 -0.05 0.00 -0.61 0.00 0.00 39.78 38.77 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 -2.08 4.92 -0.06 2.41 1.01 -0.76 -3.04 121.20 123.60 3ciy s ILE 310 Ca 0.32 1.40 -0.25 0.00 0.00 0.00 0.00 60.65 62.12 3ciy s ILE 310 Cb 0.03 -4.01 -0.20 0.00 0.01 0.00 0.00 42.46 38.29 3ciy s ILE 310 CO -0.04 0.35 1.01 -0.61 0.00 0.00 0.00 174.94 175.65 3ciy h GLN 311 N 6.05 -0.06 -2.86 2.79 5.75 -1.81 -2.50 115.11 122.47 3ciy h GLN 311 Ca -0.43 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.15 3ciy h GLN 311 Cb 1.20 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.72 3ciy h GLN 311 CO 0.72 0.52 0.31 -0.98 -2.65 0.00 0.00 178.83 176.75 3ciy s ARG 312 N -3.48 1.76 -0.34 1.69 1.70 -1.26 -2.94 118.95 116.08 3ciy s ARG 312 Ca -0.15 -1.03 -0.01 0.00 -0.47 0.00 0.00 55.73 54.07 3ciy s ARG 312 Cb 0.00 0.56 0.12 0.00 -0.57 0.00 0.00 34.95 35.06 3ciy s ARG 312 CO 0.61 -0.81 0.15 -0.51 -1.08 0.00 0.00 175.30 173.66 3ciy s LEU 313 N -2.99 1.81 1.02 -1.89 1.43 -1.25 -4.81 118.68 112.00 3ciy s LEU 313 Ca 0.13 -1.90 -0.13 0.00 -1.03 0.00 0.00 54.13 51.21 3ciy s LEU 313 Cb -0.05 -0.73 0.20 0.00 0.03 0.00 0.00 46.19 45.64 3ciy s LEU 313 CO 0.07 -0.37 1.10 -0.94 0.23 0.00 0.00 176.35 176.44 3ciy s SER 314 N 1.32 2.48 0.30 2.29 1.04 -1.26 -3.34 113.70 116.54 3ciy s SER 314 Ca 0.13 1.13 0.02 0.00 0.48 0.00 0.00 55.95 57.70 3ciy s SER 314 Cb -0.20 -1.77 0.58 0.00 0.10 0.00 0.00 66.02 64.73 3ciy s SER 314 CO -0.17 -3.21 1.87 1.55 0.98 0.00 0.00 173.24 174.26 3ciy h PRO 315 N -1.95 0.94 0.00 4.02 0.13 -1.76 -1.09 132.00 132.29 3ciy h PRO 315 Ca -0.55 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 3ciy h PRO 315 Cb 1.33 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3ciy h PRO 315 CO 0.57 0.62 0.00 -2.13 -0.23 0.00 0.00 178.00 176.84 3ciy n ARG 316 N -4.55 0.87 0.29 0.86 3.00 -1.26 -4.02 116.66 111.85 3ciy n ARG 316 Ca 0.17 0.00 -0.17 0.00 -0.00 0.00 0.00 57.85 57.85 3ciy n ARG 316 Cb 0.31 -1.27 -0.09 0.00 0.00 0.00 0.00 32.46 31.41 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 -0.59 -0.23 6.15 0.02 -1.50 -2.74 113.55 114.66 3ciy h SER 317 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3ciy h SER 317 Cb 0.00 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.69 3ciy h SER 317 CO 0.00 -0.42 0.00 0.49 -1.14 0.00 0.00 176.83 175.76 3ciy n PHE 318 N -5.39 0.31 -1.68 3.45 3.01 -1.26 -3.92 117.46 111.98 3ciy n PHE 318 Ca -0.12 -0.15 -0.45 0.00 1.01 0.00 0.00 57.45 57.74 3ciy n PHE 318 Cb 0.29 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.72 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 0.25 2.46 0.00 1.38 9.36 -1.20 -2.77 117.16 126.64 3ciy n TYR 319 Ca 0.12 -0.06 0.00 0.00 3.32 0.00 0.00 57.90 61.27 3ciy n TYR 319 Cb 0.25 -2.69 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 4.18 3.74 3.51 2.98 0.00 -1.26 -2.50 105.19 115.83 3ciy n GLY 320 Ca 0.19 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 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 4.55 0.00 0.99 1.43 -1.12 -3.81 118.68 120.73 3ciy s LEU 321 Ca 0.00 -2.59 0.25 0.00 -1.03 0.00 0.00 54.13 50.76 3ciy s LEU 321 Cb 0.00 -2.47 0.53 0.00 0.03 0.00 0.00 46.19 44.29 3ciy s LEU 321 CO 0.00 -0.98 1.45 -1.54 0.23 0.00 0.00 176.35 175.52 3ciy n SER 322 N 6.86 2.46 -0.00 2.29 3.41 -1.26 -4.04 113.62 123.34 3ciy n SER 322 Ca 0.39 -1.82 0.04 0.00 -0.26 0.00 0.00 58.87 57.22 3ciy n SER 322 Cb 0.45 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.91 2.06 -4.60 4.04 2.85 -1.26 -4.58 115.26 114.68 3ciy n ASN 323 Ca 0.16 -0.26 -0.47 0.00 -0.11 0.00 0.00 54.58 53.90 3ciy n ASN 323 Cb 0.50 1.23 -0.03 0.00 1.24 0.00 0.00 39.78 42.72 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 -1.56 1.84 0.00 1.20 7.94 0.19 -4.40 117.00 122.21 3ciy n LEU 324 Ca -0.00 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 56.04 3ciy n LEU 324 Cb 0.18 -1.26 0.00 0.00 0.53 0.00 0.00 43.42 42.87 3ciy n LEU 324 CO 0.17 -1.17 -0.12 0.54 -1.11 0.00 0.00 177.39 175.70 3ciy n ARG 325 N 1.66 3.54 -3.59 1.96 1.74 0.24 -2.35 116.66 119.88 3ciy n ARG 325 Ca 0.14 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.99 3ciy n ARG 325 Cb 0.27 -0.51 -0.16 0.00 -1.02 0.00 0.00 32.46 31.04 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 -0.87 0.04 -0.06 -1.55 6.14 -0.94 -1.28 117.35 118.83 3ciy s TYR 326 Ca 0.00 -0.08 0.05 0.00 0.64 0.00 0.00 57.07 57.68 3ciy s TYR 326 Cb 0.00 -0.57 -0.01 0.00 0.42 0.00 0.00 41.96 41.80 3ciy s TYR 326 CO 0.00 -0.50 -0.22 -1.17 0.64 0.00 0.00 175.55 174.30 3ciy s LEU 327 N 2.20 2.24 -0.19 6.97 2.96 -0.30 -2.28 118.68 130.27 3ciy s LEU 327 Ca 0.04 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 3ciy s LEU 327 Cb -0.15 -1.43 0.03 0.00 0.50 0.00 0.00 46.19 45.14 3ciy s LEU 327 CO -0.09 0.25 -0.14 -0.55 -1.32 0.00 0.00 176.35 174.50 3ciy s SER 328 N -0.19 3.26 -0.26 3.68 0.15 -1.11 -1.74 113.70 117.48 3ciy s SER 328 Ca -0.02 -0.78 0.09 0.00 0.70 0.00 0.00 55.95 55.95 3ciy s SER 328 Cb -0.13 -1.33 0.45 0.00 -1.71 0.00 0.00 66.02 63.30 3ciy s SER 328 CO 0.03 -0.09 1.31 0.18 1.20 0.00 0.00 173.24 175.88 3ciy n LEU 329 N 4.66 3.62 -4.62 3.45 4.77 0.12 -1.53 117.00 127.47 3ciy n LEU 329 Ca -0.17 -4.02 -0.43 0.00 -0.03 0.00 0.00 56.01 51.37 3ciy n LEU 329 Cb 0.48 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 3ciy n LEU 329 CO 0.22 1.48 1.76 1.17 -1.33 0.00 0.00 177.39 180.70 3ciy n LYS 330 N -1.05 2.31 -3.73 3.23 4.81 -1.25 -1.36 118.16 121.11 3ciy n LYS 330 Ca 0.28 0.73 -0.26 0.00 -0.87 0.00 0.00 58.31 58.19 3ciy n LYS 330 Cb 0.84 -3.16 0.06 0.00 0.02 0.00 0.00 35.03 32.79 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 8.30 -6.84 -0.11 1.64 3.00 -0.23 -0.79 116.66 121.63 3ciy n ARG 331 Ca 0.26 0.73 0.12 0.00 -0.00 0.00 0.00 57.85 58.96 3ciy n ARG 331 Cb 0.43 -5.70 0.23 0.00 0.00 0.00 0.00 32.46 27.42 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 -4.84 2.46 -2.57 5.13 0.00 -0.47 -1.26 120.51 118.96 3ciy n ALA 332 Ca 0.01 -0.81 -0.22 0.00 0.00 0.00 0.00 53.44 52.42 3ciy n ALA 332 Cb 0.55 -0.91 -0.14 0.00 0.00 0.00 0.00 19.45 18.95 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 -1.70 1.44 0.55 0.00 0.08 -1.11 -1.84 117.98 115.40 3ciy s PHE 333 Ca 0.35 -0.34 -0.18 0.00 0.12 0.00 0.00 56.93 56.88 3ciy s PHE 333 Cb 0.21 -0.87 -0.11 0.00 -0.57 0.00 0.00 43.02 41.68 3ciy s PHE 333 CO 0.31 0.04 0.22 -2.37 -0.10 0.00 0.00 175.22 173.32 3ciy n THR 334 N 2.07 1.22 -1.15 0.64 5.66 -0.94 -4.65 114.28 117.14 3ciy n THR 334 Ca -0.17 -0.50 -0.34 0.00 -3.05 0.00 0.00 64.05 60.00 3ciy n THR 334 Cb 0.54 -0.38 0.12 0.00 -1.55 0.00 0.00 70.33 69.07 3ciy n THR 334 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3ciy n LYS 335 N 0.64 0.23 -2.91 1.09 4.76 -1.26 -4.48 118.16 116.22 3ciy n LYS 335 Ca 0.10 0.15 -0.40 0.00 -2.87 0.00 0.00 58.31 55.29 3ciy n LYS 335 Cb 0.48 -2.37 -0.06 0.00 -1.84 0.00 0.00 35.03 31.24 3ciy n LYS 335 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3ciy s GLN 336 N -3.92 4.64 -0.11 1.97 0.74 -1.26 -4.60 119.66 117.11 3ciy s GLN 336 Ca 0.73 1.25 -0.08 0.00 0.05 0.00 0.00 55.36 57.31 3ciy s GLN 336 Cb -0.30 -3.28 -0.27 0.00 1.10 0.00 0.00 33.01 30.27 3ciy s GLN 336 CO 0.51 0.52 0.40 0.77 -0.55 0.00 0.00 175.29 176.94 3ciy h SER 337 N 4.44 0.43 0.00 6.67 0.02 -1.93 -3.48 113.55 119.70 3ciy h SER 337 Ca -0.46 -0.95 0.00 0.00 -0.84 0.00 0.00 61.79 59.54 3ciy h SER 337 Cb 1.20 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.60 3ciy h SER 337 CO 0.67 1.85 0.00 0.52 -1.14 0.00 0.00 176.83 178.73 3ciy n VAL 338 N -3.52 0.00 0.11 2.27 0.31 -1.26 -3.96 118.33 112.28 3ciy n VAL 338 Ca -0.31 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 63.85 3ciy n VAL 338 Cb 1.04 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.83 3ciy n VAL 338 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3ciy h SER 339 N 0.00 0.45 -0.39 4.52 4.64 -2.02 -3.26 113.55 117.49 3ciy h SER 339 Ca 0.00 -0.49 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3ciy h SER 339 Cb 0.00 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 3ciy h SER 339 CO 0.00 1.39 0.00 0.18 -0.87 0.00 0.00 176.83 177.53 3ciy n LEU 340 N -3.54 2.80 -4.01 5.97 4.77 -1.25 -4.97 117.00 116.75 3ciy n LEU 340 Ca -0.09 -1.27 -0.44 0.00 -0.03 0.00 0.00 56.01 54.18 3ciy n LEU 340 Cb 1.03 -0.26 0.02 0.00 -2.33 0.00 0.00 43.42 41.89 3ciy n LEU 340 CO 0.54 0.64 -0.16 0.00 -1.33 0.00 0.00 177.39 177.08 3ciy n ALA 341 N 1.04 -2.62 -2.30 -1.18 0.00 -1.23 -4.88 120.51 109.34 3ciy n ALA 341 Ca 0.18 -0.53 -0.12 0.00 0.00 0.00 0.00 53.44 52.98 3ciy n ALA 341 Cb 0.48 -2.65 0.05 0.00 0.00 0.00 0.00 19.45 17.32 3ciy n ALA 341 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3ciy n SER 342 N -2.23 3.28 -4.61 0.00 7.64 -1.26 -4.97 113.62 111.46 3ciy n SER 342 Ca -0.12 -3.07 -0.43 0.00 1.01 0.00 0.00 58.87 56.26 3ciy n SER 342 Cb 0.57 -0.40 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 3ciy n SER 342 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 3ciy s HIS 343 N -3.44 2.06 0.70 1.43 -3.43 -1.26 -4.23 115.29 107.11 3ciy s HIS 343 Ca 0.41 0.60 -0.16 0.00 -0.80 0.00 0.00 55.06 55.11 3ciy s HIS 343 Cb 0.37 -4.10 0.02 0.00 -1.43 0.00 0.00 32.58 27.45 3ciy s HIS 343 CO -0.01 -2.75 1.19 -1.25 -2.00 0.00 0.00 174.74 169.93 3ciy s PRO 344 N 5.08 2.36 -0.17 -0.38 0.04 -1.26 -4.93 135.00 135.75 3ciy s PRO 344 Ca 0.73 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 63.19 3ciy s PRO 344 Cb -0.22 -1.86 0.13 0.00 0.04 0.00 0.00 34.50 32.59 3ciy s PRO 344 CO 0.31 -1.66 1.01 0.54 0.04 0.00 0.00 177.00 177.25 3ciy s ASN 345 N -2.04 -0.36 -0.13 6.66 4.22 -1.15 -4.16 114.94 117.98 3ciy s ASN 345 Ca 0.74 0.40 -0.06 0.00 -2.14 0.00 0.00 52.86 51.79 3ciy s ASN 345 Cb -0.28 0.30 -0.04 0.00 1.28 0.00 0.00 41.25 42.51 3ciy s ASN 345 CO 0.43 -0.33 0.08 0.27 -2.04 0.00 0.00 177.10 175.51 3ciy s ILE 346 N -1.08 5.00 0.64 0.54 -4.36 -1.26 -3.84 121.20 116.83 3ciy s ILE 346 Ca -0.01 0.02 0.05 0.00 -0.26 0.00 0.00 60.65 60.45 3ciy s ILE 346 Cb -0.01 -3.19 0.10 0.00 1.25 0.00 0.00 42.46 40.62 3ciy s ILE 346 CO 0.01 0.56 0.88 1.51 0.24 0.00 0.00 174.94 178.14 3ciy s ASP 347 N -0.52 4.78 1.01 4.36 1.47 -1.21 -4.96 116.67 121.59 3ciy s ASP 347 Ca 0.11 -0.63 -0.11 0.00 1.18 0.00 0.00 52.55 53.10 3ciy s ASP 347 Cb -0.12 0.14 0.19 0.00 -0.34 0.00 0.00 42.92 42.80 3ciy s ASP 347 CO 0.02 -1.56 1.08 0.47 0.68 0.00 0.00 175.17 175.86 3ciy n ASP 348 N -2.50 -0.40 -3.98 2.11 8.00 -1.26 -3.73 116.55 114.79 3ciy n ASP 348 Ca 0.15 0.22 -0.32 0.00 0.71 0.00 0.00 54.79 55.55 3ciy n ASP 348 Cb 0.61 -1.40 -0.02 0.00 -0.02 0.00 0.00 41.12 40.29 3ciy n ASP 348 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ciy n PHE 349 N -4.50 -1.76 0.58 1.24 3.72 -1.01 -4.37 117.46 111.37 3ciy n PHE 349 Ca 0.09 0.70 0.11 0.00 -0.05 0.00 0.00 57.45 58.30 3ciy n PHE 349 Cb 0.53 -2.87 -0.08 0.00 -0.94 0.00 0.00 39.48 36.12 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 -2.53 0.59 -0.50 4.37 7.64 -1.24 -4.16 113.62 117.79 3ciy n SER 350 Ca 0.06 -0.44 0.05 0.00 1.01 0.00 0.00 58.87 59.55 3ciy n SER 350 Cb 0.50 1.18 0.08 0.00 -1.01 0.00 0.00 64.21 64.96 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 -1.86 0.17 0.17 1.43 3.72 -1.26 -4.32 117.46 115.50 3ciy n PHE 351 Ca 0.01 -0.20 0.18 0.00 -0.05 0.00 0.00 57.45 57.40 3ciy n PHE 351 Cb 0.43 -0.01 0.73 0.00 -0.94 0.00 0.00 39.48 39.69 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 2.03 0.00 0.00 -1.08 3.07 -1.70 -1.84 115.11 115.59 3ciy h GLN 352 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.58 3ciy h GLN 352 Cb 0.55 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.09 3ciy h GLN 352 CO 0.00 0.00 -0.89 -1.49 0.09 0.00 0.00 178.83 176.54 3ciy h TRP 353 N 0.00 0.00 -0.47 0.06 4.06 -1.90 -3.38 115.95 114.32 3ciy h TRP 353 Ca 0.14 0.00 -0.57 0.00 2.06 0.00 0.00 58.89 60.52 3ciy h TRP 353 Cb 1.06 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.16 3ciy h TRP 353 CO 0.00 0.72 2.13 1.28 -3.56 0.00 0.00 178.44 179.01 3ciy n LEU 354 N -3.20 7.56 0.00 -4.49 4.77 -0.69 -4.48 117.00 116.46 3ciy n LEU 354 Ca -0.02 -4.24 0.04 0.00 -0.03 0.00 0.00 56.01 51.76 3ciy n LEU 354 Cb 0.84 -1.43 0.19 0.00 -2.33 0.00 0.00 43.42 40.69 3ciy n LEU 354 CO 0.43 1.95 0.57 2.29 -1.33 0.00 0.00 177.39 181.31 3ciy n LYS 355 N 2.47 0.08 -0.05 3.23 -0.00 -1.26 -2.03 118.16 120.59 3ciy n LYS 355 Ca 0.63 0.25 0.04 0.00 -0.00 0.00 0.00 58.31 59.23 3ciy n LYS 355 Cb 0.42 -1.50 0.06 0.00 -0.00 0.00 0.00 35.03 34.01 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 -1.34 0.13 -2.25 5.58 4.01 -1.26 -4.08 117.16 117.95 3ciy n TYR 356 Ca 0.03 -0.23 -0.38 0.00 -0.16 0.00 0.00 57.90 57.16 3ciy n TYR 356 Cb 0.07 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 39.07 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 -0.78 4.16 0.00 7.72 2.96 -0.86 -4.40 118.68 127.48 3ciy s LEU 357 Ca 0.11 2.38 0.00 0.00 -0.22 0.00 0.00 54.13 56.40 3ciy s LEU 357 Cb 0.07 -4.05 0.00 0.00 0.50 0.00 0.00 46.19 42.71 3ciy s LEU 357 CO 0.09 -0.75 0.09 -1.84 -1.32 0.00 0.00 176.35 172.63 3ciy n GLU 358 N -0.03 0.61 -3.48 1.98 0.28 -0.40 -1.81 120.64 117.79 3ciy n GLU 358 Ca 0.05 -0.09 -0.21 0.00 -0.16 0.00 0.00 57.16 56.74 3ciy n GLU 358 Cb 0.46 -0.46 -0.13 0.00 1.43 0.00 0.00 31.44 32.74 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 -0.11 -0.15 -0.18 -1.84 6.04 -1.03 -1.95 117.35 118.12 3ciy s TYR 359 Ca 0.00 -0.23 -0.01 0.00 0.04 0.00 0.00 57.07 56.87 3ciy s TYR 359 Cb 0.00 -0.56 0.00 0.00 -1.04 0.00 0.00 41.96 40.37 3ciy s TYR 359 CO 0.00 -0.76 -0.13 -1.17 -1.54 0.00 0.00 175.55 171.95 3ciy s LEU 360 N 2.27 2.51 -0.09 6.97 2.96 -0.75 -1.15 118.68 131.40 3ciy s LEU 360 Ca 0.08 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.54 3ciy s LEU 360 Cb -0.15 -1.59 -0.00 0.00 0.50 0.00 0.00 46.19 44.94 3ciy s LEU 360 CO -0.25 0.03 -0.24 0.21 -1.32 0.00 0.00 176.35 174.78 3ciy s ASN 361 N 1.14 3.05 -0.22 3.68 3.84 -0.71 -2.29 114.94 123.43 3ciy s ASN 361 Ca 0.01 -0.54 0.22 0.00 0.21 0.00 0.00 52.86 52.76 3ciy s ASN 361 Cb -0.14 -1.24 0.49 0.00 -0.55 0.00 0.00 41.25 39.81 3ciy s ASN 361 CO -0.05 0.18 1.13 0.23 -2.79 0.00 0.00 177.10 175.80 3ciy n MET 362 N 3.37 1.57 -1.11 0.43 2.81 -1.00 0.14 117.12 123.33 3ciy n MET 362 Ca -0.19 -3.30 -0.29 0.00 -1.81 0.00 0.00 57.70 52.11 3ciy n MET 362 Cb 0.53 -1.39 0.20 0.00 -0.71 0.00 0.00 33.22 31.84 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 -3.49 2.08 -0.81 7.83 1.01 -1.26 -4.44 116.67 117.59 3ciy s ASP 363 Ca 0.30 1.06 -0.01 0.00 0.71 0.00 0.00 52.55 54.62 3ciy s ASP 363 Cb 0.34 -1.65 0.00 0.00 1.01 0.00 0.00 42.92 42.62 3ciy s ASP 363 CO -0.06 -3.46 0.63 -0.67 0.21 0.00 0.00 175.17 171.83 3ciy n ASP 364 N -4.38 -5.69 -3.27 0.27 -0.08 -0.74 -1.06 116.55 101.60 3ciy n ASP 364 Ca 0.06 -0.72 -0.13 0.00 -1.51 0.00 0.00 54.79 52.50 3ciy n ASP 364 Cb 0.58 -2.73 -0.03 0.00 2.34 0.00 0.00 41.12 41.27 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 -3.00 0.59 0.00 1.67 0.01 0.32 -2.69 114.94 111.84 3ciy s ASN 365 Ca 0.01 -1.34 0.11 0.00 -0.71 0.00 0.00 52.86 50.93 3ciy s ASN 365 Cb -0.00 0.69 0.21 0.00 0.41 0.00 0.00 41.25 42.56 3ciy s ASN 365 CO 0.86 -1.36 1.08 0.59 -1.51 0.00 0.00 177.10 176.75 3ciy n ASN 366 N -1.28 2.50 -4.49 -1.22 5.03 -1.25 -4.15 115.26 110.39 3ciy n ASN 366 Ca -0.01 -1.77 -0.58 0.00 0.87 0.00 0.00 54.58 53.09 3ciy n ASN 366 Cb 0.61 -0.13 -0.08 0.00 -1.02 0.00 0.00 39.78 39.16 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 0.56 0.17 0.05 2.41 -0.00 -1.06 -4.34 119.36 117.15 3ciy n ILE 367 Ca 0.09 -0.04 -0.04 0.00 -0.00 0.00 0.00 62.75 62.76 3ciy n ILE 367 Cb 0.36 -0.02 -0.02 0.00 -0.00 0.00 0.00 39.64 39.96 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 2.86 -0.19 0.00 0.38 0.11 -1.86 -2.58 132.00 130.73 3ciy h PRO 368 Ca -0.49 0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.67 3ciy h PRO 368 Cb 1.43 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.58 3ciy h PRO 368 CO 0.65 -0.13 0.37 0.45 -0.21 0.00 0.00 178.00 179.13 3ciy n SER 369 N -2.99 -1.97 -4.86 -2.05 2.88 -1.26 -1.69 113.62 101.67 3ciy n SER 369 Ca -0.02 -2.27 -0.31 0.00 -1.33 0.00 0.00 58.87 54.94 3ciy n SER 369 Cb 0.09 3.26 0.03 0.00 -0.75 0.00 0.00 64.21 66.85 3ciy n SER 369 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3ciy s THR 370 N -2.13 4.23 0.36 2.46 -4.23 -1.26 -5.02 115.64 110.05 3ciy s THR 370 Ca 0.17 0.73 0.09 0.00 -1.18 0.00 0.00 61.69 61.50 3ciy s THR 370 Cb -0.04 -3.67 -0.06 0.00 1.34 0.00 0.00 72.50 70.06 3ciy s THR 370 CO 0.09 -0.95 -0.03 -0.54 -0.54 0.00 0.00 174.62 172.65 3ciy s LYS 371 N -5.21 1.93 0.59 3.99 1.02 -1.26 -5.02 119.74 115.79 3ciy s LYS 371 Ca 0.56 -1.93 0.30 0.00 0.02 0.00 0.00 55.97 54.92 3ciy s LYS 371 Cb -0.12 -1.76 1.80 0.00 -0.52 0.00 0.00 37.83 37.24 3ciy s LYS 371 CO 0.54 0.08 2.23 0.66 -0.92 0.00 0.00 175.35 177.94 3ciy h SER 372 N 1.88 0.00 0.00 2.83 4.64 -1.89 -3.09 113.55 117.93 3ciy h SER 372 Ca -0.43 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.87 3ciy h SER 372 Cb 1.25 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 3ciy h SER 372 CO 0.72 0.00 -0.34 0.59 -0.87 0.00 0.00 176.83 176.93 3ciy n ASN 373 N -3.84 1.50 0.01 4.97 3.02 -1.26 -4.01 115.26 115.66 3ciy n ASN 373 Ca -0.02 -2.88 -0.00 0.00 -0.03 0.00 0.00 54.58 51.64 3ciy n ASN 373 Cb 0.12 -0.38 -0.00 0.00 -0.61 0.00 0.00 39.78 38.90 3ciy n ASN 373 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3ciy h THR 374 N 2.67 0.00 0.00 3.41 2.02 -1.86 -2.63 112.91 116.52 3ciy h THR 374 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3ciy h THR 374 Cb 1.20 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3ciy h THR 374 CO 0.01 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.39 3ciy n PHE 375 N -2.33 0.00 -1.98 3.16 3.72 -1.26 -4.13 117.46 114.63 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 0.01 -0.05 -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 -1.38 2.96 0.00 4.37 2.01 -1.11 -2.92 115.64 119.56 3ciy s THR 376 Ca 0.00 0.57 0.00 0.00 0.31 0.00 0.00 61.69 62.57 3ciy s THR 376 Cb 0.00 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.14 3ciy s THR 376 CO 0.00 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 3ciy n GLY 377 N 3.82 2.82 3.56 4.40 0.00 -1.26 -3.12 105.19 115.41 3ciy n GLY 377 Ca 0.14 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 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 3.18 0.00 0.99 1.43 -1.15 -4.43 118.68 118.70 3ciy s LEU 378 Ca 0.00 -0.89 0.20 0.00 -1.03 0.00 0.00 54.13 52.41 3ciy s LEU 378 Cb 0.00 -2.56 0.53 0.00 0.03 0.00 0.00 46.19 44.18 3ciy s LEU 378 CO 0.00 -2.71 1.44 1.33 0.23 0.00 0.00 176.35 176.64 3ciy n VAL 379 N 7.79 0.60 0.00 -1.59 0.24 -1.26 -3.89 118.33 120.22 3ciy n VAL 379 Ca 0.41 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 3ciy n VAL 379 Cb 0.47 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 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 1.12 1.69 -4.62 -1.34 7.64 -1.25 -4.22 113.62 112.64 3ciy n SER 380 Ca 0.19 -0.33 -0.53 0.00 1.01 0.00 0.00 58.87 59.20 3ciy n SER 380 Cb 0.49 1.00 -0.07 0.00 -1.01 0.00 0.00 64.21 64.62 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 -1.17 2.53 0.00 -3.43 0.00 -0.75 -4.38 117.00 109.80 3ciy n LEU 381 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 56.01 56.85 3ciy n LEU 381 Cb 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 43.42 42.19 3ciy n LEU 381 CO 0.00 -0.44 -0.16 2.29 0.00 0.00 0.00 177.39 179.08 3ciy n LYS 382 N 6.59 4.29 -3.76 1.96 2.85 -0.98 -2.50 118.16 126.61 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 0.19 -0.63 -0.17 0.00 -0.65 0.00 0.00 35.03 33.77 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 -1.23 1.02 -0.05 5.58 4.12 -0.82 -0.69 117.35 125.27 3ciy s TYR 383 Ca 0.00 -0.73 0.03 0.00 0.02 0.00 0.00 57.07 56.38 3ciy s TYR 383 Cb 0.00 -1.01 0.01 0.00 -1.52 0.00 0.00 41.96 39.44 3ciy s TYR 383 CO 0.00 -0.55 -0.13 -1.17 0.02 0.00 0.00 175.55 173.72 3ciy s LEU 384 N 1.86 1.73 -0.06 -1.29 2.96 -0.12 -1.81 118.68 121.94 3ciy s LEU 384 Ca 0.00 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 3ciy s LEU 384 Cb -0.16 -0.81 -0.00 0.00 0.50 0.00 0.00 46.19 45.72 3ciy s LEU 384 CO -0.07 0.07 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.28 3ciy s SER 385 N 0.44 2.43 -0.31 3.68 0.15 -0.97 -2.31 113.70 116.80 3ciy s SER 385 Ca -0.10 -0.41 0.18 0.00 0.70 0.00 0.00 55.95 56.32 3ciy s SER 385 Cb -0.14 -0.86 0.47 0.00 -1.71 0.00 0.00 66.02 63.78 3ciy s SER 385 CO 0.03 0.14 0.98 0.18 1.20 0.00 0.00 173.24 175.77 3ciy n LEU 386 N 3.33 1.55 -4.65 3.45 4.77 0.13 -2.39 117.00 123.20 3ciy n LEU 386 Ca -0.19 -3.64 -0.43 0.00 -0.03 0.00 0.00 56.01 51.72 3ciy n LEU 386 Cb 0.53 0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 42.01 3ciy n LEU 386 CO 0.26 1.50 0.91 -0.55 -1.33 0.00 0.00 177.39 178.17 3ciy s SER 387 N -3.24 7.04 -1.30 -1.43 0.15 -1.17 -3.62 113.70 110.12 3ciy s SER 387 Ca 0.28 1.28 -0.02 0.00 0.70 0.00 0.00 55.95 58.19 3ciy s SER 387 Cb 0.44 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 62.22 3ciy s SER 387 CO 0.02 -0.71 0.82 1.17 1.20 0.00 0.00 173.24 175.75 3ciy n LYS 388 N 6.42 -5.55 -0.00 5.44 4.81 -0.51 -2.26 118.16 126.52 3ciy n LYS 388 Ca 0.12 0.68 0.05 0.00 -0.87 0.00 0.00 58.31 58.29 3ciy n LYS 388 Cb 0.46 -5.41 -0.08 0.00 0.02 0.00 0.00 35.03 30.02 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 -4.31 0.00 -4.39 3.15 -1.04 -1.24 -0.52 114.28 105.93 3ciy n THR 389 Ca -0.25 -0.25 -0.27 0.00 -2.04 0.00 0.00 64.05 61.25 3ciy n THR 389 Cb 0.66 0.27 -0.11 0.00 -1.82 0.00 0.00 70.33 69.32 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 -2.74 2.40 -0.03 -1.42 0.08 -1.26 -2.57 117.98 112.44 3ciy s PHE 390 Ca -0.04 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.71 3ciy s PHE 390 Cb 0.07 -1.17 -0.03 0.00 -0.57 0.00 0.00 43.02 41.32 3ciy s PHE 390 CO 0.45 0.52 0.00 0.25 -0.10 0.00 0.00 175.22 176.34 3ciy n THR 391 N 0.14 0.18 -1.40 0.64 -2.24 -0.97 -4.76 114.28 105.86 3ciy n THR 391 Ca -0.12 -0.10 0.02 0.00 -2.27 0.00 0.00 64.05 61.58 3ciy n THR 391 Cb 0.56 -0.88 0.20 0.00 -2.10 0.00 0.00 70.33 68.11 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 -2.18 2.38 -2.33 3.42 7.64 -0.68 -4.76 113.62 117.13 3ciy n SER 392 Ca -0.04 -3.66 -0.29 0.00 1.01 0.00 0.00 58.87 55.89 3ciy n SER 392 Cb 0.58 -0.57 0.04 0.00 -1.01 0.00 0.00 64.21 63.24 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 -1.09 7.08 -0.34 -3.43 0.00 -1.24 -4.70 117.00 113.28 3ciy n LEU 393 Ca 0.26 -4.04 0.22 0.00 0.00 0.00 0.00 56.01 52.45 3ciy n LEU 393 Cb 0.87 -1.07 0.46 0.00 0.00 0.00 0.00 43.42 43.68 3ciy n LEU 393 CO 0.10 1.49 1.12 1.56 0.00 0.00 0.00 177.39 181.66 3ciy h GLN 394 N 2.19 0.36 -5.14 1.96 7.50 -1.85 -3.40 115.11 116.72 3ciy h GLN 394 Ca 0.47 -0.02 -0.57 0.00 0.50 0.00 0.00 58.65 59.02 3ciy h GLN 394 Cb 0.69 -0.08 -0.32 0.00 0.05 0.00 0.00 27.48 27.82 3ciy h GLN 394 CO 1.18 0.24 -0.84 0.99 -1.50 0.00 0.00 178.83 178.90 3ciy s THR 395 N -5.69 1.46 -0.40 -0.54 2.01 -1.26 -1.58 115.64 109.64 3ciy s THR 395 Ca -0.10 -0.71 -0.24 0.00 0.31 0.00 0.00 61.69 60.95 3ciy s THR 395 Cb 0.30 -1.27 0.02 0.00 0.01 0.00 0.00 72.50 71.55 3ciy s THR 395 CO 0.79 0.42 0.82 -0.76 -0.69 0.00 0.00 174.62 175.21 3ciy s LEU 396 N 0.22 4.12 0.35 4.42 1.43 -0.80 -5.04 118.68 123.38 3ciy s LEU 396 Ca -0.08 0.26 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 3ciy s LEU 396 Cb -0.13 -3.07 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 3ciy s LEU 396 CO 0.03 -0.83 0.44 0.42 0.23 0.00 0.00 176.35 176.64 3ciy s THR 397 N 3.28 3.69 -1.21 5.49 -4.23 -1.26 -2.36 115.64 119.05 3ciy s THR 397 Ca 0.33 -1.11 0.11 0.00 -1.18 0.00 0.00 61.69 59.83 3ciy s THR 397 Cb -0.12 -3.27 0.14 0.00 1.34 0.00 0.00 72.50 70.59 3ciy s THR 397 CO 0.20 -0.13 1.29 -0.46 -0.54 0.00 0.00 174.62 174.98 3ciy n ASN 398 N -1.60 0.00 -0.80 3.99 6.94 -1.26 -1.61 115.26 120.92 3ciy n ASN 398 Ca 0.01 0.32 0.07 0.00 -0.02 0.00 0.00 54.58 54.96 3ciy n ASN 398 Cb 0.59 -0.39 0.19 0.00 -2.36 0.00 0.00 39.78 37.80 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 -1.39 2.70 0.10 -3.83 1.02 -1.26 -4.62 120.64 113.35 3ciy n GLU 399 Ca 0.04 -2.14 -0.05 0.00 -0.02 0.00 0.00 57.16 54.99 3ciy n GLU 399 Cb 0.10 -1.34 -0.02 0.00 -0.02 0.00 0.00 31.44 30.16 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 2.61 0.00 -0.32 2.62 2.02 -1.61 -3.34 112.91 114.89 3ciy h THR 400 Ca 0.00 -0.38 -0.15 0.00 0.77 0.00 0.00 66.41 66.65 3ciy h THR 400 Cb 0.78 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.10 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 -3.86 1.00 -0.21 3.16 3.72 -1.26 -4.29 117.46 115.73 3ciy n PHE 401 Ca -0.04 -0.83 -0.08 0.00 -0.05 0.00 0.00 57.45 56.45 3ciy n PHE 401 Cb 0.12 -0.45 0.02 0.00 -0.94 0.00 0.00 39.48 38.24 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 0.54 1.23 -1.00 -4.37 3.04 -1.82 -2.87 116.25 110.99 3ciy h VAL 402 Ca 0.18 -0.74 0.23 0.00 -1.01 0.00 0.00 66.70 65.36 3ciy h VAL 402 Cb 1.53 0.63 -0.10 0.00 -2.01 0.00 0.00 31.29 31.34 3ciy h VAL 402 CO 0.34 0.28 0.63 0.28 -1.01 0.00 0.00 177.57 178.09 3ciy h SER 403 N 0.80 0.61 -0.03 3.17 0.02 -1.75 0.14 113.55 116.51 3ciy h SER 403 Ca 0.19 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3ciy h SER 403 Cb 0.23 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 3ciy h SER 403 CO -0.01 0.17 0.00 0.18 -1.14 0.00 0.00 176.83 176.03 3ciy n LEU 404 N -4.71 1.39 0.10 5.07 4.77 -1.08 -3.95 117.00 118.58 3ciy n LEU 404 Ca 0.24 -0.70 -0.13 0.00 -0.03 0.00 0.00 56.01 55.39 3ciy n LEU 404 Cb 0.72 -0.51 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3ciy n LEU 404 CO 0.23 0.29 0.80 0.00 -1.33 0.00 0.00 177.39 177.37 3ciy h ALA 405 N 2.09 -0.17 -0.48 -1.18 0.00 -0.83 -3.14 119.26 115.55 3ciy h ALA 405 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ciy h ALA 405 Cb 0.62 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3ciy h ALA 405 CO 0.03 -0.56 0.00 0.72 0.00 0.00 0.00 179.25 179.43 3ciy n HIS 406 N -5.13 0.94 -3.70 0.00 8.25 -1.26 -4.83 115.22 109.48 3ciy n HIS 406 Ca -0.08 -0.40 -0.36 0.00 -0.26 0.00 0.00 57.72 56.62 3ciy n HIS 406 Cb 0.12 -0.12 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 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 -0.85 6.02 -0.59 0.41 0.01 -1.19 -4.54 113.70 112.97 3ciy s SER 407 Ca 0.36 0.09 -0.22 0.00 1.31 0.00 0.00 55.95 57.49 3ciy s SER 407 Cb 0.22 -2.08 -0.19 0.00 0.21 0.00 0.00 66.02 64.17 3ciy s SER 407 CO 0.20 0.07 1.84 -0.81 0.41 0.00 0.00 173.24 174.94 3ciy n PRO 408 N 4.25 1.17 -2.74 12.44 -0.04 -1.13 -4.90 135.00 144.05 3ciy n PRO 408 Ca -0.15 -1.58 -0.42 0.00 -0.04 0.00 0.00 63.50 61.31 3ciy n PRO 408 Cb 0.52 -2.75 -0.03 0.00 -0.04 0.00 0.00 33.50 31.20 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 0.77 4.33 -0.05 1.53 1.43 -1.04 -3.61 118.68 122.04 3ciy s LEU 409 Ca 0.56 1.56 0.03 0.00 -1.03 0.00 0.00 54.13 55.25 3ciy s LEU 409 Cb 0.14 -3.51 -0.05 0.00 0.03 0.00 0.00 46.19 42.80 3ciy s LEU 409 CO 0.15 -0.30 -0.01 0.18 0.23 0.00 0.00 176.35 176.60 3ciy n LEU 410 N 4.21 1.24 -4.36 1.79 4.32 0.13 -1.02 117.00 123.30 3ciy n LEU 410 Ca 0.06 -0.01 -0.32 0.00 -0.02 0.00 0.00 56.01 55.72 3ciy n LEU 410 Cb 0.50 -0.02 -0.15 0.00 -1.62 0.00 0.00 43.42 42.14 3ciy n LEU 410 CO 0.51 0.32 -0.51 -0.89 -1.22 0.00 0.00 177.39 175.60 3ciy s THR 411 N -2.12 2.52 -0.28 -5.08 2.01 -0.72 0.35 115.64 112.31 3ciy s THR 411 Ca -0.05 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.04 3ciy s THR 411 Cb 0.02 -1.95 0.14 0.00 0.01 0.00 0.00 72.50 70.72 3ciy s THR 411 CO 0.17 0.58 0.34 -0.22 -0.69 0.00 0.00 174.62 174.80 3ciy s LEU 412 N -0.43 -0.47 -0.24 4.42 2.96 -0.46 -0.95 118.68 123.51 3ciy s LEU 412 Ca 0.05 -0.52 -0.16 0.00 -0.22 0.00 0.00 54.13 53.27 3ciy s LEU 412 Cb -0.12 0.77 -0.04 0.00 0.50 0.00 0.00 46.19 47.31 3ciy s LEU 412 CO 0.02 -0.37 0.41 0.21 -1.32 0.00 0.00 176.35 175.30 3ciy s ASN 413 N 2.44 6.36 -0.07 3.68 3.84 -0.98 -1.04 114.94 129.17 3ciy s ASN 413 Ca 0.10 0.42 0.10 0.00 0.21 0.00 0.00 52.86 53.69 3ciy s ASN 413 Cb -0.14 -2.23 0.16 0.00 -0.55 0.00 0.00 41.25 38.49 3ciy s ASN 413 CO -0.30 -0.16 1.06 0.18 -2.79 0.00 0.00 177.10 175.09 3ciy n LEU 414 N 5.04 1.99 -4.74 3.21 4.77 0.97 0.22 117.00 128.46 3ciy n LEU 414 Ca -0.08 -2.45 -0.38 0.00 -0.03 0.00 0.00 56.01 53.08 3ciy n LEU 414 Cb 0.51 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3ciy n LEU 414 CO 0.39 0.58 0.95 0.42 -1.33 0.00 0.00 177.39 178.39 3ciy s THR 415 N -1.91 2.06 -1.00 -5.08 -4.23 -1.18 -3.84 115.64 100.46 3ciy s THR 415 Ca 0.17 0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 60.69 3ciy s THR 415 Cb 0.15 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.93 3ciy s THR 415 CO 0.02 -0.00 0.86 0.29 -0.54 0.00 0.00 174.62 175.24 3ciy n LYS 416 N -1.44 -3.63 0.00 3.99 5.02 -0.75 -1.45 118.16 119.90 3ciy n LYS 416 Ca 0.13 0.78 0.00 0.00 -2.02 0.00 0.00 58.31 57.19 3ciy n LYS 416 Cb 0.46 -5.46 0.00 0.00 -0.02 0.00 0.00 35.03 30.02 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 -3.00 0.26 -0.25 4.39 3.02 -1.25 -1.42 115.26 117.01 3ciy n ASN 417 Ca -0.14 -0.64 -0.03 0.00 -0.03 0.00 0.00 54.58 53.74 3ciy n ASN 417 Cb 0.63 0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 40.03 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 -0.25 0.00 -1.68 3.10 8.25 -1.26 -4.67 115.22 118.71 3ciy n HIS 418 Ca 0.00 0.00 -0.51 0.00 -0.26 0.00 0.00 57.72 56.95 3ciy n HIS 418 Cb 0.06 -0.99 -0.05 0.00 1.12 0.00 0.00 29.99 30.13 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 -2.79 0.32 0.11 1.59 5.41 -1.26 -4.24 119.36 118.50 3ciy n ILE 419 Ca -0.03 -0.06 0.01 0.00 1.00 0.00 0.00 62.75 63.67 3ciy n ILE 419 Cb 0.17 -1.49 -0.02 0.00 -0.71 0.00 0.00 39.64 37.59 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 5.15 0.76 -3.68 4.38 3.41 -0.61 0.36 113.62 123.38 3ciy n SER 420 Ca 0.22 -0.48 -0.10 0.00 -0.26 0.00 0.00 58.87 58.25 3ciy n SER 420 Cb 0.23 1.02 -0.10 0.00 -0.26 0.00 0.00 64.21 65.11 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 -1.39 0.51 -0.26 4.33 2.20 -1.25 -0.35 119.74 123.53 3ciy s LYS 421 Ca 0.01 0.87 0.03 0.00 -0.36 0.00 0.00 55.97 56.52 3ciy s LYS 421 Cb 0.02 0.09 0.06 0.00 -1.51 0.00 0.00 37.83 36.49 3ciy s LYS 421 CO 0.11 -0.14 -0.10 0.42 -0.36 0.00 0.00 175.35 175.29 3ciy s ILE 422 N 1.19 2.13 0.96 5.43 1.01 -1.26 -1.91 121.20 128.75 3ciy s ILE 422 Ca -0.07 -1.64 -0.13 0.00 0.00 0.00 0.00 60.65 58.80 3ciy s ILE 422 Cb -0.06 -2.27 0.17 0.00 0.01 0.00 0.00 42.46 40.30 3ciy s ILE 422 CO -0.11 -0.06 1.13 0.00 0.00 0.00 0.00 174.94 175.90 3ciy s ALA 423 N 1.11 1.50 0.48 9.38 0.00 -0.99 -4.81 121.76 128.43 3ciy s ALA 423 Ca -0.08 -0.56 -0.23 0.00 0.00 0.00 0.00 51.96 51.09 3ciy s ALA 423 Cb -0.20 -3.03 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 3ciy s ALA 423 CO -0.05 -2.53 1.16 0.09 0.00 0.00 0.00 175.76 174.42 3ciy n ASN 424 N -3.95 1.89 -1.59 0.00 4.13 -1.26 -2.86 115.26 111.62 3ciy n ASN 424 Ca 0.07 1.01 -0.18 0.00 1.68 0.00 0.00 54.58 57.15 3ciy n ASN 424 Cb 0.59 -1.45 -0.07 0.00 -1.54 0.00 0.00 39.78 37.30 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 1.60 0.30 7.41 0.00 -1.22 -4.45 105.19 109.82 3ciy n GLY 425 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 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 0.60 -0.10 2.61 2.02 -1.75 -2.65 112.91 113.63 3ciy h THR 426 Ca -0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.80 3ciy h THR 426 Cb 1.20 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3ciy h THR 426 CO 0.55 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.93 3ciy n PHE 427 N -3.96 0.13 -0.42 3.16 3.72 -1.26 -4.49 117.46 114.34 3ciy n PHE 427 Ca -0.02 -0.34 0.37 0.00 -0.05 0.00 0.00 57.45 57.40 3ciy n PHE 427 Cb 0.11 -0.03 0.71 0.00 -0.94 0.00 0.00 39.48 39.33 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 0.86 0.12 1.51 4.37 4.64 -1.31 0.11 113.55 123.84 3ciy h SER 428 Ca 0.00 0.04 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 3ciy h SER 428 Cb 0.47 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 3ciy h SER 428 CO 0.00 -0.01 -0.36 -0.50 -0.87 0.00 0.00 176.83 175.09 3ciy h TRP 429 N 0.08 0.00 -0.30 4.77 4.06 -1.86 -3.35 115.95 119.36 3ciy h TRP 429 Ca 0.68 0.00 -0.68 0.00 2.06 0.00 0.00 58.89 60.95 3ciy h TRP 429 Cb 2.47 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 30.62 3ciy h TRP 429 CO -0.00 0.36 3.45 1.28 -3.56 0.00 0.00 178.44 179.97 3ciy n LEU 430 N -3.23 8.57 -0.12 -4.49 4.32 0.36 -4.53 117.00 117.88 3ciy n LEU 430 Ca 0.02 -4.49 -0.06 0.00 -0.02 0.00 0.00 56.01 51.46 3ciy n LEU 430 Cb 0.65 -1.51 0.00 0.00 -1.62 0.00 0.00 43.42 40.94 3ciy n LEU 430 CO 0.38 2.07 0.69 1.23 -1.22 0.00 0.00 177.39 180.54 3ciy h GLY 431 N 6.61 -0.01 -0.94 -0.72 0.00 -1.73 -2.47 103.07 103.80 3ciy h GLY 431 Ca 0.83 0.31 0.00 0.00 0.00 0.00 0.00 47.33 48.47 3ciy h GLY 431 CO 1.69 -0.21 0.00 -1.06 0.00 0.00 0.00 176.54 176.97 3ciy n GLN 432 N -5.40 1.60 -1.88 4.80 6.02 -1.26 -3.59 117.38 117.67 3ciy n GLN 432 Ca 0.02 -0.82 -0.41 0.00 -0.01 0.00 0.00 57.00 55.77 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 -0.98 4.36 -0.05 1.08 2.96 -0.19 -4.25 118.68 121.61 3ciy s LEU 433 Ca 0.15 2.82 -0.02 0.00 -0.22 0.00 0.00 54.13 56.86 3ciy s LEU 433 Cb 0.08 -3.63 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 3ciy s LEU 433 CO 0.10 -0.82 -0.06 0.54 -1.32 0.00 0.00 176.35 174.78 3ciy n ARG 434 N 2.31 0.11 -3.91 1.98 1.74 -0.31 -3.51 116.66 115.07 3ciy n ARG 434 Ca 0.08 0.04 -0.35 0.00 -0.77 0.00 0.00 57.85 56.85 3ciy n ARG 434 Cb 0.39 -0.80 -0.14 0.00 -1.02 0.00 0.00 32.46 30.89 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 -2.10 3.06 -0.02 0.55 1.09 0.15 0.22 121.20 124.15 3ciy s ILE 435 Ca -0.07 -1.19 0.07 0.00 -1.10 0.00 0.00 60.65 58.36 3ciy s ILE 435 Cb 0.02 -2.67 -0.02 0.00 -1.06 0.00 0.00 42.46 38.73 3ciy s ILE 435 CO 0.10 0.01 -0.23 -0.22 -0.10 0.00 0.00 174.94 174.50 3ciy s LEU 436 N 1.30 2.24 -0.22 2.97 0.20 -1.04 -1.36 118.68 122.76 3ciy s LEU 436 Ca -0.03 -0.41 -0.02 0.00 0.69 0.00 0.00 54.13 54.36 3ciy s LEU 436 Cb -0.18 -1.39 0.07 0.00 -0.43 0.00 0.00 46.19 44.25 3ciy s LEU 436 CO -0.02 0.32 0.05 -0.62 -0.29 0.00 0.00 176.35 175.79 3ciy s ASP 437 N -0.70 3.19 -0.42 3.68 3.68 -0.21 -2.52 116.67 123.38 3ciy s ASP 437 Ca 0.11 -1.01 0.04 0.00 2.13 0.00 0.00 52.55 53.82 3ciy s ASP 437 Cb -0.10 -0.67 0.45 0.00 -1.45 0.00 0.00 42.92 41.16 3ciy s ASP 437 CO -0.00 -0.33 1.46 0.18 0.13 0.00 0.00 175.17 176.61 3ciy n LEU 438 N 5.00 5.81 -4.93 -1.34 4.77 -0.50 -0.02 117.00 125.79 3ciy n LEU 438 Ca -0.08 -4.63 -0.26 0.00 -0.03 0.00 0.00 56.01 51.01 3ciy n LEU 438 Cb 0.46 -0.55 0.08 0.00 -2.33 0.00 0.00 43.42 41.07 3ciy n LEU 438 CO 0.13 1.92 0.62 -0.83 -1.33 0.00 0.00 177.39 177.89 3ciy s GLY 439 N -3.02 1.70 -1.37 -0.72 0.00 -1.21 -4.36 107.32 98.34 3ciy s GLY 439 Ca 0.55 -0.99 -0.06 0.00 0.00 0.00 0.00 44.72 44.22 3ciy s GLY 439 CO 0.01 -0.56 0.43 1.04 0.00 0.00 0.00 173.10 174.02 3ciy n LEU 440 N -2.95 -1.95 -4.41 0.66 4.77 -0.32 -3.13 117.00 109.67 3ciy n LEU 440 Ca 0.09 -1.08 -0.22 0.00 -0.03 0.00 0.00 56.01 54.77 3ciy n LEU 440 Cb 0.60 -2.10 -0.09 0.00 -2.33 0.00 0.00 43.42 39.51 3ciy n LEU 440 CO 0.51 0.48 -0.19 0.20 -1.33 0.00 0.00 177.39 177.06 3ciy s ASN 441 N -4.17 2.09 -0.07 -1.43 0.01 -0.93 -1.82 114.94 108.62 3ciy s ASN 441 Ca 0.11 -1.62 0.14 0.00 -0.71 0.00 0.00 52.86 50.79 3ciy s ASN 441 Cb -0.05 0.42 0.55 0.00 0.41 0.00 0.00 41.25 42.58 3ciy s ASN 441 CO 0.91 -0.91 1.42 1.21 -1.51 0.00 0.00 177.10 178.23 3ciy n GLU 442 N -0.72 2.99 -1.72 -0.60 4.07 -0.09 -3.83 120.64 120.73 3ciy n GLU 442 Ca -0.01 -2.17 -0.63 0.00 -0.06 0.00 0.00 57.16 54.29 3ciy n GLU 442 Cb 0.65 -1.71 -0.09 0.00 -0.06 0.00 0.00 31.44 30.23 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 0.86 0.14 -3.39 6.31 5.41 0.16 -4.20 119.36 124.64 3ciy n ILE 443 Ca 0.20 -0.03 -0.27 0.00 1.00 0.00 0.00 62.75 63.65 3ciy n ILE 443 Cb 0.68 -0.83 -0.10 0.00 -0.71 0.00 0.00 39.64 38.67 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 3.33 0.78 0.38 0.38 2.12 0.53 -2.23 118.70 123.99 3ciy s GLU 444 Ca 1.02 -1.77 -0.14 0.00 0.36 0.00 0.00 54.97 54.44 3ciy s GLU 444 Cb -1.30 -1.30 0.05 0.00 0.26 0.00 0.00 34.13 31.83 3ciy s GLU 444 CO 0.74 -1.32 0.76 1.14 -0.54 0.00 0.00 175.26 176.04 3ciy s GLN 445 N 0.47 2.21 -0.34 4.30 -2.07 -1.08 -4.81 119.66 118.34 3ciy s GLN 445 Ca 0.27 -1.48 -0.00 0.00 -1.82 0.00 0.00 55.36 52.33 3ciy s GLN 445 Cb -0.06 0.61 0.08 0.00 -1.09 0.00 0.00 33.01 32.55 3ciy s GLN 445 CO -0.12 -1.02 0.06 -1.59 -1.32 0.00 0.00 175.29 171.30 3ciy s LYS 446 N -2.38 2.03 -0.17 9.60 -2.85 -1.26 -2.94 119.74 121.77 3ciy s LYS 446 Ca 0.17 -1.61 -0.37 0.00 -1.00 0.00 0.00 55.97 53.16 3ciy s LYS 446 Cb -0.05 -3.28 -0.14 0.00 -2.06 0.00 0.00 37.83 32.30 3ciy s LYS 446 CO 0.12 -0.84 1.79 1.28 0.10 0.00 0.00 175.35 177.81 3ciy n LEU 447 N 4.50 2.86 -2.26 2.77 4.77 -1.01 -4.87 117.00 123.77 3ciy n LEU 447 Ca -0.05 1.03 -0.24 0.00 -0.03 0.00 0.00 56.01 56.72 3ciy n LEU 447 Cb 0.42 -1.25 0.01 0.00 -2.33 0.00 0.00 43.42 40.27 3ciy n LEU 447 CO 0.27 -0.28 0.17 -1.54 -1.33 0.00 0.00 177.39 174.68 3ciy n SER 448 N 5.81 4.59 0.00 -1.43 3.41 -1.26 -3.64 113.62 121.10 3ciy n SER 448 Ca 0.24 -3.63 0.00 0.00 -0.26 0.00 0.00 58.87 55.22 3ciy n SER 448 Cb 0.21 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 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 -0.59 0.55 0.10 5.00 0.00 -1.04 -4.65 105.19 104.57 3ciy n GLY 449 Ca 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.38 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 0.09 0.00 0.00 1.61 1.08 -1.85 -3.18 115.11 112.86 3ciy h GLN 450 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3ciy h GLN 450 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3ciy h GLN 450 CO 0.00 0.77 0.12 1.05 -0.95 0.00 0.00 178.83 179.81 3ciy h GLU 451 N 0.00 0.00 -0.44 1.46 9.09 -1.83 0.84 114.58 123.70 3ciy h GLU 451 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.40 3ciy h GLU 451 Cb 1.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.56 3ciy h GLU 451 CO 0.10 0.00 0.00 0.91 0.05 0.00 0.00 179.01 180.07 3ciy n TRP 452 N -2.92 1.23 -1.93 2.06 5.03 -1.20 -4.47 117.44 115.25 3ciy n TRP 452 Ca -0.02 -0.72 -0.43 0.00 3.03 0.00 0.00 57.50 59.36 3ciy n TRP 452 Cb 0.17 -0.29 -0.03 0.00 -1.03 0.00 0.00 31.31 30.14 3ciy n TRP 452 CO 0.00 0.00 0.00 0.50 -0.03 0.00 0.00 177.69 178.16 3ciy s ARG 453 N -2.26 3.59 0.00 -0.99 3.52 0.28 -2.53 118.95 120.56 3ciy s ARG 453 Ca 0.44 1.80 0.00 0.00 -0.13 0.00 0.00 55.73 57.84 3ciy s ARG 453 Cb 0.32 -4.16 0.00 0.00 -1.56 0.00 0.00 34.95 29.55 3ciy s ARG 453 CO 0.16 -1.56 0.00 0.41 -0.81 0.00 0.00 175.30 173.50 3ciy n GLY 454 N 5.07 1.05 2.70 8.12 0.00 -1.26 -2.83 105.19 118.04 3ciy n GLY 454 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 7.15 -0.30 0.99 4.77 -1.05 -4.21 117.00 124.35 3ciy n LEU 455 Ca 0.00 -4.43 -0.11 0.00 -0.03 0.00 0.00 56.01 51.45 3ciy n LEU 455 Cb 0.00 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 39.46 3ciy n LEU 455 CO 0.00 1.42 0.51 -0.09 -1.33 0.00 0.00 177.39 177.90 3ciy h ARG 456 N 5.64 -0.16 -3.12 3.23 2.43 -1.85 -3.25 114.38 117.31 3ciy h ARG 456 Ca 0.56 0.01 -0.62 0.00 -0.81 0.00 0.00 59.98 59.11 3ciy h ARG 456 Cb 0.56 0.04 -0.41 0.00 -0.42 0.00 0.00 29.97 29.73 3ciy h ARG 456 CO 1.74 -0.10 -0.62 0.54 -1.51 0.00 0.00 179.97 180.02 3ciy s ASN 457 N -5.30 4.44 -0.18 -3.80 4.22 -1.25 -4.81 114.94 108.25 3ciy s ASN 457 Ca -0.13 -3.51 -0.07 0.00 -2.14 0.00 0.00 52.86 47.01 3ciy s ASN 457 Cb 0.11 -1.54 -0.04 0.00 1.28 0.00 0.00 41.25 41.06 3ciy s ASN 457 CO 0.63 -0.14 0.04 -0.51 -2.04 0.00 0.00 177.10 175.08 3ciy s ILE 458 N -0.95 4.54 0.00 0.54 1.10 -1.23 -3.88 121.20 121.32 3ciy s ILE 458 Ca 0.23 -0.12 0.00 0.00 -0.51 0.00 0.00 60.65 60.25 3ciy s ILE 458 Cb -0.11 -3.04 0.00 0.00 0.15 0.00 0.00 42.46 39.46 3ciy s ILE 458 CO -0.11 0.46 0.00 0.33 -2.11 0.00 0.00 174.94 173.51 3ciy n PHE 459 N 3.65 0.00 -4.25 3.50 7.35 0.59 -3.33 117.46 124.97 3ciy n PHE 459 Ca -0.17 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.30 3ciy n PHE 459 Cb 0.52 -0.38 -0.12 0.00 0.35 0.00 0.00 39.48 39.85 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 -0.90 1.04 -0.43 -4.13 -1.05 -0.85 -0.22 118.70 112.16 3ciy s GLU 460 Ca 0.00 -1.11 0.02 0.00 -0.15 0.00 0.00 54.97 53.73 3ciy s GLU 460 Cb 0.00 -1.22 0.13 0.00 -0.44 0.00 0.00 34.13 32.60 3ciy s GLU 460 CO 0.00 0.28 0.21 0.42 0.95 0.00 0.00 175.26 177.12 3ciy s ILE 461 N -1.23 1.64 -0.41 1.83 1.01 -0.49 -2.51 121.20 121.04 3ciy s ILE 461 Ca 0.04 -2.53 -0.29 0.00 0.00 0.00 0.00 60.65 57.87 3ciy s ILE 461 Cb -0.10 -2.16 0.01 0.00 0.01 0.00 0.00 42.46 40.23 3ciy s ILE 461 CO 0.04 -0.82 1.30 -0.47 0.00 0.00 0.00 174.94 174.98 3ciy s TYR 462 N 0.45 2.61 -0.11 3.97 5.04 -1.05 -2.79 117.35 125.47 3ciy s TYR 462 Ca 0.16 0.75 0.15 0.00 -2.44 0.00 0.00 57.07 55.68 3ciy s TYR 462 Cb -0.23 -4.24 0.33 0.00 0.35 0.00 0.00 41.96 38.16 3ciy s TYR 462 CO -0.04 -1.67 1.16 -0.11 -1.34 0.00 0.00 175.55 173.55 3ciy n LEU 463 N 8.22 1.82 -4.80 6.97 7.94 -1.09 -1.41 117.00 134.67 3ciy n LEU 463 Ca 0.15 -2.84 -0.35 0.00 -1.11 0.00 0.00 56.01 51.86 3ciy n LEU 463 Cb 0.48 -0.30 -0.06 0.00 0.53 0.00 0.00 43.42 44.06 3ciy n LEU 463 CO 0.69 0.86 0.66 -0.44 -1.11 0.00 0.00 177.39 178.04 3ciy s SER 464 N -2.53 7.15 -0.06 1.96 0.01 -1.24 -4.60 113.70 114.38 3ciy s SER 464 Ca 0.30 1.80 -0.00 0.00 1.31 0.00 0.00 55.95 59.35 3ciy s SER 464 Cb 0.30 -2.57 -0.00 0.00 0.21 0.00 0.00 66.02 63.96 3ciy s SER 464 CO -0.06 -0.21 0.05 -1.22 0.41 0.00 0.00 173.24 172.22 3ciy n TYR 465 N 0.07 -0.16 -4.32 2.43 4.01 0.55 -1.17 117.16 118.57 3ciy n TYR 465 Ca 0.04 0.06 -0.16 0.00 -0.16 0.00 0.00 57.90 57.67 3ciy n TYR 465 Cb 0.51 -2.46 -0.05 0.00 -0.31 0.00 0.00 39.34 37.04 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 -1.52 1.14 -0.03 7.72 4.13 -1.11 -2.19 115.26 123.39 3ciy n ASN 466 Ca -0.00 -2.39 -0.15 0.00 1.68 0.00 0.00 54.58 53.71 3ciy n ASN 466 Cb 0.51 0.66 -0.13 0.00 -1.54 0.00 0.00 39.78 39.28 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 0.10 -1.88 3.52 1.79 -1.62 -3.40 116.57 115.08 3ciy h LYS 467 Ca -0.20 -0.15 0.01 0.00 -2.18 0.00 0.00 60.65 58.13 3ciy h LYS 467 Cb 0.78 0.05 -0.23 0.00 -1.58 0.00 0.00 32.23 31.25 3ciy h LYS 467 CO 0.32 1.00 0.17 -0.47 -1.08 0.00 0.00 179.45 179.39 3ciy s TYR 468 N -2.62 -0.81 -0.47 -1.35 6.14 -0.95 -4.57 117.35 112.72 3ciy s TYR 468 Ca -0.17 1.79 0.05 0.00 0.64 0.00 0.00 57.07 59.38 3ciy s TYR 468 Cb -0.01 0.41 0.19 0.00 0.42 0.00 0.00 41.96 42.97 3ciy s TYR 468 CO 0.73 -0.39 0.42 1.28 0.64 0.00 0.00 175.55 178.23 3ciy n LEU 469 N 3.26 0.44 -4.71 6.97 4.77 -1.13 -2.65 117.00 123.95 3ciy n LEU 469 Ca -0.16 -4.63 -0.42 0.00 -0.03 0.00 0.00 56.01 50.77 3ciy n LEU 469 Cb 0.57 0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.91 3ciy n LEU 469 CO 0.01 1.89 1.12 -1.58 -1.33 0.00 0.00 177.39 177.50 3ciy s GLN 470 N -0.55 4.29 0.22 3.23 0.74 -1.15 -3.71 119.66 122.72 3ciy s GLN 470 Ca 0.32 2.15 0.05 0.00 0.05 0.00 0.00 55.36 57.93 3ciy s GLN 470 Cb 0.06 -3.27 -0.03 0.00 1.10 0.00 0.00 33.01 30.86 3ciy s GLN 470 CO -0.17 -0.51 0.26 -0.51 -0.55 0.00 0.00 175.29 173.82 3ciy s LEU 471 N 1.31 4.09 0.40 3.68 1.43 -0.81 -2.40 118.68 126.38 3ciy s LEU 471 Ca 0.66 -0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.76 3ciy s LEU 471 Cb -0.38 -2.64 -0.03 0.00 0.03 0.00 0.00 46.19 43.16 3ciy s LEU 471 CO 0.30 -0.02 0.10 -0.94 0.23 0.00 0.00 176.35 176.03 3ciy s SER 472 N -3.69 2.82 0.00 2.29 1.04 -1.24 -4.78 113.70 110.14 3ciy s SER 472 Ca 0.33 -1.61 0.11 0.00 0.48 0.00 0.00 55.95 55.26 3ciy s SER 472 Cb -0.09 0.39 0.52 0.00 0.10 0.00 0.00 66.02 66.94 3ciy s SER 472 CO 0.27 -0.86 1.34 1.07 0.98 0.00 0.00 173.24 176.03 3ciy n THR 473 N -0.90 1.06 -0.10 2.02 5.66 -1.26 -2.93 114.28 117.82 3ciy n THR 473 Ca -0.06 0.27 0.00 0.00 -3.05 0.00 0.00 64.05 61.20 3ciy n THR 473 Cb 0.65 -1.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.36 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 -1.43 0.98 -0.28 1.09 2.88 -1.26 -4.73 113.62 110.86 3ciy n SER 474 Ca 0.04 -1.08 0.23 0.00 -1.33 0.00 0.00 58.87 56.72 3ciy n SER 474 Cb 0.12 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 64.01 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 -0.04 0.17 -0.14 -3.46 7.64 -1.15 -1.66 113.62 114.98 3ciy n SER 475 Ca 0.00 1.43 0.02 0.00 1.01 0.00 0.00 58.87 61.33 3ciy n SER 475 Cb 0.05 -0.64 0.02 0.00 -1.01 0.00 0.00 64.21 62.62 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 -5.03 0.01 -0.15 1.43 3.72 -1.26 -2.49 117.46 113.69 3ciy n PHE 476 Ca 0.29 -0.04 0.28 0.00 -0.05 0.00 0.00 57.45 57.92 3ciy n PHE 476 Cb 0.97 -0.00 0.72 0.00 -0.94 0.00 0.00 39.48 40.22 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 0.65 2.77 0.00 4.37 0.00 -1.58 -0.19 119.26 125.28 3ciy h ALA 477 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ciy h ALA 477 Cb 0.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3ciy h ALA 477 CO 0.00 -1.09 0.00 1.25 0.00 0.00 0.00 179.25 179.41 3ciy h LEU 478 N 0.00 0.00 -6.85 0.00 6.46 -1.78 -3.39 115.31 109.76 3ciy h LEU 478 Ca 0.41 0.00 -0.61 0.00 -0.12 0.00 0.00 57.88 57.56 3ciy h LEU 478 Cb 1.69 0.00 -0.40 0.00 -0.73 0.00 0.00 40.66 41.22 3ciy h LEU 478 CO -0.00 0.00 -0.72 0.68 -0.62 0.00 0.00 178.44 177.77 3ciy s VAL 479 N -3.33 1.91 -0.79 1.05 -7.23 -0.08 -4.89 120.40 107.04 3ciy s VAL 479 Ca 0.06 -3.55 0.06 0.00 -1.81 0.00 0.00 61.98 56.73 3ciy s VAL 479 Cb 0.08 -2.27 0.34 0.00 0.56 0.00 0.00 36.38 35.08 3ciy s VAL 479 CO 0.60 -1.06 1.04 -0.81 -0.31 0.00 0.00 175.10 174.56 3ciy n PRO 480 N 2.44 2.57 -0.03 4.82 -0.04 -1.26 -3.66 135.00 139.84 3ciy n PRO 480 Ca 0.22 -1.31 0.12 0.00 -0.04 0.00 0.00 63.50 62.49 3ciy n PRO 480 Cb 0.39 -1.78 0.20 0.00 -0.04 0.00 0.00 33.50 32.27 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 0.27 2.77 -4.74 3.54 7.64 -1.26 -4.39 113.62 117.45 3ciy n SER 481 Ca 0.12 -1.91 -0.41 0.00 1.01 0.00 0.00 58.87 57.67 3ciy n SER 481 Cb 0.62 -0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.76 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 -1.92 4.39 -0.13 -3.43 1.43 -1.21 -4.44 118.68 113.36 3ciy s LEU 482 Ca 0.31 2.62 -0.09 0.00 -1.03 0.00 0.00 54.13 55.95 3ciy s LEU 482 Cb 0.20 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.75 3ciy s LEU 482 CO 0.31 -0.69 -0.21 0.00 0.23 0.00 0.00 176.35 175.98 3ciy n GLN 483 N 2.57 0.33 -5.18 1.70 1.13 0.69 -2.05 117.38 116.57 3ciy n GLN 483 Ca 0.07 0.14 -0.32 0.00 -1.94 0.00 0.00 57.00 54.96 3ciy n GLN 483 Cb 0.40 -1.07 -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 -2.38 2.55 -0.23 -1.09 0.52 -1.21 -0.75 118.95 116.36 3ciy s ARG 484 Ca -0.21 -0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 54.11 3ciy s ARG 484 Cb 0.07 -2.21 0.08 0.00 0.52 0.00 0.00 34.95 33.40 3ciy s ARG 484 CO 0.27 0.43 0.08 -1.17 0.02 0.00 0.00 175.30 174.93 3ciy s LEU 485 N -0.27 1.01 -0.06 2.53 2.96 -0.57 -1.39 118.68 122.89 3ciy s LEU 485 Ca -0.00 -1.02 -0.11 0.00 -0.22 0.00 0.00 54.13 52.78 3ciy s LEU 485 Cb -0.13 -0.50 -0.05 0.00 0.50 0.00 0.00 46.19 46.01 3ciy s LEU 485 CO 0.03 -0.37 0.29 -0.04 -1.32 0.00 0.00 176.35 174.94 3ciy s MET 486 N 1.94 3.72 -0.32 1.98 -1.94 -1.12 -2.01 119.30 121.55 3ciy s MET 486 Ca 0.04 0.17 0.18 0.00 -1.71 0.00 0.00 55.69 54.36 3ciy s MET 486 Cb -0.17 -3.21 0.46 0.00 2.01 0.00 0.00 34.83 33.92 3ciy s MET 486 CO -0.18 0.72 1.07 1.28 -0.01 0.00 0.00 175.02 177.90 3ciy n LEU 487 N 1.94 0.83 -4.78 -0.03 7.99 0.08 -2.65 117.00 120.37 3ciy n LEU 487 Ca -0.17 -3.50 -0.36 0.00 -0.01 0.00 0.00 56.01 51.97 3ciy n LEU 487 Cb 0.53 0.36 -0.04 0.00 -0.11 0.00 0.00 43.42 44.17 3ciy n LEU 487 CO 0.35 1.50 0.73 -0.60 -1.51 0.00 0.00 177.39 177.86 3ciy s ARG 488 N -2.62 4.13 -0.64 3.23 3.52 -1.26 -4.07 118.95 121.24 3ciy s ARG 488 Ca 0.25 1.48 -0.15 0.00 -0.13 0.00 0.00 55.73 57.19 3ciy s ARG 488 Cb 0.42 -2.49 0.02 0.00 -1.56 0.00 0.00 34.95 31.34 3ciy s ARG 488 CO -0.00 -0.16 0.29 -2.13 -0.81 0.00 0.00 175.30 172.48 3ciy n ARG 489 N -0.17 -0.68 -0.01 5.12 0.63 -0.73 -0.33 116.66 120.49 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 0.50 -0.92 0.01 0.00 0.45 0.00 0.00 32.46 32.49 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 -3.00 0.97 -3.92 5.15 0.24 -1.26 -2.76 118.33 113.76 3ciy n VAL 490 Ca -0.07 -0.99 -0.31 0.00 -2.04 0.00 0.00 64.34 60.93 3ciy n VAL 490 Cb 0.29 0.50 -0.00 0.00 -1.47 0.00 0.00 33.84 33.16 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 -0.51 -2.26 -1.62 2.33 0.00 -1.26 -2.82 120.51 114.37 3ciy n ALA 491 Ca 0.01 -0.32 -0.38 0.00 0.00 0.00 0.00 53.44 52.75 3ciy n ALA 491 Cb 0.29 -2.40 0.05 0.00 0.00 0.00 0.00 19.45 17.39 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 -4.44 3.52 -3.84 0.00 4.77 -1.26 -4.11 117.00 111.63 3ciy n LEU 492 Ca -0.22 0.84 -0.12 0.00 -0.03 0.00 0.00 56.01 56.48 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 0.73 -1.79 -0.28 -0.75 -1.33 0.00 0.00 177.39 173.97 3ciy s LYS 493 N -2.63 0.08 -0.51 3.23 2.20 -1.24 -4.87 119.74 115.98 3ciy s LYS 493 Ca 0.73 0.12 -0.02 0.00 -0.36 0.00 0.00 55.97 56.44 3ciy s LYS 493 Cb -0.44 0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 35.87 3ciy s LYS 493 CO 0.49 -0.03 0.46 0.09 -0.36 0.00 0.00 175.35 176.00 3ciy n ASN 494 N 3.16 -4.64 -0.56 1.43 5.03 -1.26 -1.92 115.26 116.49 3ciy n ASN 494 Ca -0.14 -0.28 0.06 0.00 0.87 0.00 0.00 54.58 55.09 3ciy n ASN 494 Cb 0.59 -3.09 0.09 0.00 -1.02 0.00 0.00 39.78 36.35 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 -2.14 0.36 1.12 2.41 0.24 -1.26 -4.36 118.33 114.69 3ciy n VAL 495 Ca -0.03 -0.68 0.12 0.00 -2.04 0.00 0.00 64.34 61.71 3ciy n VAL 495 Cb 0.55 0.98 0.21 0.00 -1.47 0.00 0.00 33.84 34.11 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 0.66 1.22 -4.77 -1.34 5.75 -1.26 -4.75 116.55 112.05 3ciy n ASP 496 Ca 0.09 -0.98 -0.38 0.00 -0.01 0.00 0.00 54.79 53.52 3ciy n ASP 496 Cb 0.35 0.33 -0.01 0.00 -1.03 0.00 0.00 41.12 40.76 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 -2.62 3.08 -0.09 2.12 -4.36 -1.26 -4.62 121.20 113.44 3ciy s ILE 497 Ca 0.19 0.85 0.01 0.00 -0.26 0.00 0.00 60.65 61.44 3ciy s ILE 497 Cb 0.18 -3.45 -0.02 0.00 1.25 0.00 0.00 42.46 40.42 3ciy s ILE 497 CO 0.60 0.03 -0.12 -0.44 0.24 0.00 0.00 174.94 175.25 3ciy s SER 498 N -1.23 4.20 1.03 4.36 0.01 -1.26 -3.60 113.70 117.21 3ciy s SER 498 Ca 0.61 -0.21 -0.15 0.00 1.31 0.00 0.00 55.95 57.52 3ciy s SER 498 Cb -0.30 -1.27 0.20 0.00 0.21 0.00 0.00 66.02 64.87 3ciy s SER 498 CO 0.37 0.27 1.13 -2.16 0.41 0.00 0.00 173.24 173.26 3ciy s PRO 499 N -0.26 0.15 0.11 12.44 0.04 -1.26 -5.03 135.00 141.20 3ciy s PRO 499 Ca 0.02 0.21 -0.33 0.00 0.04 0.00 0.00 61.00 60.94 3ciy s PRO 499 Cb -0.13 -1.73 -0.12 0.00 0.04 0.00 0.00 34.50 32.56 3ciy s PRO 499 CO 0.03 -2.85 1.73 0.45 0.04 0.00 0.00 177.00 176.40 3ciy n SER 500 N -4.20 3.56 0.16 6.66 2.88 -1.24 -4.79 113.62 116.65 3ciy n SER 500 Ca 0.08 1.03 0.09 0.00 -1.33 0.00 0.00 58.87 58.74 3ciy n SER 500 Cb 0.59 -1.47 0.46 0.00 -0.75 0.00 0.00 64.21 63.03 3ciy n SER 500 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3ciy n PRO 501 N 4.72 0.11 -0.18 -1.46 -0.04 -1.26 0.19 135.00 137.07 3ciy n PRO 501 Ca 0.18 0.60 0.11 0.00 -0.04 0.00 0.00 63.50 64.35 3ciy n PRO 501 Cb 0.32 -2.00 0.26 0.00 -0.04 0.00 0.00 33.50 32.04 3ciy n PRO 501 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3ciy n PHE 502 N -2.13 0.48 -0.23 0.54 3.72 -1.26 -4.12 117.46 114.45 3ciy n PHE 502 Ca -0.01 -0.24 0.04 0.00 -0.05 0.00 0.00 57.45 57.19 3ciy n PHE 502 Cb 0.17 0.00 0.15 0.00 -0.94 0.00 0.00 39.48 38.85 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 3.77 0.16 0.00 -1.08 9.65 0.17 -1.15 114.38 125.90 3ciy h ARG 503 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3ciy h ARG 503 Cb 0.83 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.38 3ciy h ARG 503 CO 0.00 0.11 0.00 -0.35 2.80 0.00 0.00 179.97 182.53 3ciy n PRO 504 N -5.26 0.13 -2.70 0.20 -0.04 -1.26 -4.53 135.00 121.55 3ciy n PRO 504 Ca 0.12 0.23 -0.42 0.00 -0.04 0.00 0.00 63.50 63.38 3ciy n PRO 504 Cb 0.43 -1.69 -0.02 0.00 -0.04 0.00 0.00 33.50 32.17 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 -3.87 4.12 -0.14 1.53 1.43 -0.44 -4.66 118.68 116.66 3ciy s LEU 505 Ca 0.09 -1.84 -0.10 0.00 -1.03 0.00 0.00 54.13 51.25 3ciy s LEU 505 Cb 0.13 -2.51 -0.25 0.00 0.03 0.00 0.00 46.19 43.59 3ciy s LEU 505 CO 0.46 -1.29 0.35 0.03 0.23 0.00 0.00 176.35 176.14 3ciy h ARG 506 N 9.09 0.21 0.00 1.70 3.08 -1.80 -3.34 114.38 123.33 3ciy h ARG 506 Ca 0.22 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3ciy h ARG 506 Cb 0.99 0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3ciy h ARG 506 CO 1.32 1.18 0.00 0.09 -1.07 0.00 0.00 179.97 181.49 3ciy n ASN 507 N -3.70 0.00 -4.68 7.04 3.02 -1.26 -4.24 115.26 111.44 3ciy n ASN 507 Ca -0.32 -1.40 -0.42 0.00 -0.03 0.00 0.00 54.58 52.41 3ciy n ASN 507 Cb 0.97 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 40.11 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 -1.07 4.28 -0.13 3.41 2.96 -0.87 -4.30 118.68 122.96 3ciy s LEU 508 Ca 0.02 1.99 -0.13 0.00 -0.22 0.00 0.00 54.13 55.80 3ciy s LEU 508 Cb 0.01 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.09 3ciy s LEU 508 CO 0.02 -0.73 -0.27 0.35 -1.32 0.00 0.00 176.35 174.41 3ciy n THR 509 N 4.88 1.37 -3.62 3.68 -2.24 0.08 -2.17 114.28 116.25 3ciy n THR 509 Ca 0.13 0.09 -0.37 0.00 -2.27 0.00 0.00 64.05 61.63 3ciy n THR 509 Cb 0.44 -2.08 -0.11 0.00 -2.10 0.00 0.00 70.33 66.49 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 -2.62 5.27 -0.04 2.28 1.01 -0.75 -0.47 121.20 125.88 3ciy s ILE 510 Ca -0.24 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.59 3ciy s ILE 510 Cb 0.05 -3.49 0.01 0.00 0.01 0.00 0.00 42.46 39.04 3ciy s ILE 510 CO 0.34 0.29 -0.08 -0.22 0.00 0.00 0.00 174.94 175.26 3ciy s LEU 511 N 1.52 1.57 -0.14 2.97 0.20 -0.84 -1.51 118.68 122.45 3ciy s LEU 511 Ca 0.07 -0.19 0.01 0.00 0.69 0.00 0.00 54.13 54.70 3ciy s LEU 511 Cb -0.15 -0.59 0.02 0.00 -0.43 0.00 0.00 46.19 45.04 3ciy s LEU 511 CO 0.09 0.01 -0.14 -0.62 -0.29 0.00 0.00 176.35 175.39 3ciy s ASP 512 N 0.61 2.62 -0.30 3.68 -1.08 -0.85 -2.38 116.67 118.97 3ciy s ASP 512 Ca -0.10 -0.47 0.14 0.00 -0.52 0.00 0.00 52.55 51.60 3ciy s ASP 512 Cb -0.13 -1.16 0.48 0.00 -1.46 0.00 0.00 42.92 40.65 3ciy s ASP 512 CO 0.01 -0.04 1.12 0.18 0.52 0.00 0.00 175.17 176.97 3ciy n LEU 513 N 4.62 3.15 -4.87 -1.34 4.77 -0.73 -0.74 117.00 121.86 3ciy n LEU 513 Ca -0.17 -3.99 -0.31 0.00 -0.03 0.00 0.00 56.01 51.51 3ciy n LEU 513 Cb 0.50 0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.64 3ciy n LEU 513 CO 0.22 1.63 0.57 -0.94 -1.33 0.00 0.00 177.39 177.54 3ciy s SER 514 N -3.62 6.46 -1.34 -1.43 1.04 -1.21 -4.32 113.70 109.28 3ciy s SER 514 Ca 0.38 1.30 -0.08 0.00 0.48 0.00 0.00 55.95 58.03 3ciy s SER 514 Cb 0.38 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 64.10 3ciy s SER 514 CO -0.02 -0.58 0.50 0.59 0.98 0.00 0.00 173.24 174.71 3ciy n ASN 515 N -1.80 -1.75 0.00 7.02 4.13 0.20 -1.77 115.26 121.29 3ciy n ASN 515 Ca 0.04 -1.06 0.00 0.00 1.68 0.00 0.00 54.58 55.24 3ciy n ASN 515 Cb 0.54 -2.88 0.00 0.00 -1.54 0.00 0.00 39.78 35.90 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 -2.83 0.18 -3.66 6.41 3.02 -1.19 -2.26 115.26 114.94 3ciy n ASN 516 Ca -0.24 -0.52 -0.21 0.00 -0.03 0.00 0.00 54.58 53.58 3ciy n ASN 516 Cb 0.65 0.50 0.04 0.00 -0.61 0.00 0.00 39.78 40.36 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 -0.50 -1.83 -4.62 6.41 2.85 -1.18 -4.42 115.26 111.97 3ciy n ASN 517 Ca 0.00 -0.82 -0.43 0.00 -0.11 0.00 0.00 54.58 53.22 3ciy n ASN 517 Cb 0.02 -4.12 -0.03 0.00 1.24 0.00 0.00 39.78 36.89 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 -3.62 3.14 0.15 -1.44 1.01 -1.18 -4.85 121.20 114.41 3ciy s ILE 518 Ca 0.06 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 60.63 3ciy s ILE 518 Cb -0.02 -3.15 0.02 0.00 0.01 0.00 0.00 42.46 39.33 3ciy s ILE 518 CO 0.81 -0.07 1.61 0.00 0.00 0.00 0.00 174.94 177.29 3ciy h ALA 519 N 13.13 -0.21 -2.65 9.38 0.00 -1.84 -3.40 119.26 133.67 3ciy h ALA 519 Ca -0.42 0.07 0.12 0.00 0.00 0.00 0.00 54.91 54.68 3ciy h ALA 519 Cb 1.22 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 3ciy h ALA 519 CO 0.97 -0.72 0.50 0.54 0.00 0.00 0.00 179.25 180.54 3ciy s ASN 520 N -5.01 -0.01 -0.28 0.00 2.20 -1.26 -4.76 114.94 105.82 3ciy s ASN 520 Ca -0.15 -0.78 -0.25 0.00 -0.94 0.00 0.00 52.86 50.74 3ciy s ASN 520 Cb 0.12 0.59 0.15 0.00 -2.00 0.00 0.00 41.25 40.11 3ciy s ASN 520 CO 0.67 -1.17 1.17 -0.51 -2.94 0.00 0.00 177.10 174.32 3ciy s ILE 521 N -2.27 0.00 0.23 0.54 -1.16 -1.26 -4.52 121.20 112.75 3ciy s ILE 521 Ca 0.20 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.34 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 0.07 0.00 0.41 0.54 -2.81 0.00 0.00 174.94 173.15 3ciy s ASN 522 N 0.05 6.36 0.57 4.50 6.03 -1.26 -4.95 114.94 126.23 3ciy s ASN 522 Ca 0.04 0.36 0.31 0.00 -1.03 0.00 0.00 52.86 52.54 3ciy s ASN 522 Cb -0.05 -1.99 1.45 0.00 -3.03 0.00 0.00 41.25 37.63 3ciy s ASN 522 CO -0.09 -0.08 1.84 1.05 -2.03 0.00 0.00 177.10 177.78 3ciy h GLU 523 N 1.70 0.00 -0.90 3.55 4.11 -1.88 -2.33 114.58 118.83 3ciy h GLU 523 Ca -0.49 0.00 0.25 0.00 0.07 0.00 0.00 59.36 59.19 3ciy h GLU 523 Cb 1.20 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.30 3ciy h GLU 523 CO 0.66 0.00 0.17 0.22 0.07 0.00 0.00 179.01 180.13 3ciy h ASP 524 N 0.00 -0.15 -2.70 3.06 -0.00 -1.94 -3.42 116.42 111.27 3ciy h ASP 524 Ca 0.36 0.22 -0.59 0.00 -0.00 0.00 0.00 57.03 57.03 3ciy h ASP 524 Cb 1.66 0.34 0.17 0.00 -0.00 0.00 0.00 39.33 41.50 3ciy h ASP 524 CO -0.00 -0.23 -0.56 -0.11 -0.00 0.00 0.00 179.24 178.33 3ciy n LEU 525 N -5.31 -0.27 0.00 2.28 7.94 -0.88 -1.51 117.00 119.25 3ciy n LEU 525 Ca 0.22 0.73 0.00 0.00 -1.11 0.00 0.00 56.01 55.85 3ciy n LEU 525 Cb 0.72 -1.10 0.00 0.00 0.53 0.00 0.00 43.42 43.57 3ciy n LEU 525 CO 0.02 -3.43 0.00 0.18 -1.11 0.00 0.00 177.39 173.05 3ciy n LEU 526 N 1.00 0.60 -4.63 -1.96 4.77 -1.26 -4.75 117.00 110.77 3ciy n LEU 526 Ca 0.11 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.66 3ciy n LEU 526 Cb 0.47 -1.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.30 3ciy n LEU 526 CO 0.52 -0.42 1.60 -0.70 -1.33 0.00 0.00 177.39 177.06 3ciy s GLU 527 N -0.85 3.67 0.00 3.23 2.12 -0.57 -2.66 118.70 123.64 3ciy s GLU 527 Ca 0.00 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.40 3ciy s GLU 527 Cb 0.00 -4.19 0.00 0.00 0.26 0.00 0.00 34.13 30.20 3ciy s GLU 527 CO 0.00 -1.47 0.00 0.41 -0.54 0.00 0.00 175.26 173.66 3ciy n GLY 528 N 5.01 0.59 3.44 -1.50 0.00 -1.26 -4.83 105.19 106.63 3ciy n GLY 528 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 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 5.27 0.00 0.99 4.77 -1.09 -4.72 117.00 122.22 3ciy n LEU 529 Ca 0.00 -4.00 0.09 0.00 -0.03 0.00 0.00 56.01 52.07 3ciy n LEU 529 Cb 0.00 -1.72 0.45 0.00 -2.33 0.00 0.00 43.42 39.81 3ciy n LEU 529 CO 0.00 0.35 0.76 1.21 -1.33 0.00 0.00 177.39 178.38 3ciy n GLU 530 N 7.80 0.25 0.00 3.23 4.07 -1.26 -2.66 120.64 132.07 3ciy n GLU 530 Ca 0.48 0.12 0.03 0.00 -0.06 0.00 0.00 57.16 57.74 3ciy n GLU 530 Cb 0.45 -1.50 -0.02 0.00 -0.06 0.00 0.00 31.44 30.30 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 -1.29 0.62 -4.53 4.31 3.02 -1.26 -4.24 115.26 111.89 3ciy n ASN 531 Ca 0.08 -0.81 -0.45 0.00 -0.03 0.00 0.00 54.58 53.37 3ciy n ASN 531 Cb 0.14 0.77 -0.05 0.00 -0.61 0.00 0.00 39.78 40.04 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 2.62 -0.12 3.41 -0.00 -0.92 -4.23 117.00 116.96 3ciy n LEU 532 Ca 0.02 0.19 -0.22 0.00 -0.00 0.00 0.00 56.01 56.00 3ciy n LEU 532 Cb 0.12 -1.43 -0.07 0.00 -0.00 0.00 0.00 43.42 42.04 3ciy n LEU 532 CO 0.12 -0.82 -1.16 -0.62 -0.00 0.00 0.00 177.39 174.91 3ciy n GLU 533 N 8.58 0.56 -4.13 1.96 1.02 0.38 -2.28 120.64 126.73 3ciy n GLU 533 Ca 0.36 0.24 -0.34 0.00 -0.02 0.00 0.00 57.16 57.40 3ciy n GLU 533 Cb 0.36 -1.46 -0.10 0.00 -0.02 0.00 0.00 31.44 30.22 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 -2.66 4.59 -0.04 -3.67 1.09 -1.16 0.20 121.20 119.55 3ciy s ILE 534 Ca -0.35 -0.11 0.01 0.00 -1.10 0.00 0.00 60.65 59.09 3ciy s ILE 534 Cb 0.11 -3.03 0.02 0.00 -1.06 0.00 0.00 42.46 38.50 3ciy s ILE 534 CO 0.46 0.50 -0.03 -0.22 -0.10 0.00 0.00 174.94 175.55 3ciy s LEU 535 N 0.11 1.29 -0.14 2.97 2.96 -0.84 -1.99 118.68 123.04 3ciy s LEU 535 Ca 0.04 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 3ciy s LEU 535 Cb -0.13 -0.38 0.00 0.00 0.50 0.00 0.00 46.19 46.19 3ciy s LEU 535 CO 0.01 -0.07 -0.20 -1.81 -1.32 0.00 0.00 176.35 172.97 3ciy s ASP 536 N 0.93 3.35 -0.07 3.68 -0.00 -1.00 -1.52 116.67 122.05 3ciy s ASP 536 Ca -0.11 -0.53 0.11 0.00 -0.00 0.00 0.00 52.55 52.02 3ciy s ASP 536 Cb -0.14 -1.49 0.20 0.00 -0.00 0.00 0.00 42.92 41.49 3ciy s ASP 536 CO -0.00 0.11 1.10 0.49 -0.00 0.00 0.00 175.17 176.86 3ciy n PHE 537 N 3.91 0.00 -1.69 4.23 3.72 0.34 -1.77 117.46 126.20 3ciy n PHE 537 Ca -0.19 -0.58 -0.44 0.00 -0.05 0.00 0.00 57.45 56.19 3ciy n PHE 537 Cb 0.52 -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 -0.60 2.48 -2.73 -1.08 3.00 -1.26 -3.73 117.38 113.48 3ciy n GLN 538 Ca 0.09 0.90 -0.02 0.00 -0.01 0.00 0.00 57.00 57.96 3ciy n GLN 538 Cb 0.72 -2.72 0.00 0.00 0.00 0.00 0.00 30.24 28.24 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 4.21 -2.55 -2.09 1.08 8.25 -0.78 0.62 115.22 123.96 3ciy n HIS 539 Ca 0.17 0.99 0.00 0.00 -0.26 0.00 0.00 57.72 58.62 3ciy n HIS 539 Cb 0.32 -3.63 -0.00 0.00 1.12 0.00 0.00 29.99 27.80 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 -1.29 0.12 -3.87 0.41 3.02 -1.24 -2.90 115.26 109.50 3ciy n ASN 540 Ca 0.03 -1.80 -0.21 0.00 -0.03 0.00 0.00 54.58 52.57 3ciy n ASN 540 Cb 0.47 -0.14 0.01 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 0.09 -1.72 -1.94 6.41 2.85 -1.24 -3.07 115.26 116.64 3ciy n ASN 541 Ca -0.01 -0.57 -0.04 0.00 -0.11 0.00 0.00 54.58 53.85 3ciy n ASN 541 Cb 0.74 -0.69 0.31 0.00 1.24 0.00 0.00 39.78 41.38 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 -2.75 5.86 0.02 1.20 7.94 0.76 -4.71 117.00 125.32 3ciy n LEU 542 Ca -0.05 -3.03 -0.09 0.00 -1.11 0.00 0.00 56.01 51.72 3ciy n LEU 542 Cb 0.25 -0.73 -0.06 0.00 0.53 0.00 0.00 43.42 43.41 3ciy n LEU 542 CO 0.33 0.75 0.50 0.00 -1.11 0.00 0.00 177.39 177.86 3ciy h ALA 543 N 2.92 -0.74 0.00 1.96 0.00 -1.36 -3.12 119.26 118.91 3ciy h ALA 543 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3ciy h ALA 543 Cb 2.21 0.78 0.00 0.00 0.00 0.00 0.00 17.79 20.78 3ciy h ALA 543 CO 0.67 -0.84 0.00 2.89 0.00 0.00 0.00 179.25 181.97 3ciy n ARG 544 N -4.21 0.13 0.00 0.00 -4.01 -1.26 -3.25 116.66 104.06 3ciy n ARG 544 Ca -0.04 0.33 0.05 0.00 -1.04 0.00 0.00 57.85 57.15 3ciy n ARG 544 Cb 0.23 -1.73 0.23 0.00 -3.04 0.00 0.00 32.46 28.15 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 -1.98 0.00 -3.11 2.89 7.99 -1.18 -4.79 117.00 116.83 3ciy n LEU 545 Ca 0.03 0.32 -0.22 0.00 -0.01 0.00 0.00 56.01 56.13 3ciy n LEU 545 Cb 0.23 -0.32 -0.04 0.00 -0.11 0.00 0.00 43.42 43.19 3ciy n LEU 545 CO 0.19 -0.22 -0.09 0.79 -1.51 0.00 0.00 177.39 176.55 3ciy n TRP 546 N -1.32 1.63 -1.38 -1.77 7.02 -1.20 -3.30 117.44 117.12 3ciy n TRP 546 Ca 0.04 -3.88 -0.10 0.00 -1.02 0.00 0.00 57.50 52.54 3ciy n TRP 546 Cb 0.08 -0.45 0.20 0.00 -2.42 0.00 0.00 31.31 28.72 3ciy n TRP 546 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 3ciy n ASN 550 N 0.14 2.90 -4.57 -0.99 5.15 -1.26 -4.83 115.26 111.79 3ciy n ASN 550 Ca 0.27 -3.71 -0.31 0.00 -0.60 0.00 0.00 54.58 50.23 3ciy n ASN 550 Cb 0.55 -0.70 -0.05 0.00 -0.53 0.00 0.00 39.78 39.06 3ciy n ASN 550 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3ciy s PRO 551 N -3.26 2.82 -1.13 1.20 0.04 -1.26 -3.39 135.00 130.03 3ciy s PRO 551 Ca 0.48 -0.93 0.00 0.00 0.04 0.00 0.00 61.00 60.60 3ciy s PRO 551 Cb 0.43 -5.22 0.00 0.00 0.04 0.00 0.00 34.50 29.74 3ciy s PRO 551 CO 0.03 -3.35 0.00 0.41 0.04 0.00 0.00 177.00 174.13 3ciy n GLY 552 N 6.28 0.58 0.00 0.56 0.00 -1.26 -4.77 105.19 106.59 3ciy n GLY 552 Ca 0.42 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.28 -0.17 3.77 -0.02 0.00 -1.22 -4.97 105.19 101.31 3ciy n GLY 553 Ca -0.13 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 43.97 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 -3.94 3.85 -0.39 1.61 0.04 -1.26 -4.92 135.00 129.99 3ciy s PRO 554 Ca 0.00 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 3ciy s PRO 554 Cb 0.00 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 32.03 3ciy s PRO 554 CO 0.00 -0.49 1.34 0.08 0.04 0.00 0.00 177.00 177.96 3ciy s VAL 555 N -1.47 4.02 -0.24 -0.36 1.01 -1.21 -4.87 120.40 117.28 3ciy s VAL 555 Ca 0.61 1.08 -0.02 0.00 0.00 0.00 0.00 61.98 63.65 3ciy s VAL 555 Cb -0.30 -4.24 -0.05 0.00 0.00 0.00 0.00 36.38 31.78 3ciy s VAL 555 CO 0.38 -0.70 1.50 -3.20 0.00 0.00 0.00 175.10 173.07 3ciy n ASN 556 N 8.31 2.06 -4.37 3.32 4.05 -1.26 -4.83 115.26 122.55 3ciy n ASN 556 Ca 0.15 -1.98 -0.32 0.00 0.45 0.00 0.00 54.58 52.88 3ciy n ASN 556 Cb 0.48 -0.62 0.17 0.00 1.23 0.00 0.00 39.78 41.04 3ciy n ASN 556 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 3ciy n PHE 557 N 3.74 -1.28 -3.73 1.20 7.35 -1.26 -3.59 117.46 119.88 3ciy n PHE 557 Ca 0.18 0.13 -0.28 0.00 -0.76 0.00 0.00 57.45 56.72 3ciy n PHE 557 Cb 0.17 -1.67 0.03 0.00 0.35 0.00 0.00 39.48 38.36 3ciy n PHE 557 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 3ciy n LEU 558 N -2.22 -2.61 -4.73 -2.13 4.77 -1.26 -4.94 117.00 103.87 3ciy n LEU 558 Ca 0.03 -0.66 -0.41 0.00 -0.03 0.00 0.00 56.01 54.95 3ciy n LEU 558 Cb 0.58 -2.64 -0.04 0.00 -2.33 0.00 0.00 43.42 38.99 3ciy n LEU 558 CO 0.52 0.45 0.78 -0.75 -1.33 0.00 0.00 177.39 177.07 3ciy s LYS 559 N -6.43 4.58 -0.59 3.23 2.20 -1.24 -4.27 119.74 117.23 3ciy s LYS 559 Ca 0.60 1.67 0.00 0.00 -0.36 0.00 0.00 55.97 57.88 3ciy s LYS 559 Cb -0.29 -3.31 0.00 0.00 -1.51 0.00 0.00 37.83 32.72 3ciy s LYS 559 CO 0.74 0.04 0.00 0.41 -0.36 0.00 0.00 175.35 176.18 3ciy n GLY 560 N 2.29 0.27 2.53 5.54 0.00 -1.26 -4.81 105.19 109.74 3ciy n GLY 560 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.73 7.75 -0.34 0.99 4.32 -1.26 -4.68 117.00 122.05 3ciy n LEU 561 Ca -0.06 -4.22 0.18 0.00 -0.02 0.00 0.00 56.01 51.89 3ciy n LEU 561 Cb 0.29 -1.59 0.34 0.00 -1.62 0.00 0.00 43.42 40.84 3ciy n LEU 561 CO 0.09 1.56 0.84 -1.54 -1.22 0.00 0.00 177.39 177.12 3ciy n SER 562 N 4.85 -0.04 -0.02 -1.43 3.41 -1.26 0.44 113.62 119.56 3ciy n SER 562 Ca 0.65 1.69 0.08 0.00 -0.26 0.00 0.00 58.87 61.03 3ciy n SER 562 Cb 0.31 -0.65 0.45 0.00 -0.26 0.00 0.00 64.21 64.05 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 -5.46 0.01 -2.11 7.33 8.25 -1.26 -3.81 115.22 118.17 3ciy n HIS 563 Ca 0.26 -0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.29 3ciy n HIS 563 Cb 0.86 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.94 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 -1.47 4.30 -0.07 2.41 0.20 0.17 -4.15 118.68 120.07 3ciy s LEU 564 Ca 0.23 2.15 -0.06 0.00 0.69 0.00 0.00 54.13 57.14 3ciy s LEU 564 Cb 0.11 -3.54 -0.02 0.00 -0.43 0.00 0.00 46.19 42.30 3ciy s LEU 564 CO 0.18 -0.85 -0.12 1.41 -0.29 0.00 0.00 176.35 176.67 3ciy n HIS 565 N 6.55 0.15 -3.81 5.38 8.25 0.13 -2.29 115.22 129.59 3ciy n HIS 565 Ca 0.16 0.07 -0.36 0.00 -0.26 0.00 0.00 57.72 57.32 3ciy n HIS 565 Cb 0.43 -0.31 -0.13 0.00 1.12 0.00 0.00 29.99 31.10 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 -1.70 3.97 -0.12 1.59 -1.16 -0.92 0.16 121.20 123.02 3ciy s ILE 566 Ca -0.10 -0.31 -0.01 0.00 -0.51 0.00 0.00 60.65 59.73 3ciy s ILE 566 Cb 0.01 -2.85 -0.02 0.00 0.61 0.00 0.00 42.46 40.21 3ciy s ILE 566 CO 0.15 0.36 -0.09 -0.22 -2.81 0.00 0.00 174.94 172.33 3ciy s LEU 567 N 1.56 3.00 -0.17 8.50 2.96 0.68 -2.00 118.68 133.22 3ciy s LEU 567 Ca 0.06 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 3ciy s LEU 567 Cb -0.15 -1.68 0.02 0.00 0.50 0.00 0.00 46.19 44.88 3ciy s LEU 567 CO 0.01 0.23 -0.16 0.21 -1.32 0.00 0.00 176.35 175.32 3ciy s ASN 568 N -0.02 2.95 -0.06 3.68 3.84 -0.57 -1.85 114.94 122.90 3ciy s ASN 568 Ca -0.01 -0.60 0.19 0.00 0.21 0.00 0.00 52.86 52.65 3ciy s ASN 568 Cb -0.14 -1.30 0.37 0.00 -0.55 0.00 0.00 41.25 39.63 3ciy s ASN 568 CO 0.03 -0.05 1.16 0.18 -2.79 0.00 0.00 177.10 175.64 3ciy n LEU 569 N 4.70 1.40 -4.65 3.21 4.32 -0.13 -0.50 117.00 125.35 3ciy n LEU 569 Ca -0.18 -2.44 -0.42 0.00 -0.02 0.00 0.00 56.01 52.95 3ciy n LEU 569 Cb 0.50 -0.16 0.01 0.00 -1.62 0.00 0.00 43.42 42.14 3ciy n LEU 569 CO 0.23 0.72 0.72 1.21 -1.22 0.00 0.00 177.39 179.05 3ciy n GLU 570 N -0.07 1.62 -3.52 3.23 2.13 -0.90 -3.44 120.64 119.69 3ciy n GLU 570 Ca 0.09 0.58 -0.30 0.00 0.66 0.00 0.00 57.16 58.19 3ciy n GLU 570 Cb 0.96 -2.17 0.02 0.00 0.27 0.00 0.00 31.44 30.52 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 0.50 -4.70 -0.15 4.31 2.88 0.47 -2.45 113.62 114.49 3ciy n SER 571 Ca 0.08 -0.55 0.03 0.00 -1.33 0.00 0.00 58.87 57.10 3ciy n SER 571 Cb 0.38 -1.46 0.04 0.00 -0.75 0.00 0.00 64.21 62.42 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 -1.30 1.17 0.00 -3.46 4.05 -1.22 -1.87 115.26 112.63 3ciy n ASN 572 Ca -0.20 -2.11 0.00 0.00 0.45 0.00 0.00 54.58 52.72 3ciy n ASN 572 Cb 0.64 -0.18 0.00 0.00 1.23 0.00 0.00 39.78 41.47 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 -0.55 2.18 3.68 8.20 0.00 -1.26 -0.17 105.19 117.27 3ciy n GLY 573 Ca 0.05 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.55 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 2.80 0.00 0.99 4.32 -1.26 -4.37 117.00 119.48 3ciy n LEU 574 Ca 0.00 1.04 0.00 0.00 -0.02 0.00 0.00 56.01 57.03 3ciy n LEU 574 Cb 0.00 -1.27 0.00 0.00 -1.62 0.00 0.00 43.42 40.53 3ciy n LEU 574 CO 0.00 -0.34 -0.16 -0.90 -1.22 0.00 0.00 177.39 174.77 3ciy n ASP 575 N 5.33 1.58 -3.50 -1.43 3.85 -1.23 -0.80 116.55 120.34 3ciy n ASP 575 Ca 0.23 -0.24 -0.09 0.00 -0.71 0.00 0.00 54.79 53.98 3ciy n ASP 575 Cb 0.22 0.80 -0.09 0.00 -1.35 0.00 0.00 41.12 40.69 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 -1.11 0.32 -0.41 0.11 2.12 -1.26 -4.36 118.70 114.10 3ciy s GLU 576 Ca 0.00 0.75 -0.23 0.00 0.36 0.00 0.00 54.97 55.86 3ciy s GLU 576 Cb 0.00 -0.12 0.02 0.00 0.26 0.00 0.00 34.13 34.29 3ciy s GLU 576 CO 0.00 -0.45 0.75 0.96 -0.54 0.00 0.00 175.26 175.98 3ciy s ILE 577 N 2.56 4.72 0.84 -3.70 -5.25 -1.26 -4.62 121.20 114.49 3ciy s ILE 577 Ca 0.06 0.56 -0.11 0.00 -0.99 0.00 0.00 60.65 60.17 3ciy s ILE 577 Cb -0.14 -4.24 0.10 0.00 2.95 0.00 0.00 42.46 41.13 3ciy s ILE 577 CO -0.14 -0.57 1.10 -2.16 -1.79 0.00 0.00 174.94 171.38 3ciy s PRO 578 N 3.11 1.68 -0.25 0.37 0.04 -1.26 -4.57 135.00 134.11 3ciy s PRO 578 Ca 0.29 1.12 -0.35 0.00 0.04 0.00 0.00 61.00 62.10 3ciy s PRO 578 Cb -0.13 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.46 3ciy s PRO 578 CO 0.20 -2.04 2.03 1.33 0.04 0.00 0.00 177.00 178.56 3ciy n VAL 579 N -3.78 0.33 -3.74 -0.36 0.24 -1.26 -3.36 118.33 106.40 3ciy n VAL 579 Ca 0.09 -0.20 -0.28 0.00 -2.04 0.00 0.00 64.34 61.91 3ciy n VAL 579 Cb 0.53 -1.71 0.04 0.00 -1.47 0.00 0.00 33.84 31.23 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 5.49 -0.52 0.49 7.63 0.00 -1.26 -4.87 105.19 112.15 3ciy n GLY 580 Ca 0.33 0.21 0.03 0.00 0.00 0.00 0.00 46.02 46.58 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 -4.76 0.38 -1.49 1.61 0.24 -1.21 -2.94 118.33 110.16 3ciy n VAL 581 Ca 0.02 -0.29 0.06 0.00 -2.04 0.00 0.00 64.34 62.10 3ciy n VAL 581 Cb 0.54 -0.01 0.11 0.00 -1.47 0.00 0.00 33.84 33.01 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 0.10 0.00 -2.62 6.34 3.72 -1.26 -4.89 117.46 118.85 3ciy n PHE 582 Ca 0.07 -0.81 -0.38 0.00 -0.05 0.00 0.00 57.45 56.29 3ciy n PHE 582 Cb 0.25 -0.14 -0.05 0.00 -0.94 0.00 0.00 39.48 38.60 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 -2.03 4.43 0.00 -1.08 2.20 -1.15 -3.57 119.74 118.54 3ciy s LYS 583 Ca 0.25 1.51 0.00 0.00 -0.36 0.00 0.00 55.97 57.38 3ciy s LYS 583 Cb 0.24 -2.79 0.00 0.00 -1.51 0.00 0.00 37.83 33.76 3ciy s LYS 583 CO -0.01 0.10 0.00 0.09 -0.36 0.00 0.00 175.35 175.17 3ciy n ASN 584 N 0.47 -0.92 -4.43 1.43 3.02 -1.26 -4.78 115.26 108.79 3ciy n ASN 584 Ca 0.02 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.13 3ciy n ASN 584 Cb 0.49 -1.03 -0.01 0.00 -0.61 0.00 0.00 39.78 38.61 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 5.36 -0.11 3.41 1.43 -1.23 -4.59 118.68 122.94 3ciy s LEU 585 Ca 0.00 -2.71 -0.15 0.00 -1.03 0.00 0.00 54.13 50.24 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 -0.79 0.52 -0.26 0.23 0.00 0.00 176.35 176.05 3ciy h PHE 586 N 7.74 0.42 0.00 0.29 0.04 -1.78 -3.35 116.94 120.30 3ciy h PHE 586 Ca 0.23 -0.31 0.00 0.00 2.80 0.00 0.00 57.97 60.69 3ciy h PHE 586 Cb 0.94 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.07 3ciy h PHE 586 CO 1.08 1.57 0.00 0.39 -0.60 0.00 0.00 178.31 180.75 3ciy n GLU 587 N -3.91 0.80 -2.00 1.51 1.02 -1.25 -4.35 120.64 112.46 3ciy n GLU 587 Ca -0.26 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.45 3ciy n GLU 587 Cb 0.90 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.84 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 -1.91 3.89 -0.14 -4.62 0.20 -0.97 -4.27 118.68 110.87 3ciy s LEU 588 Ca 0.35 1.76 -0.10 0.00 0.69 0.00 0.00 54.13 56.82 3ciy s LEU 588 Cb 0.16 -3.53 -0.25 0.00 -0.43 0.00 0.00 46.19 42.14 3ciy s LEU 588 CO 0.27 -1.33 0.34 1.17 -0.29 0.00 0.00 176.35 176.51 3ciy n LYS 589 N 7.80 0.72 -3.71 1.98 3.00 0.42 -3.73 118.16 124.63 3ciy n LYS 589 Ca 0.20 0.33 -0.24 0.00 -0.00 0.00 0.00 58.31 58.61 3ciy n LYS 589 Cb 0.45 -1.72 -0.17 0.00 0.00 0.00 0.00 35.03 33.58 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 -7.01 1.92 -0.14 3.14 0.15 -0.62 0.50 113.70 111.64 3ciy s SER 590 Ca -0.24 -0.31 -0.06 0.00 0.70 0.00 0.00 55.95 56.05 3ciy s SER 590 Cb 0.06 -0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 63.96 3ciy s SER 590 CO 0.73 -0.26 0.06 -0.63 1.20 0.00 0.00 173.24 174.34 3ciy s ILE 591 N 2.02 4.81 -0.24 6.45 1.01 -1.13 -0.23 121.20 133.88 3ciy s ILE 591 Ca 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.63 3ciy s ILE 591 Cb -0.14 -3.11 0.07 0.00 0.01 0.00 0.00 42.46 39.30 3ciy s ILE 591 CO -0.06 0.54 0.03 0.21 0.00 0.00 0.00 174.94 175.66 3ciy s ASN 592 N -0.34 3.55 -0.23 3.58 2.47 -0.77 -2.27 114.94 120.93 3ciy s ASN 592 Ca 0.09 -1.20 0.12 0.00 0.42 0.00 0.00 52.86 52.29 3ciy s ASN 592 Cb -0.12 -0.87 0.45 0.00 -1.45 0.00 0.00 41.25 39.26 3ciy s ASN 592 CO 0.02 -0.32 1.33 0.18 -3.72 0.00 0.00 177.10 174.58 3ciy n LEU 593 N 4.86 3.33 -4.26 3.21 4.77 0.21 -0.96 117.00 128.17 3ciy n LEU 593 Ca -0.07 -3.67 -0.29 0.00 -0.03 0.00 0.00 56.01 51.95 3ciy n LEU 593 Cb 0.45 -0.56 0.27 0.00 -2.33 0.00 0.00 43.42 41.24 3ciy n LEU 593 CO 0.14 1.20 0.31 0.61 -1.33 0.00 0.00 177.39 178.32 3ciy n GLY 594 N -1.11 -3.26 4.38 -0.72 0.00 -1.12 -3.82 105.19 99.53 3ciy n GLY 594 Ca 0.24 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.43 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 -4.94 -1.27 -4.68 0.99 4.77 -0.80 -0.39 117.00 110.68 3ciy n LEU 595 Ca 0.09 -1.13 -0.31 0.00 -0.03 0.00 0.00 56.01 54.63 3ciy n LEU 595 Cb 0.56 -1.84 -0.08 0.00 -2.33 0.00 0.00 43.42 39.74 3ciy n LEU 595 CO 0.43 0.21 -0.23 0.20 -1.33 0.00 0.00 177.39 176.68 3ciy s ASN 596 N -3.33 3.68 -0.85 -1.43 0.01 -1.25 -3.46 114.94 108.30 3ciy s ASN 596 Ca 0.75 -1.69 -0.00 0.00 -0.71 0.00 0.00 52.86 51.20 3ciy s ASN 596 Cb -0.42 0.59 0.21 0.00 0.41 0.00 0.00 41.25 42.04 3ciy s ASN 596 CO 0.98 -0.92 0.71 0.20 -1.51 0.00 0.00 177.10 176.56 3ciy s ASN 597 N -3.79 5.74 -0.32 -1.22 -0.87 0.02 -3.78 114.94 110.72 3ciy s ASN 597 Ca 0.10 -3.74 0.02 0.00 -1.57 0.00 0.00 52.86 47.67 3ciy s ASN 597 Cb 0.01 -1.85 0.10 0.00 -0.02 0.00 0.00 41.25 39.49 3ciy s ASN 597 CO 0.07 -0.16 0.06 -0.76 -2.57 0.00 0.00 177.10 173.73 3ciy s LEU 598 N -1.36 3.43 -0.02 0.60 1.43 -1.26 -3.54 118.68 117.97 3ciy s LEU 598 Ca 0.27 -1.82 0.02 0.00 -1.03 0.00 0.00 54.13 51.56 3ciy s LEU 598 Cb -0.07 -1.25 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 3ciy s LEU 598 CO -0.13 -0.38 0.02 -0.46 0.23 0.00 0.00 176.35 175.62 3ciy n ASN 599 N 4.56 4.45 -4.52 2.29 0.23 -1.24 -3.43 115.26 117.59 3ciy n ASN 599 Ca -0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 3ciy n ASN 599 Cb 0.42 0.65 -0.03 0.00 -2.08 0.00 0.00 39.78 38.74 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 -2.07 3.46 -0.43 -3.83 1.02 -1.26 -4.64 119.74 111.98 3ciy s LYS 600 Ca -0.01 -1.05 -0.10 0.00 0.02 0.00 0.00 55.97 54.84 3ciy s LYS 600 Cb 0.01 -4.91 0.08 0.00 -0.52 0.00 0.00 37.83 32.49 3ciy s LYS 600 CO 0.09 -2.07 0.28 -0.51 -0.92 0.00 0.00 175.35 172.22 3ciy s LEU 601 N 4.56 5.24 -0.30 3.17 2.01 -1.26 -4.38 118.68 127.71 3ciy s LEU 601 Ca 0.39 -1.53 -0.29 0.00 0.01 0.00 0.00 54.13 52.70 3ciy s LEU 601 Cb -0.04 -2.00 -0.01 0.00 0.01 0.00 0.00 46.19 44.14 3ciy s LEU 601 CO -0.03 -0.56 1.56 -1.61 1.01 0.00 0.00 176.35 176.73 3ciy s GLU 602 N 1.43 3.66 -0.06 1.70 0.41 -1.26 -4.89 118.70 119.68 3ciy s GLU 602 Ca 0.03 1.38 -0.21 0.00 -0.41 0.00 0.00 54.97 55.77 3ciy s GLU 602 Cb -0.23 -4.05 -0.10 0.00 -1.78 0.00 0.00 34.13 27.97 3ciy s GLU 602 CO 0.02 -1.46 0.59 -2.30 -0.49 0.00 0.00 175.26 171.63 3ciy n PRO 603 N 7.88 0.00 -0.45 0.39 -0.02 -1.26 -2.67 135.00 138.86 3ciy n PRO 603 Ca 0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3ciy n PRO 603 Cb 0.46 -0.74 0.00 0.00 -0.02 0.00 0.00 33.50 33.21 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 1.06 0.00 0.02 6.00 0.99 -0.86 -4.94 117.46 119.73 3ciy n PHE 604 Ca 0.11 0.00 0.01 0.00 -0.00 0.00 0.00 57.45 57.57 3ciy n PHE 604 Cb 0.02 -0.14 0.33 0.00 -1.00 0.00 0.00 39.48 38.69 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 1.18 -3.58 4.37 -2.65 -1.78 -3.38 117.51 111.67 3ciy h ILE 605 Ca 0.00 -0.69 -0.68 0.00 1.03 0.00 0.00 64.86 64.52 3ciy h ILE 605 Cb 0.00 0.91 -0.29 0.00 -2.05 0.00 0.00 36.82 35.39 3ciy h ILE 605 CO 0.00 0.24 -0.68 -0.36 0.03 0.00 0.00 178.15 177.38 3ciy s PHE 606 N -5.02 3.13 0.00 0.16 0.08 -1.26 -4.41 117.98 110.66 3ciy s PHE 606 Ca -0.07 -1.29 0.00 0.00 0.12 0.00 0.00 56.93 55.68 3ciy s PHE 606 Cb 0.16 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.44 3ciy s PHE 606 CO 0.76 -0.66 0.00 -0.25 -0.10 0.00 0.00 175.22 174.97 3ciy n ASP 607 N 4.77 0.50 -0.13 1.36 10.43 -1.26 -4.63 116.55 127.59 3ciy n ASP 607 Ca -0.15 0.00 0.14 0.00 2.57 0.00 0.00 54.79 57.35 3ciy n ASP 607 Cb 0.47 0.00 0.54 0.00 1.84 0.00 0.00 41.12 43.97 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 -2.41 0.56 -3.92 -2.24 9.92 -1.26 -4.28 116.55 112.92 3ciy n ASP 608 Ca 0.00 -0.55 -0.43 0.00 -0.53 0.00 0.00 54.79 53.28 3ciy n ASP 608 Cb 0.19 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.64 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 -0.96 3.70 -0.16 -1.24 3.00 -1.26 -4.16 117.38 116.30 3ciy n GLN 609 Ca 0.13 -3.66 0.10 0.00 -0.01 0.00 0.00 57.00 53.55 3ciy n GLN 609 Cb 0.30 -2.88 0.18 0.00 0.00 0.00 0.00 30.24 27.83 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 3.19 0.51 0.05 5.09 -2.24 -1.26 -3.67 114.28 115.94 3ciy n THR 610 Ca 0.38 -0.75 0.01 0.00 -2.27 0.00 0.00 64.05 61.41 3ciy n THR 610 Cb 0.36 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 1.22 0.71 -4.56 3.42 2.88 -1.26 -4.64 113.62 111.39 3ciy n SER 611 Ca 0.16 -0.85 -0.47 0.00 -1.33 0.00 0.00 58.87 56.37 3ciy n SER 611 Cb 0.53 0.37 -0.03 0.00 -0.75 0.00 0.00 64.21 64.33 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 -0.34 1.30 -0.00 2.46 7.94 -1.24 -4.73 117.00 122.39 3ciy n LEU 612 Ca 0.01 1.15 0.03 0.00 -1.11 0.00 0.00 56.01 56.09 3ciy n LEU 612 Cb 0.02 -1.21 -0.05 0.00 0.53 0.00 0.00 43.42 42.72 3ciy n LEU 612 CO 0.01 -1.53 -0.58 -1.14 -1.11 0.00 0.00 177.39 173.05 3ciy n ARG 613 N 1.29 0.27 -3.58 1.96 0.63 0.18 -3.91 116.66 113.50 3ciy n ARG 613 Ca 0.13 -0.06 -0.01 0.00 -0.92 0.00 0.00 57.85 57.00 3ciy n ARG 613 Cb 0.27 -1.15 -0.04 0.00 0.45 0.00 0.00 32.46 31.98 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 -2.77 -0.96 0.04 6.15 1.04 -1.18 -0.80 113.70 115.23 3ciy s SER 614 Ca -0.02 1.33 0.03 0.00 0.48 0.00 0.00 55.95 57.77 3ciy s SER 614 Cb 0.04 2.02 -0.04 0.00 0.10 0.00 0.00 66.02 68.15 3ciy s SER 614 CO 0.27 -0.19 -0.02 -0.22 0.98 0.00 0.00 173.24 174.06 3ciy s LEU 615 N 2.63 3.41 -0.10 2.42 2.96 -1.07 -2.86 118.68 126.06 3ciy s LEU 615 Ca -0.05 -0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.72 3ciy s LEU 615 Cb -0.10 -2.04 0.04 0.00 0.50 0.00 0.00 46.19 44.60 3ciy s LEU 615 CO -0.19 0.24 0.04 0.21 -1.32 0.00 0.00 176.35 175.34 3ciy s ASN 616 N -1.84 1.82 -0.11 3.68 3.84 -0.96 -1.59 114.94 119.79 3ciy s ASN 616 Ca 0.21 -0.27 0.22 0.00 0.21 0.00 0.00 52.86 53.24 3ciy s ASN 616 Cb -0.11 -0.33 0.45 0.00 -0.55 0.00 0.00 41.25 40.71 3ciy s ASN 616 CO 0.13 -0.26 1.16 0.18 -2.79 0.00 0.00 177.10 175.52 3ciy n LEU 617 N 5.21 1.59 -4.61 3.21 4.77 0.08 0.67 117.00 127.92 3ciy n LEU 617 Ca -0.06 -2.66 -0.29 0.00 -0.03 0.00 0.00 56.01 52.97 3ciy n LEU 617 Cb 0.49 0.03 0.20 0.00 -2.33 0.00 0.00 43.42 41.81 3ciy n LEU 617 CO 0.09 0.84 0.60 0.00 -1.33 0.00 0.00 177.39 177.60 3ciy s GLN 618 N -1.57 0.17 -0.44 3.23 -2.07 -1.14 -3.75 119.66 114.08 3ciy s GLN 618 Ca 0.34 0.85 -0.01 0.00 -1.82 0.00 0.00 55.36 54.72 3ciy s GLN 618 Cb 0.37 -1.68 0.01 0.00 -1.09 0.00 0.00 33.01 30.62 3ciy s GLN 618 CO -0.11 -2.99 0.04 1.63 -1.32 0.00 0.00 175.29 172.53 3ciy n LYS 619 N -4.41 -2.70 0.00 9.60 5.02 -0.89 -1.90 118.16 122.89 3ciy n LYS 619 Ca 0.06 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 3ciy n LYS 619 Cb 0.55 -4.75 0.00 0.00 -0.02 0.00 0.00 35.03 30.80 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 -1.66 0.00 -2.34 4.39 4.13 -1.25 -3.97 115.26 114.57 3ciy n ASN 620 Ca -0.04 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.00 3ciy n ASN 620 Cb 0.54 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.79 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 4.23 -4.66 3.41 4.32 -1.25 -4.55 117.00 118.51 3ciy n LEU 621 Ca 0.00 -4.69 -0.43 0.00 -0.02 0.00 0.00 56.01 50.87 3ciy n LEU 621 Cb 0.00 -0.25 -0.02 0.00 -1.62 0.00 0.00 43.42 41.53 3ciy n LEU 621 CO 0.00 2.02 0.93 -0.63 -1.22 0.00 0.00 177.39 178.49 3ciy s ILE 622 N -4.78 4.65 -0.07 -0.08 1.01 -1.22 -3.70 121.20 117.01 3ciy s ILE 622 Ca 0.45 1.98 -0.01 0.00 0.00 0.00 0.00 60.65 63.07 3ciy s ILE 622 Cb 0.40 -4.32 -0.00 0.00 0.01 0.00 0.00 42.46 38.55 3ciy s ILE 622 CO -0.06 -0.23 -0.03 0.74 0.00 0.00 0.00 174.94 175.37 3ciy h THR 623 N 5.49 0.00 -3.48 2.92 2.02 -1.83 -3.17 112.91 114.87 3ciy h THR 623 Ca -0.19 -0.60 -0.65 0.00 0.77 0.00 0.00 66.41 65.74 3ciy h THR 623 Cb 1.06 0.00 -0.20 0.00 -1.74 0.00 0.00 68.15 67.27 3ciy h THR 623 CO 0.99 0.00 -0.84 -0.94 0.37 0.00 0.00 175.52 175.10 3ciy s SER 624 N -4.61 3.29 -0.41 4.18 1.04 -1.26 -2.46 113.70 113.46 3ciy s SER 624 Ca -0.02 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.59 3ciy s SER 624 Cb 0.00 -0.23 0.11 0.00 0.10 0.00 0.00 66.02 66.01 3ciy s SER 624 CO 0.03 0.12 0.17 -0.69 0.98 0.00 0.00 173.24 173.86 3ciy s VAL 625 N -1.47 2.87 0.46 5.02 1.01 -1.19 -5.01 120.40 122.09 3ciy s VAL 625 Ca 0.17 -2.37 -0.01 0.00 0.00 0.00 0.00 61.98 59.77 3ciy s VAL 625 Cb -0.09 -3.01 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 3ciy s VAL 625 CO 0.08 -0.68 0.70 -1.61 0.00 0.00 0.00 175.10 173.59 3ciy s GLU 626 N 0.80 3.18 0.04 2.72 0.41 -1.26 -4.04 118.70 120.55 3ciy s GLU 626 Ca 0.11 -0.30 -0.01 0.00 -0.41 0.00 0.00 54.97 54.36 3ciy s GLU 626 Cb -0.21 -2.51 -0.27 0.00 -1.78 0.00 0.00 34.13 29.36 3ciy s GLU 626 CO -0.05 -0.25 0.99 -0.22 -0.49 0.00 0.00 175.26 175.23 3ciy h LYS 627 N 0.35 0.20 0.00 1.61 3.64 -1.95 -2.39 116.57 118.03 3ciy h LYS 627 Ca -0.47 -0.34 -0.00 0.00 -1.27 0.00 0.00 60.65 58.57 3ciy h LYS 627 Cb 1.24 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 33.19 3ciy h LYS 627 CO 0.59 1.08 -0.01 0.38 -2.27 0.00 0.00 179.45 179.23 3ciy h ASP 628 N 0.06 0.00 0.00 4.20 3.04 -1.99 0.13 116.42 121.86 3ciy h ASP 628 Ca -0.18 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.61 3ciy h ASP 628 Cb 1.97 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.26 3ciy h ASP 628 CO 0.16 0.01 -0.58 0.52 -2.04 0.00 0.00 179.24 177.31 3ciy n VAL 629 N -3.50 1.07 1.35 4.15 0.31 -1.24 -2.02 118.33 118.45 3ciy n VAL 629 Ca -0.03 0.26 0.14 0.00 -0.01 0.00 0.00 64.34 64.70 3ciy n VAL 629 Cb 0.09 -2.13 0.48 0.00 -0.91 0.00 0.00 33.84 31.37 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 -3.95 0.00 0.00 3.52 3.01 -0.90 -4.29 117.46 114.85 3ciy n PHE 630 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 3ciy n PHE 630 Cb 0.30 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 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 1.29 -2.75 0.33 1.37 0.00 0.45 -2.09 105.19 103.78 3ciy n GLY 631 Ca 0.14 0.17 0.21 0.00 0.00 0.00 0.00 46.02 46.55 3ciy n GLY 631 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ciy h PRO 632 N 0.00 0.11 -0.02 1.61 0.11 -1.81 -0.90 132.00 131.09 3ciy h PRO 632 Ca 0.00 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.91 3ciy h PRO 632 Cb 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 3ciy h PRO 632 CO 0.00 0.07 -0.83 -1.00 -0.21 0.00 0.00 178.00 176.03 3ciy h PRO 633 N 0.11 0.26 0.00 1.05 0.13 -1.63 -3.11 132.00 128.80 3ciy h PRO 633 Ca 0.69 -0.25 -0.00 0.00 -0.87 0.00 0.00 66.00 65.56 3ciy h PRO 633 Cb 1.60 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.79 3ciy h PRO 633 CO -0.76 0.95 -0.01 0.74 -0.23 0.00 0.00 178.00 178.70 3ciy h PHE 634 N 0.16 0.00 0.00 1.56 -1.00 -0.60 -3.31 116.94 113.74 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 1.43 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.99 3ciy h PHE 634 CO 0.03 0.01 0.00 1.04 -1.61 0.00 0.00 178.31 177.78 3ciy n GLN 635 N -3.13 0.00 -0.75 1.51 1.13 -1.07 -3.28 117.38 111.78 3ciy n GLN 635 Ca -0.02 0.78 0.02 0.00 -1.94 0.00 0.00 57.00 55.84 3ciy n GLN 635 Cb 0.15 -1.31 0.29 0.00 0.11 0.00 0.00 30.24 29.48 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 -2.20 4.36 -4.65 1.08 3.02 -1.26 -5.05 115.26 110.56 3ciy n ASN 636 Ca 0.00 -3.16 -0.39 0.00 -0.03 0.00 0.00 54.58 51.01 3ciy n ASN 636 Cb 0.00 -0.64 0.04 0.00 -0.61 0.00 0.00 39.78 38.57 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 -0.27 3.98 -0.14 3.41 7.94 -1.21 -4.83 117.00 125.88 3ciy n LEU 637 Ca 0.30 0.90 -0.26 0.00 -1.11 0.00 0.00 56.01 55.83 3ciy n LEU 637 Cb 1.12 -1.43 -0.11 0.00 0.53 0.00 0.00 43.42 43.53 3ciy n LEU 637 CO 0.28 -1.45 -1.41 -3.20 -1.11 0.00 0.00 177.39 170.50 3ciy n ASN 638 N -0.59 1.97 -3.66 1.96 4.05 0.02 -4.68 115.26 114.33 3ciy n ASN 638 Ca 0.12 0.20 -0.08 0.00 0.45 0.00 0.00 54.58 55.26 3ciy n ASN 638 Cb 0.45 -0.70 -0.09 0.00 1.23 0.00 0.00 39.78 40.66 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 -7.21 -0.37 0.23 1.20 1.04 -0.99 -0.52 113.70 107.08 3ciy s SER 639 Ca -0.38 1.02 0.06 0.00 0.48 0.00 0.00 55.95 57.13 3ciy s SER 639 Cb 0.13 1.28 -0.04 0.00 0.10 0.00 0.00 66.02 67.50 3ciy s SER 639 CO 0.53 -0.22 0.22 -0.22 0.98 0.00 0.00 173.24 174.52 3ciy s LEU 640 N 2.35 3.94 -0.27 2.42 2.96 -1.00 -2.60 118.68 126.48 3ciy s LEU 640 Ca -0.04 -0.15 -0.00 0.00 -0.22 0.00 0.00 54.13 53.73 3ciy s LEU 640 Cb -0.11 -2.49 0.16 0.00 0.50 0.00 0.00 46.19 44.25 3ciy s LEU 640 CO -0.13 -0.02 0.44 -0.62 -1.32 0.00 0.00 176.35 174.69 3ciy s ASP 641 N -3.71 -0.09 -0.27 3.68 3.68 -0.62 -4.34 116.67 115.00 3ciy s ASP 641 Ca 0.33 0.11 0.20 0.00 2.13 0.00 0.00 52.55 55.32 3ciy s ASP 641 Cb -0.09 1.34 0.50 0.00 -1.45 0.00 0.00 42.92 43.22 3ciy s ASP 641 CO 0.26 -0.31 1.10 0.23 0.13 0.00 0.00 175.17 176.58 3ciy n MET 642 N 5.37 1.93 -2.32 4.34 2.81 -1.26 -0.74 117.12 127.25 3ciy n MET 642 Ca -0.01 -3.58 -0.33 0.00 -1.81 0.00 0.00 57.70 51.97 3ciy n MET 642 Cb 0.50 -1.66 -0.02 0.00 -0.71 0.00 0.00 33.22 31.33 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 -3.70 3.71 0.00 0.03 1.70 -1.26 -4.07 118.95 115.35 3ciy s ARG 643 Ca 0.30 1.12 0.00 0.00 -0.47 0.00 0.00 55.73 56.68 3ciy s ARG 643 Cb 0.35 -2.09 0.00 0.00 -0.57 0.00 0.00 34.95 32.63 3ciy s ARG 643 CO -0.02 -0.48 0.00 1.19 -1.08 0.00 0.00 175.30 174.91 3ciy n PHE 644 N -1.59 0.00 -2.79 5.89 3.72 -0.14 -2.09 117.46 120.46 3ciy n PHE 644 Ca 0.08 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.20 3ciy n PHE 644 Cb 0.53 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.06 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 -2.19 6.35 -1.03 4.37 -0.87 -1.26 -4.63 114.94 115.68 3ciy s ASN 645 Ca 0.00 0.93 -0.15 0.00 -1.57 0.00 0.00 52.86 52.07 3ciy s ASN 645 Cb 0.00 -2.24 -0.08 0.00 -0.02 0.00 0.00 41.25 38.90 3ciy s ASN 645 CO 0.00 -0.48 2.13 -2.65 -2.57 0.00 0.00 177.10 173.53 3ciy n PRO 646 N -1.88 2.13 -1.84 -0.60 -0.02 -1.20 -4.76 135.00 126.83 3ciy n PRO 646 Ca 0.00 -1.92 -0.41 0.00 -2.02 0.00 0.00 63.50 59.15 3ciy n PRO 646 Cb 0.55 -2.85 -0.02 0.00 -0.02 0.00 0.00 33.50 31.16 3ciy n PRO 646 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3ciy s PHE 647 N 3.95 2.82 -0.38 6.00 0.08 -1.25 -4.19 117.98 125.02 3ciy s PHE 647 Ca 0.52 0.85 -0.14 0.00 0.12 0.00 0.00 56.93 58.28 3ciy s PHE 647 Cb 0.14 -4.00 0.01 0.00 -0.57 0.00 0.00 43.02 38.59 3ciy s PHE 647 CO 0.02 -3.34 0.26 0.34 -0.10 0.00 0.00 175.22 172.40 3ciy s ASP 648 N 0.45 6.03 -1.53 1.36 3.68 -1.03 0.24 116.67 125.87 3ciy s ASP 648 Ca 0.62 -0.72 -0.11 0.00 2.13 0.00 0.00 52.55 54.48 3ciy s ASP 648 Cb -0.46 -2.13 -0.02 0.00 -1.45 0.00 0.00 42.92 38.86 3ciy s ASP 648 CO 0.47 -0.35 2.64 0.00 0.13 0.00 0.00 175.17 178.05 3ciy s THR 650 N 2.06 0.57 -0.78 0.00 -4.23 -1.26 -4.67 115.64 107.33 3ciy s THR 650 Ca 0.60 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.36 3ciy s THR 650 Cb 0.16 -2.57 0.11 0.00 1.34 0.00 0.00 72.50 71.54 3ciy s THR 650 CO -0.07 0.00 1.50 0.00 -0.54 0.00 0.00 174.62 175.52 3ciy h GLU 652 N 0.00 0.00 0.00 0.00 4.81 -1.97 -3.35 114.58 114.07 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 0.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.04 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 -2.33 0.00 -0.01 1.04 3.41 -1.19 -4.88 113.62 109.66 3ciy n SER 653 Ca 0.02 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.78 3ciy n SER 653 Cb 0.27 -0.05 0.66 0.00 -0.26 0.00 0.00 64.21 64.82 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 -1.68 0.00 -0.02 -1.33 -0.00 -1.07 -3.17 119.36 112.08 3ciy n ILE 654 Ca 0.00 -0.00 -0.07 0.00 -0.00 0.00 0.00 62.75 62.67 3ciy n ILE 654 Cb 0.00 -0.43 -0.05 0.00 -0.00 0.00 0.00 39.64 39.16 3ciy n ILE 654 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 3ciy h SER 655 N 0.05 -0.87 -0.61 7.28 0.02 -1.70 1.33 113.55 119.05 3ciy h SER 655 Ca 0.00 0.11 0.05 0.00 -0.84 0.00 0.00 61.79 61.10 3ciy h SER 655 Cb 0.40 0.34 -0.04 0.00 0.14 0.00 0.00 62.40 63.25 3ciy h SER 655 CO 0.00 -0.23 0.40 -0.25 -1.14 0.00 0.00 176.83 175.62 3ciy h TRP 656 N -0.26 0.65 0.46 3.45 7.01 -1.81 -3.08 115.95 122.36 3ciy h TRP 656 Ca 0.02 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 3ciy h TRP 656 Cb 0.32 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.17 3ciy h TRP 656 CO -0.56 0.36 -0.22 0.35 -2.79 0.00 0.00 178.44 175.59 3ciy h PHE 657 N 0.66 -0.57 -1.01 2.65 3.57 -1.47 -2.89 116.94 117.87 3ciy h PHE 657 Ca 0.25 -0.01 0.34 0.00 3.53 0.00 0.00 57.97 62.08 3ciy h PHE 657 Cb 0.18 0.19 -0.15 0.00 2.79 0.00 0.00 35.95 38.95 3ciy h PHE 657 CO -0.00 -0.32 0.57 0.28 -2.23 0.00 0.00 178.31 176.61 3ciy h VAL 658 N -1.13 0.26 0.45 1.41 2.07 0.18 0.73 116.25 120.21 3ciy h VAL 658 Ca -0.06 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3ciy h VAL 658 Cb 0.51 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3ciy h VAL 658 CO 0.10 0.05 -0.22 0.78 0.02 0.00 0.00 177.57 178.31 3ciy h ASN 659 N 0.28 -0.51 -0.91 0.57 2.35 -1.59 -1.34 115.58 114.42 3ciy h ASN 659 Ca 0.75 -0.08 0.26 0.00 -0.55 0.00 0.00 56.30 56.68 3ciy h ASN 659 Cb 1.77 0.13 -0.14 0.00 0.05 0.00 0.00 38.32 40.13 3ciy h ASN 659 CO -0.62 -0.22 0.31 -0.25 -1.65 0.00 0.00 177.43 175.01 3ciy h TRP 660 N -0.82 0.49 0.23 1.19 7.01 -0.68 0.68 115.95 124.05 3ciy h TRP 660 Ca -0.06 0.05 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 3ciy h TRP 660 Cb 0.56 -0.07 -0.00 0.00 -2.10 0.00 0.00 29.16 27.55 3ciy h TRP 660 CO -0.00 -0.20 -0.14 0.82 -2.79 0.00 0.00 178.44 176.13 3ciy h ILE 661 N 0.24 0.70 -0.92 2.65 1.08 -0.95 0.31 117.51 120.62 3ciy h ILE 661 Ca 0.60 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 65.12 3ciy h ILE 661 Cb 1.25 0.70 -0.06 0.00 -3.07 0.00 0.00 36.82 35.64 3ciy h ILE 661 CO -0.65 0.00 0.60 -1.13 -0.69 0.00 0.00 178.15 176.28 3ciy h ASN 662 N -0.35 0.96 -0.33 1.72 -0.73 0.13 -3.19 115.58 113.79 3ciy h ASN 662 Ca -0.02 -0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.11 3ciy h ASN 662 Cb 0.30 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.66 3ciy h ASN 662 CO 0.02 0.64 0.01 0.00 -0.37 0.00 0.00 177.43 177.73 3ciy n GLN 663 N -4.47 3.02 -4.29 6.67 10.64 0.12 -5.01 117.38 124.06 3ciy n GLN 663 Ca 0.13 -2.92 -0.19 0.00 -1.83 0.00 0.00 57.00 52.19 3ciy n GLN 663 Cb 0.15 -1.90 -0.11 0.00 -0.86 0.00 0.00 30.24 27.52 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 -2.88 1.55 -0.31 -0.39 -1.32 0.11 -4.98 115.64 107.41 3ciy s THR 664 Ca 0.44 -1.86 0.06 0.00 -1.21 0.00 0.00 61.69 59.13 3ciy s THR 664 Cb 0.36 -1.72 0.46 0.00 -1.51 0.00 0.00 72.50 70.09 3ciy s THR 664 CO 0.09 -0.41 1.24 1.41 -2.21 0.00 0.00 174.62 174.74 3ciy n HIS 665 N 0.32 2.78 -2.98 9.09 8.25 -1.26 -4.89 115.22 126.53 3ciy n HIS 665 Ca -0.14 -2.28 -0.42 0.00 -0.26 0.00 0.00 57.72 54.63 3ciy n HIS 665 Cb 0.57 -0.41 -0.05 0.00 1.12 0.00 0.00 29.99 31.23 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 4.83 -0.28 1.59 2.01 -1.26 -4.97 115.64 112.94 3ciy s THR 666 Ca 0.52 1.14 -0.39 0.00 0.31 0.00 0.00 61.69 63.27 3ciy s THR 666 Cb 0.42 -4.11 -0.14 0.00 0.01 0.00 0.00 72.50 68.68 3ciy s THR 666 CO 0.04 -0.20 1.87 -3.20 -0.69 0.00 0.00 174.62 172.43 3ciy n ASN 667 N 6.11 2.39 -3.82 3.53 2.85 0.32 -4.68 115.26 121.96 3ciy n ASN 667 Ca 0.03 0.92 -0.30 0.00 -0.11 0.00 0.00 54.58 55.11 3ciy n ASN 667 Cb 0.48 -1.18 -0.15 0.00 1.24 0.00 0.00 39.78 40.17 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 4.49 1.23 0.67 -1.44 1.01 -1.26 -2.37 121.20 123.52 3ciy s ILE 668 Ca 1.01 -1.51 -0.17 0.00 0.00 0.00 0.00 60.65 59.99 3ciy s ILE 668 Cb -1.01 -1.85 0.00 0.00 0.01 0.00 0.00 42.46 39.62 3ciy s ILE 668 CO 0.61 -0.54 1.22 -0.55 0.00 0.00 0.00 174.94 175.68 3ciy s SER 669 N 1.46 4.62 -0.35 3.58 0.15 -1.26 -3.51 113.70 118.38 3ciy s SER 669 Ca 0.07 2.42 0.00 0.00 0.70 0.00 0.00 55.95 59.14 3ciy s SER 669 Cb -0.18 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 3ciy s SER 669 CO -0.18 -1.98 0.00 -0.62 1.20 0.00 0.00 173.24 171.66 3ciy n GLU 670 N -2.18 -2.62 0.15 5.44 1.02 -1.26 -4.78 120.64 116.41 3ciy n GLU 670 Ca 0.14 0.20 0.18 0.00 -0.02 0.00 0.00 57.16 57.65 3ciy n GLU 670 Cb 0.50 -4.69 0.77 0.00 -0.02 0.00 0.00 31.44 28.00 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 0.00 0.00 -0.34 -4.62 5.85 -1.94 -2.45 115.31 111.81 3ciy h LEU 671 Ca -0.09 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.50 3ciy h LEU 671 Cb 1.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 3ciy h LEU 671 CO 0.11 0.00 -0.29 0.28 -0.34 0.00 0.00 178.44 178.20 3ciy h SER 672 N 0.00 0.84 0.00 1.25 0.02 -1.89 -3.39 113.55 110.38 3ciy h SER 672 Ca 0.13 -0.46 -0.21 0.00 -0.84 0.00 0.00 61.79 60.42 3ciy h SER 672 Cb 0.66 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 3ciy h SER 672 CO -0.00 1.12 -1.60 0.41 -1.14 0.00 0.00 176.83 175.62 3ciy n THR 673 N -4.20 0.99 -0.07 -2.27 -1.04 -0.96 -4.78 114.28 101.94 3ciy n THR 673 Ca -0.03 -0.12 -0.10 0.00 -2.04 0.00 0.00 64.05 61.76 3ciy n THR 673 Cb 0.48 -1.79 0.06 0.00 -1.82 0.00 0.00 70.33 67.26 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 -3.79 1.16 -1.73 -1.42 8.25 -0.98 -3.93 115.22 112.78 3ciy n HIS 674 Ca -0.26 -1.19 0.06 0.00 -0.26 0.00 0.00 57.72 56.07 3ciy n HIS 674 Cb 0.63 -0.60 0.12 0.00 1.12 0.00 0.00 29.99 31.26 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 -0.64 4.41 4.02 -1.26 -0.96 117.16 122.79 3ciy n TYR 675 Ca 0.23 -0.92 -0.31 0.00 -0.01 0.00 0.00 57.90 56.88 3ciy n TYR 675 Cb 0.84 -0.17 0.19 0.00 -0.02 0.00 0.00 39.34 40.18 3ciy n TYR 675 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3ciy n LEU 676 N -0.67 1.08 -4.92 7.72 4.77 -1.25 -2.51 117.00 121.22 3ciy n LEU 676 Ca 0.12 0.21 -0.29 0.00 -0.03 0.00 0.00 56.01 56.03 3ciy n LEU 676 Cb 0.78 -1.34 -0.04 0.00 -2.33 0.00 0.00 43.42 40.49 3ciy n LEU 676 CO -0.02 -2.77 0.01 0.00 -1.33 0.00 0.00 177.39 173.28 3ciy n ASN 678 N -0.36 1.17 -3.55 0.00 5.15 0.66 -0.31 115.26 118.02 3ciy n ASN 678 Ca -0.04 -0.50 -0.15 0.00 -0.60 0.00 0.00 54.58 53.29 3ciy n ASN 678 Cb 0.53 1.14 -0.06 0.00 -0.53 0.00 0.00 39.78 40.87 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 -2.16 0.00 0.12 -0.44 -1.32 -1.09 -4.78 115.64 105.96 3ciy s THR 679 Ca 0.01 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.48 3ciy s THR 679 Cb 0.07 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 70.09 3ciy s THR 679 CO 0.41 0.00 0.16 -2.65 -2.21 0.00 0.00 174.62 170.33 3ciy n PRO 680 N 0.92 0.20 -0.38 7.08 -0.02 -1.26 0.14 135.00 141.68 3ciy n PRO 680 Ca -0.16 -0.35 -0.01 0.00 -2.02 0.00 0.00 63.50 60.96 3ciy n PRO 680 Cb 0.57 -0.14 0.03 0.00 -0.02 0.00 0.00 33.50 33.94 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 -1.89 0.01 0.31 6.00 -0.00 -1.26 -0.82 115.22 117.56 3ciy n HIS 681 Ca 0.02 1.20 0.17 0.00 0.46 0.00 0.00 57.72 59.57 3ciy n HIS 681 Cb 0.08 -0.85 0.77 0.00 -0.12 0.00 0.00 29.99 29.88 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 -0.40 1.57 3.86 -2.00 -2.99 115.15 115.19 3ciy h HIS 682 Ca 0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.54 3ciy h HIS 682 Cb 0.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 3ciy h HIS 682 CO -0.86 0.00 0.00 0.66 0.86 0.00 0.00 177.93 178.59 3ciy n TYR 683 N -2.85 0.53 -2.23 2.45 4.01 -0.00 -4.96 117.16 114.11 3ciy n TYR 683 Ca -0.00 -0.46 -0.41 0.00 -0.16 0.00 0.00 57.90 56.87 3ciy n TYR 683 Cb 0.21 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.19 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 -1.01 3.21 -1.62 -0.72 6.14 -0.89 -2.75 117.35 119.71 3ciy s TYR 684 Ca 0.28 1.51 0.00 0.00 0.64 0.00 0.00 57.07 59.49 3ciy s TYR 684 Cb 0.15 -3.55 0.00 0.00 0.42 0.00 0.00 41.96 38.97 3ciy s TYR 684 CO 0.19 -1.44 0.00 0.41 0.64 0.00 0.00 175.55 175.35 3ciy n GLY 685 N 0.92 -0.27 3.59 8.97 0.00 0.58 -4.89 105.19 114.09 3ciy n GLY 685 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.89 3.22 -0.32 1.61 0.40 -1.11 -4.80 117.98 114.09 3ciy s PHE 686 Ca 0.00 -0.01 -0.39 0.00 -0.60 0.00 0.00 56.93 55.93 3ciy s PHE 686 Cb 0.00 -2.17 -0.15 0.00 0.51 0.00 0.00 43.02 41.21 3ciy s PHE 686 CO 0.00 0.00 1.91 -2.30 0.70 0.00 0.00 175.22 175.53 3ciy n PRO 687 N 4.09 1.01 -0.33 0.24 -0.02 -1.26 -1.95 135.00 136.78 3ciy n PRO 687 Ca -0.16 0.34 0.16 0.00 -2.02 0.00 0.00 63.50 61.83 3ciy n PRO 687 Cb 0.52 -2.14 0.36 0.00 -0.02 0.00 0.00 33.50 32.22 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 8.85 0.53 -0.48 2.45 5.85 -1.78 -2.32 115.31 128.40 3ciy h LEU 688 Ca -0.37 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.58 3ciy h LEU 688 Cb 1.33 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.37 3ciy h LEU 688 CO 0.99 0.04 0.08 0.07 -0.34 0.00 0.00 178.44 179.28 3ciy h LYS 689 N 0.49 0.21 -2.89 1.25 2.10 -1.84 -3.19 116.57 112.70 3ciy h LYS 689 Ca 0.62 -0.01 -0.64 0.00 -2.00 0.00 0.00 60.65 58.62 3ciy h LYS 689 Cb 1.20 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 32.50 3ciy h LYS 689 CO -0.51 0.14 3.41 1.28 -2.00 0.00 0.00 179.45 181.76 3ciy n LEU 690 N -5.13 8.44 -3.98 7.07 4.77 -0.87 -4.80 117.00 122.49 3ciy n LEU 690 Ca 0.05 -4.31 -0.31 0.00 -0.03 0.00 0.00 56.01 51.41 3ciy n LEU 690 Cb 0.24 -1.53 -0.15 0.00 -2.33 0.00 0.00 43.42 39.65 3ciy n LEU 690 CO 0.20 2.05 -0.38 0.12 -1.33 0.00 0.00 177.39 178.05 3ciy s PHE 691 N 1.81 3.16 -0.42 -1.77 2.19 -1.21 -4.93 117.98 116.82 3ciy s PHE 691 Ca 0.69 -2.47 -0.28 0.00 0.33 0.00 0.00 56.93 55.20 3ciy s PHE 691 Cb 0.19 -2.30 -0.02 0.00 -1.31 0.00 0.00 43.02 39.58 3ciy s PHE 691 CO -0.06 -0.89 1.86 0.16 1.83 0.00 0.00 175.22 178.12 3ciy s ASP 692 N 1.12 5.62 -0.17 6.13 -4.77 -1.26 -4.82 116.67 118.53 3ciy s ASP 692 Ca 0.03 1.03 0.06 0.00 -3.30 0.00 0.00 52.55 50.37 3ciy s ASP 692 Cb -0.19 -2.53 0.44 0.00 -1.09 0.00 0.00 42.92 39.55 3ciy s ASP 692 CO -0.09 -1.97 1.30 0.35 0.70 0.00 0.00 175.17 175.46 3ciy n THR 693 N 7.40 1.77 0.73 2.11 -2.24 -1.26 -4.16 114.28 118.63 3ciy n THR 693 Ca 0.23 -0.88 0.11 0.00 -2.27 0.00 0.00 64.05 61.24 3ciy n THR 693 Cb 0.49 -0.48 0.47 0.00 -2.10 0.00 0.00 70.33 68.71 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 0.11 0.13 -0.73 3.42 3.41 -1.26 -2.80 113.62 115.90 3ciy n SER 694 Ca 0.21 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.42 3ciy n SER 694 Cb 0.90 -0.55 0.12 0.00 -0.26 0.00 0.00 64.21 64.42 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 -1.63 2.67 -3.36 4.04 2.88 -1.26 -5.02 113.62 111.94 3ciy n SER 695 Ca 0.05 -1.78 -0.18 0.00 -1.33 0.00 0.00 58.87 55.63 3ciy n SER 695 Cb 0.28 -0.12 -0.04 0.00 -0.75 0.00 0.00 64.21 63.58 3ciy n SER 695 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81