#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ruy s THR 6 N 0.00 1.57 -0.10 -3.53 2.01 -1.26 -5.13 115.64 109.20 1ruy s THR 6 Ca 0.00 -1.57 -0.02 0.00 0.31 0.00 0.00 61.69 60.41 1ruy s THR 6 Cb 0.00 -1.50 0.04 0.00 0.01 0.00 0.00 72.50 71.05 1ruy s THR 6 CO 0.00 -0.16 0.02 -0.22 -0.69 0.00 0.00 174.62 173.57 1ruy s LEU 7 N -2.03 0.64 0.17 4.42 2.96 -1.26 -5.15 118.68 118.43 1ruy s LEU 7 Ca 0.06 -0.26 0.07 0.00 -0.22 0.00 0.00 54.13 53.78 1ruy s LEU 7 Cb -0.09 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.14 1ruy s LEU 7 CO 0.04 -0.24 0.01 0.00 -1.32 0.00 0.00 176.35 174.84 1ruy s ILE 9 N -1.70 2.86 0.11 0.00 1.01 -1.26 -5.10 121.20 117.13 1ruy s ILE 9 Ca 0.27 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 60.02 1ruy s ILE 9 Cb -0.09 -2.40 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 1ruy s ILE 9 CO 0.19 0.28 0.07 0.61 0.00 0.00 0.00 174.94 176.09 1ruy n GLY 10 N 4.68 3.73 3.16 6.18 0.00 -1.26 -5.18 105.19 116.50 1ruy n GLY 10 Ca -0.17 -1.81 -0.14 0.00 0.00 0.00 0.00 46.02 43.90 1ruy n GLY 10 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ruy s TYR 11 N -2.29 0.98 0.98 1.61 -0.85 -1.26 -5.15 117.35 111.38 1ruy s TYR 11 Ca 0.10 -0.65 -0.13 0.00 -0.52 0.00 0.00 57.07 55.87 1ruy s TYR 11 Cb 0.01 -0.55 0.08 0.00 0.38 0.00 0.00 41.96 41.87 1ruy s TYR 11 CO 0.07 -0.03 0.49 1.58 -1.52 0.00 0.00 175.55 176.14 1ruy n HIS 12 N 0.67 -1.09 -3.54 -3.49 -0.00 -1.26 -5.05 115.22 101.46 1ruy n HIS 12 Ca -0.17 0.22 -0.09 0.00 -0.00 0.00 0.00 57.72 57.68 1ruy n HIS 12 Cb 0.57 -1.78 -0.03 0.00 -0.00 0.00 0.00 29.99 28.75 1ruy n HIS 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1ruy s ALA 13 N -2.41 -1.88 0.00 1.57 0.00 -1.26 -4.73 121.76 113.05 1ruy s ALA 13 Ca 0.59 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.82 1ruy s ALA 13 Cb -0.20 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.89 1ruy s ALA 13 CO 0.66 -0.54 0.00 0.27 0.00 0.00 0.00 175.76 176.15 1ruy n ASN 14 N 0.14 0.00 -0.75 0.00 0.23 -1.26 -5.02 115.26 108.60 1ruy n ASN 14 Ca -0.09 -0.98 0.03 0.00 -0.53 0.00 0.00 54.58 53.01 1ruy n ASN 14 Cb 0.60 0.00 0.12 0.00 -2.08 0.00 0.00 39.78 38.42 1ruy n ASN 14 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1ruy n ASN 15 N -0.93 2.02 -4.76 0.53 6.94 -1.26 -4.75 115.26 113.06 1ruy n ASN 15 Ca 0.00 -2.19 -0.38 0.00 -0.02 0.00 0.00 54.58 52.00 1ruy n ASN 15 Cb 0.00 -0.41 0.02 0.00 -2.36 0.00 0.00 39.78 37.03 1ruy n ASN 15 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1ruy s SER 16 N -0.51 5.62 0.00 0.53 0.15 -1.26 -4.94 113.70 113.29 1ruy s SER 16 Ca 0.16 2.61 0.01 0.00 0.70 0.00 0.00 55.95 59.43 1ruy s SER 16 Cb 0.11 -2.63 0.01 0.00 -1.71 0.00 0.00 66.02 61.80 1ruy s SER 16 CO 0.07 -1.32 0.55 0.35 1.20 0.00 0.00 173.24 174.09 1ruy n THR 17 N -0.79 0.07 -1.63 6.45 -2.24 -1.26 -4.85 114.28 110.02 1ruy n THR 17 Ca 0.09 -0.54 -0.43 0.00 -2.27 0.00 0.00 64.05 60.90 1ruy n THR 17 Cb 0.46 0.98 -0.01 0.00 -2.10 0.00 0.00 70.33 69.66 1ruy n THR 17 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ruy n ASP 18 N -0.00 1.85 -4.09 3.42 10.43 -1.26 -4.84 116.55 122.05 1ruy n ASP 18 Ca 0.00 1.17 -0.17 0.00 2.57 0.00 0.00 54.79 58.37 1ruy n ASP 18 Cb 0.03 -1.37 -0.13 0.00 1.84 0.00 0.00 41.12 41.50 1ruy n ASP 18 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1ruy s THR 19 N -1.10 0.81 0.05 -3.53 -4.23 -1.26 -0.99 115.64 105.39 1ruy s THR 19 Ca 0.58 -0.98 -0.02 0.00 -1.18 0.00 0.00 61.69 60.09 1ruy s THR 19 Cb -0.63 -0.78 -0.03 0.00 1.34 0.00 0.00 72.50 72.39 1ruy s THR 19 CO 0.60 -0.16 0.01 0.68 -0.54 0.00 0.00 174.62 175.21 1ruy s VAL 20 N -1.02 0.19 0.20 2.29 -7.23 -0.60 -4.89 120.40 109.35 1ruy s VAL 20 Ca -0.03 -1.56 0.06 0.00 -1.81 0.00 0.00 61.98 58.64 1ruy s VAL 20 Cb -0.08 -1.29 -0.04 0.00 0.56 0.00 0.00 36.38 35.53 1ruy s VAL 20 CO 0.01 -0.86 0.16 -1.81 -0.31 0.00 0.00 175.10 172.29 1ruy s ASP 21 N -2.66 5.53 0.16 4.85 1.01 -1.26 -0.74 116.67 123.56 1ruy s ASP 21 Ca 0.03 -0.17 -0.01 0.00 0.71 0.00 0.00 52.55 53.10 1ruy s ASP 21 Cb 0.05 -1.43 -0.04 0.00 1.01 0.00 0.00 42.92 42.50 1ruy s ASP 21 CO -0.09 0.02 0.09 0.42 0.21 0.00 0.00 175.17 175.83 1ruy s THR 22 N -1.91 0.06 0.21 -1.27 -4.23 0.36 -4.98 115.64 103.88 1ruy s THR 22 Ca 0.32 -1.95 -0.10 0.00 -1.18 0.00 0.00 61.69 58.78 1ruy s THR 22 Cb -0.09 -2.24 0.15 0.00 1.34 0.00 0.00 72.50 71.66 1ruy s THR 22 CO 0.24 -0.26 1.71 0.58 -0.54 0.00 0.00 174.62 176.35 1ruy h VAL 23 N 2.76 0.67 0.00 2.29 2.07 -2.03 -3.04 116.25 118.96 1ruy h VAL 23 Ca -0.35 -0.10 -0.18 0.00 0.82 0.00 0.00 66.70 66.89 1ruy h VAL 23 Cb 1.22 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1ruy h VAL 23 CO 0.56 0.05 -1.24 -0.07 0.02 0.00 0.00 177.57 176.89 1ruy h LEU 24 N 0.28 0.00 -7.56 2.57 3.38 -2.04 -3.47 115.31 108.47 1ruy h LEU 24 Ca 0.31 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.08 1ruy h LEU 24 Cb 0.44 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.92 1ruy h LEU 24 CO -0.38 0.69 -0.56 -0.70 0.09 0.00 0.00 178.44 177.59 1ruy s GLU 25 N -2.85 0.16 0.15 1.13 2.12 -1.15 -5.16 118.70 113.11 1ruy s GLU 25 Ca -0.01 0.23 0.03 0.00 0.36 0.00 0.00 54.97 55.57 1ruy s GLU 25 Cb 0.08 0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.48 1ruy s GLU 25 CO 0.80 -0.04 0.28 0.15 -0.54 0.00 0.00 175.26 175.91 1ruy s LYS 26 N 0.26 3.41 -0.85 4.30 1.02 -1.26 -0.49 119.74 126.13 1ruy s LYS 26 Ca -0.02 -0.62 -0.04 0.00 0.02 0.00 0.00 55.97 55.32 1ruy s LYS 26 Cb -0.03 -2.95 -0.01 0.00 -0.52 0.00 0.00 37.83 34.33 1ruy s LYS 26 CO -0.01 0.51 0.71 -1.71 -0.92 0.00 0.00 175.35 173.93 1ruy n ASN 27 N -0.58 -6.53 -4.46 2.83 5.15 -1.21 -4.95 115.26 105.51 1ruy n ASN 27 Ca -0.07 -0.52 -0.37 0.00 -0.60 0.00 0.00 54.58 53.03 1ruy n ASN 27 Cb 0.54 -4.02 -0.12 0.00 -0.53 0.00 0.00 39.78 35.65 1ruy n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1ruy s VAL 28 N -3.10 4.42 0.14 3.44 1.01 0.08 -4.88 120.40 121.51 1ruy s VAL 28 Ca 0.11 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 1ruy s VAL 28 Cb -0.03 -3.08 -0.07 0.00 0.00 0.00 0.00 36.38 33.19 1ruy s VAL 28 CO 0.81 0.32 1.22 -0.89 0.00 0.00 0.00 175.10 176.56 1ruy s THR 29 N 1.63 3.66 0.32 3.92 2.01 -1.26 -1.56 115.64 124.36 1ruy s THR 29 Ca 0.06 1.30 0.11 0.00 0.31 0.00 0.00 61.69 63.47 1ruy s THR 29 Cb -0.15 -3.83 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 1ruy s THR 29 CO 0.04 0.16 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.31 1ruy s VAL 30 N 0.42 2.34 0.04 3.82 1.01 -0.16 -1.55 120.40 126.31 1ruy s VAL 30 Ca 0.56 -2.29 0.10 0.00 0.00 0.00 0.00 61.98 60.35 1ruy s VAL 30 Cb -0.32 -2.51 -0.22 0.00 0.00 0.00 0.00 36.38 33.33 1ruy s VAL 30 CO 0.34 -0.28 0.97 0.71 0.00 0.00 0.00 175.10 176.83 1ruy h THR 31 N 2.12 1.28 -2.86 3.92 1.35 -1.34 -3.39 112.91 113.99 1ruy h THR 31 Ca -0.41 -3.06 -0.13 0.00 -0.55 0.00 0.00 66.41 62.26 1ruy h THR 31 Cb 1.25 2.63 -0.24 0.00 -1.73 0.00 0.00 68.15 70.07 1ruy h THR 31 CO 0.66 0.73 -0.27 -1.00 -0.25 0.00 0.00 175.52 175.39 1ruy s HIS 32 N -2.65 -0.37 0.20 4.73 3.76 -1.26 -4.83 115.29 114.86 1ruy s HIS 32 Ca -0.02 0.87 -0.20 0.00 -0.15 0.00 0.00 55.06 55.55 1ruy s HIS 32 Cb 0.09 0.14 0.04 0.00 1.11 0.00 0.00 32.58 33.96 1ruy s HIS 32 CO 0.82 -0.24 0.59 -1.54 -0.85 0.00 0.00 174.74 173.52 1ruy s SER 33 N -0.10 -0.37 -0.06 1.40 1.04 -1.26 -0.75 113.70 113.59 1ruy s SER 33 Ca -0.03 -0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.11 1ruy s SER 33 Cb -0.03 0.62 0.01 0.00 0.10 0.00 0.00 66.02 66.71 1ruy s SER 33 CO 0.01 -1.08 -0.14 0.68 0.98 0.00 0.00 173.24 173.69 1ruy s VAL 34 N -3.83 1.26 -0.11 5.02 -7.23 -0.48 -4.89 120.40 110.14 1ruy s VAL 34 Ca 0.06 -0.58 -0.26 0.00 -1.81 0.00 0.00 61.98 59.40 1ruy s VAL 34 Cb -0.02 -1.13 -0.02 0.00 0.56 0.00 0.00 36.38 35.77 1ruy s VAL 34 CO -0.05 0.38 0.82 0.21 -0.31 0.00 0.00 175.10 176.15 1ruy s ASN 35 N 0.45 7.04 0.00 4.85 3.04 -1.26 -1.34 114.94 127.72 1ruy s ASN 35 Ca -0.12 1.27 0.21 0.00 0.04 0.00 0.00 52.86 54.26 1ruy s ASN 35 Cb -0.14 -2.46 -0.18 0.00 -1.54 0.00 0.00 41.25 36.93 1ruy s ASN 35 CO 0.04 -0.29 0.92 0.18 -3.04 0.00 0.00 177.10 174.91 1ruy n LEU 36 N 4.53 1.21 -4.52 3.21 4.77 0.16 -4.92 117.00 121.44 1ruy n LEU 36 Ca 0.03 -0.56 -0.39 0.00 -0.03 0.00 0.00 56.01 55.06 1ruy n LEU 36 Cb 0.50 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.48 1ruy n LEU 36 CO 0.49 0.27 -0.17 -0.22 -1.33 0.00 0.00 177.39 176.43 1ruy s LEU 37 N -2.85 4.17 -0.02 2.23 2.96 -1.24 -2.15 118.68 121.78 1ruy s LEU 37 Ca 0.10 -0.30 -0.23 0.00 -0.22 0.00 0.00 54.13 53.49 1ruy s LEU 37 Cb 0.16 -2.08 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 1ruy s LEU 37 CO 0.78 -0.15 0.68 -0.70 -1.32 0.00 0.00 176.35 175.64 1ruy s GLU 38 N 1.70 4.41 -0.02 1.98 2.56 0.81 -4.92 118.70 125.22 1ruy s GLU 38 Ca 0.06 0.87 0.13 0.00 0.00 0.00 0.00 54.97 56.03 1ruy s GLU 38 Cb -0.17 -3.39 0.23 0.00 2.00 0.00 0.00 34.13 32.80 1ruy s GLU 38 CO 0.09 0.22 1.10 -0.40 -0.56 0.00 0.00 175.26 175.70 1ruy n ASP 39 N 3.20 0.68 -4.17 -1.70 5.75 -1.26 -2.26 116.55 116.79 1ruy n ASP 39 Ca -0.03 -2.18 -0.24 0.00 -0.01 0.00 0.00 54.79 52.32 1ruy n ASP 39 Cb 0.51 -0.28 -0.15 0.00 -1.03 0.00 0.00 41.12 40.17 1ruy n ASP 39 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1ruy s SER 40 N -1.68 2.00 0.12 -1.12 0.01 -1.26 -4.94 113.70 106.82 1ruy s SER 40 Ca 0.19 -0.35 -0.06 0.00 1.31 0.00 0.00 55.95 57.04 1ruy s SER 40 Cb 0.21 -0.20 -0.02 0.00 0.21 0.00 0.00 66.02 66.22 1ruy s SER 40 CO -0.08 0.18 0.16 -1.38 0.41 0.00 0.00 173.24 172.53 1ruy s HIS 41 N -0.51 0.44 -1.78 2.43 -3.43 -1.26 -4.62 115.29 106.57 1ruy s HIS 41 Ca 0.06 -0.86 0.12 0.00 -0.80 0.00 0.00 55.06 53.58 1ruy s HIS 41 Cb -0.07 -0.20 0.38 0.00 -1.43 0.00 0.00 32.58 31.27 1ruy s HIS 41 CO -0.00 -0.58 1.29 0.27 -2.00 0.00 0.00 174.74 173.72 1ruy n ASN 42 N -0.10 2.45 -2.18 7.38 2.04 -0.91 -4.91 115.26 119.03 1ruy n ASN 42 Ca -0.10 -2.08 -0.12 0.00 -0.44 0.00 0.00 54.58 51.84 1ruy n ASN 42 Cb 0.63 -0.33 -0.02 0.00 -2.53 0.00 0.00 39.78 37.53 1ruy n ASN 42 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ruy n GLY 44 N 1.04 -0.11 3.14 4.83 0.00 -1.24 -4.83 105.19 108.01 1ruy n GLY 44 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 1ruy n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ruy s LYS 45 N -4.54 0.77 -0.44 1.61 1.02 -1.25 -4.41 119.74 112.49 1ruy s LYS 45 Ca 0.00 -0.87 -0.19 0.00 0.02 0.00 0.00 55.97 54.92 1ruy s LYS 45 Cb 0.00 -0.74 0.03 0.00 -0.52 0.00 0.00 37.83 36.60 1ruy s LYS 45 CO 0.00 0.16 0.57 -0.51 -0.92 0.00 0.00 175.35 174.66 1ruy s LEU 46 N -1.58 4.66 0.00 3.17 1.43 -0.07 -2.39 118.68 123.90 1ruy s LEU 46 Ca -0.03 -0.50 0.07 0.00 -1.03 0.00 0.00 54.13 52.64 1ruy s LEU 46 Cb -0.09 -2.59 0.07 0.00 0.03 0.00 0.00 46.19 43.60 1ruy s LEU 46 CO 0.02 -0.72 0.55 0.00 0.23 0.00 0.00 176.35 176.43 1ruy s ARG 48 N -4.41 3.57 0.09 0.00 1.70 -0.57 -4.62 118.95 114.70 1ruy s ARG 48 Ca 0.42 -0.19 0.08 0.00 -0.47 0.00 0.00 55.73 55.57 1ruy s ARG 48 Cb -0.03 -2.90 -0.04 0.00 -0.57 0.00 0.00 34.95 31.41 1ruy s ARG 48 CO 0.27 0.51 -0.18 -0.51 -1.08 0.00 0.00 175.30 174.31 1ruy s LEU 49 N -2.62 2.68 -1.33 -1.89 1.43 -1.07 -2.38 118.68 113.50 1ruy s LEU 49 Ca 0.39 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 1ruy s LEU 49 Cb -0.12 -1.55 0.00 0.00 0.03 0.00 0.00 46.19 44.55 1ruy s LEU 49 CO 0.26 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.65 1ruy n GLY 49 N 1.08 -0.03 2.41 -3.19 0.00 -1.26 -0.65 105.19 103.55 1ruy n GLY 49 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.71 1ruy n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ruy n GLY 50 N -0.72 1.20 3.17 -0.02 0.00 -1.26 -4.99 105.19 102.57 1ruy n GLY 50 Ca -0.17 -0.30 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 1ruy n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ruy s ILE 51 N -2.60 1.68 0.67 -0.61 1.01 0.18 -5.08 121.20 116.45 1ruy s ILE 51 Ca 0.00 -0.84 -0.15 0.00 0.00 0.00 0.00 60.65 59.66 1ruy s ILE 51 Cb 0.00 -1.44 0.01 0.00 0.01 0.00 0.00 42.46 41.03 1ruy s ILE 51 CO 0.00 0.47 1.14 0.00 0.00 0.00 0.00 174.94 176.55 1ruy s ALA 52 N 0.11 2.39 0.47 9.38 0.00 -1.26 -2.61 121.76 130.24 1ruy s ALA 52 Ca -0.08 0.65 -0.07 0.00 0.00 0.00 0.00 51.96 52.46 1ruy s ALA 52 Cb -0.14 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 1ruy s ALA 52 CO 0.04 -1.40 0.81 -1.25 0.00 0.00 0.00 175.76 173.96 1ruy s PRO 53 N -3.99 3.62 -0.46 0.00 0.04 -1.26 -1.81 135.00 131.15 1ruy s PRO 53 Ca 0.69 0.34 -0.22 0.00 0.04 0.00 0.00 61.00 61.85 1ruy s PRO 53 Cb -0.23 -2.35 0.03 0.00 0.04 0.00 0.00 34.50 31.99 1ruy s PRO 53 CO 0.41 -0.19 0.74 -1.17 0.04 0.00 0.00 177.00 176.83 1ruy s LEU 54 N -4.51 4.37 -0.58 -3.56 2.96 0.14 -4.88 118.68 112.61 1ruy s LEU 54 Ca 0.49 -0.26 -0.21 0.00 -0.22 0.00 0.00 54.13 53.94 1ruy s LEU 54 Cb -0.10 -2.84 0.07 0.00 0.50 0.00 0.00 46.19 43.82 1ruy s LEU 54 CO 0.42 -0.89 0.80 -1.58 -1.32 0.00 0.00 176.35 173.78 1ruy s GLN 55 N 3.13 3.13 0.51 1.98 2.00 -1.26 -0.08 119.66 129.06 1ruy s GLN 55 Ca 0.26 -0.90 0.32 0.00 -2.00 0.00 0.00 55.36 53.04 1ruy s GLN 55 Cb -0.13 -4.18 1.25 0.00 0.80 0.00 0.00 33.01 30.75 1ruy s GLN 55 CO 0.21 -1.53 1.93 -0.07 -0.50 0.00 0.00 175.29 175.32 1ruy h LEU 56 N 10.46 0.00 0.00 3.68 3.38 -1.52 -3.47 115.31 127.84 1ruy h LEU 56 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1ruy h LEU 56 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1ruy h LEU 56 CO 1.09 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.23 1ruy n GLY 57 N 0.13 3.19 0.00 0.83 0.00 -1.26 -0.86 105.19 107.23 1ruy n GLY 57 Ca 0.01 0.27 0.14 0.00 0.00 0.00 0.00 46.02 46.44 1ruy n GLY 57 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ruy n LYS 58 N 10.23 0.52 -3.86 1.61 0.00 -1.26 -3.71 118.16 121.69 1ruy n LYS 58 Ca 0.00 0.02 -0.21 0.00 -0.00 0.00 0.00 58.31 58.12 1ruy n LYS 58 Cb 0.00 -1.50 -0.03 0.00 -0.00 0.00 0.00 35.03 33.50 1ruy n LYS 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ruy s ASN 60 N -3.98 3.75 0.28 0.00 2.20 -1.02 -4.61 114.94 111.56 1ruy s ASN 60 Ca 0.39 -1.51 0.01 0.00 -0.94 0.00 0.00 52.86 50.81 1ruy s ASN 60 Cb -0.07 0.06 0.67 0.00 -2.00 0.00 0.00 41.25 39.91 1ruy s ASN 60 CO 0.27 -0.66 1.67 0.40 -2.94 0.00 0.00 177.10 175.84 1ruy h ILE 61 N 1.64 0.40 0.09 0.54 5.03 -1.94 -1.00 117.51 122.27 1ruy h ILE 61 Ca -0.43 -0.10 0.01 0.00 -0.12 0.00 0.00 64.86 64.23 1ruy h ILE 61 Cb 1.27 0.10 -0.02 0.00 -3.03 0.00 0.00 36.82 35.14 1ruy h ILE 61 CO 0.75 0.05 -0.16 0.00 -0.68 0.00 0.00 178.15 178.11 1ruy h ALA 62 N 1.73 -0.27 -0.56 1.87 0.00 -1.93 -0.51 119.26 119.59 1ruy h ALA 62 Ca 0.53 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.44 1ruy h ALA 62 Cb 1.02 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1ruy h ALA 62 CO -0.59 -0.68 0.37 0.78 0.00 0.00 0.00 179.25 179.13 1ruy h GLY 63 N -0.32 0.75 0.62 0.00 0.00 -1.31 -0.18 103.07 102.62 1ruy h GLY 63 Ca 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1ruy h GLY 63 CO -0.09 0.24 -0.22 -0.25 0.00 0.00 0.00 176.54 176.22 1ruy h TRP 64 N 0.67 -0.56 -0.64 5.60 7.01 -0.77 0.26 115.95 127.53 1ruy h TRP 64 Ca 0.22 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.14 1ruy h TRP 64 Cb 0.04 0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.26 1ruy h TRP 64 CO -0.00 -0.24 0.15 -0.07 -2.79 0.00 0.00 178.44 175.49 1ruy h LEU 65 N -1.00 0.98 -0.42 0.65 3.38 -0.99 -2.81 115.31 115.11 1ruy h LEU 65 Ca -0.06 -0.24 -0.16 0.00 0.09 0.00 0.00 57.88 57.51 1ruy h LEU 65 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1ruy h LEU 65 CO 0.10 0.96 -0.76 -0.07 0.09 0.00 0.00 178.44 178.76 1ruy h LEU 66 N 0.95 0.00 -0.59 1.67 3.38 -1.13 -3.45 115.31 116.14 1ruy h LEU 66 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1ruy h LEU 66 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1ruy h LEU 66 CO 0.00 0.76 0.00 0.61 0.09 0.00 0.00 178.44 179.91 1ruy n GLY 67 N 0.76 0.75 3.63 0.83 0.00 -0.03 -2.11 105.19 109.01 1ruy n GLY 67 Ca -0.00 -0.24 -0.45 0.00 0.00 0.00 0.00 46.02 45.33 1ruy n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ruy n ASN 68 N 0.15 1.88 0.24 1.61 2.85 0.71 -0.52 115.26 122.17 1ruy n ASN 68 Ca 0.00 1.18 0.18 0.00 -0.11 0.00 0.00 54.58 55.82 1ruy n ASN 68 Cb 0.20 -1.35 0.83 0.00 1.24 0.00 0.00 39.78 40.71 1ruy n ASN 68 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ruy h PRO 69 N 2.65 0.00 -0.36 1.20 0.11 -1.87 -0.34 132.00 133.40 1ruy h PRO 69 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1ruy h PRO 69 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1ruy h PRO 69 CO 0.65 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.83 1ruy n GLU 70 N -3.35 1.84 -0.07 1.05 -0.58 -1.26 -3.97 120.64 114.31 1ruy n GLU 70 Ca 0.01 -1.30 0.09 0.00 -0.42 0.00 0.00 57.16 55.54 1ruy n GLU 70 Cb 0.42 -1.28 0.12 0.00 -0.57 0.00 0.00 31.44 30.12 1ruy n GLU 70 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ruy h ASP 72 N 0.00 0.14 -0.90 0.00 3.32 -1.72 0.85 116.42 118.11 1ruy h ASP 72 Ca 0.00 0.02 0.20 0.00 0.02 0.00 0.00 57.03 57.27 1ruy h ASP 72 Cb 0.95 -0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.43 1ruy h ASP 72 CO 0.00 0.04 0.59 -0.07 -1.72 0.00 0.00 179.24 178.08 1ruy h LEU 73 N 0.13 0.42 0.00 1.55 3.38 -1.93 -0.38 115.31 118.47 1ruy h LEU 73 Ca 0.50 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1ruy h LEU 73 Cb 1.77 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.48 1ruy h LEU 73 CO -0.08 0.17 -0.08 0.18 0.09 0.00 0.00 178.44 178.71 1ruy n LEU 74 N -4.52 0.50 -0.32 1.67 4.77 0.29 -4.26 117.00 115.14 1ruy n LEU 74 Ca 0.19 0.49 0.15 0.00 -0.03 0.00 0.00 56.01 56.81 1ruy n LEU 74 Cb 0.69 -0.37 0.34 0.00 -2.33 0.00 0.00 43.42 41.75 1ruy n LEU 74 CO 0.30 -0.09 1.07 -0.07 -1.33 0.00 0.00 177.39 177.28 1ruy h LEU 75 N 0.00 0.40 -0.78 2.23 3.38 -1.14 -1.52 115.31 117.88 1ruy h LEU 75 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1ruy h LEU 75 Cb 0.64 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1ruy h LEU 75 CO 0.00 -0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.88 1ruy n THR 76 N -5.02 0.06 -3.10 0.22 -2.24 -1.26 -4.87 114.28 98.07 1ruy n THR 76 Ca 0.24 -0.22 -0.39 0.00 -2.27 0.00 0.00 64.05 61.41 1ruy n THR 76 Cb 0.71 0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 69.14 1ruy n THR 76 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ruy s VAL 77 N -1.94 4.90 0.00 2.28 1.01 -0.58 -4.93 120.40 121.14 1ruy s VAL 77 Ca 0.37 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.76 1ruy s VAL 77 Cb 0.20 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1ruy s VAL 77 CO 0.31 0.35 0.36 -1.54 0.00 0.00 0.00 175.10 174.58 1ruy n SER 78 N 3.07 0.00 -3.70 3.32 3.41 -1.26 -5.02 113.62 113.44 1ruy n SER 78 Ca -0.04 -1.00 -0.14 0.00 -0.26 0.00 0.00 58.87 57.43 1ruy n SER 78 Cb 0.51 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.37 1ruy n SER 78 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ruy s SER 79 N 0.00 -0.42 0.17 4.04 1.04 -1.26 -1.69 113.70 115.58 1ruy s SER 79 Ca 0.00 0.64 -0.20 0.00 0.48 0.00 0.00 55.95 56.87 1ruy s SER 79 Cb 0.00 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.86 1ruy s SER 79 CO 0.00 -0.31 0.55 -1.66 0.98 0.00 0.00 173.24 172.80 1ruy s TRP 80 N -0.44 -0.35 -0.17 5.02 -2.14 -0.88 -4.86 118.94 115.13 1ruy s TRP 80 Ca -0.06 0.06 0.20 0.00 2.66 0.00 0.00 56.10 58.97 1ruy s TRP 80 Cb -0.03 0.48 -0.09 0.00 -3.10 0.00 0.00 33.47 30.72 1ruy s TRP 80 CO 0.03 -0.87 0.87 -1.13 -2.66 0.00 0.00 176.95 173.19 1ruy n SER 81 N -0.35 0.73 -3.64 -2.66 3.41 -0.75 -4.75 113.62 105.62 1ruy n SER 81 Ca -0.14 0.30 -0.02 0.00 -0.26 0.00 0.00 58.87 58.75 1ruy n SER 81 Cb 0.64 0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 65.09 1ruy n SER 81 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1ruy s TYR 82 N -3.20 -0.04 -0.07 7.33 -0.85 -1.26 -4.63 117.35 114.63 1ruy s TYR 82 Ca -0.03 0.06 -0.11 0.00 -0.52 0.00 0.00 57.07 56.47 1ruy s TYR 82 Cb 0.10 0.50 -0.05 0.00 0.38 0.00 0.00 41.96 42.89 1ruy s TYR 82 CO 0.81 -0.05 0.26 0.42 -1.52 0.00 0.00 175.55 175.48 1ruy s ILE 83 N -1.44 5.29 -0.15 -3.49 1.01 -0.43 -0.69 121.20 121.30 1ruy s ILE 83 Ca 0.10 0.50 0.01 0.00 0.00 0.00 0.00 60.65 61.26 1ruy s ILE 83 Cb -0.01 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.93 1ruy s ILE 83 CO -0.06 0.59 -0.18 -0.69 0.00 0.00 0.00 174.94 174.60 1ruy s VAL 84 N -0.94 1.80 0.15 2.92 1.01 0.88 -1.28 120.40 124.94 1ruy s VAL 84 Ca 0.19 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1ruy s VAL 84 Cb -0.14 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1ruy s VAL 84 CO 0.08 0.50 0.01 -1.61 0.00 0.00 0.00 175.10 174.08 1ruy s GLU 85 N 1.20 2.48 0.48 2.72 2.02 -0.08 -1.40 118.70 126.13 1ruy s GLU 85 Ca 0.00 -1.02 0.04 0.00 0.02 0.00 0.00 54.97 54.02 1ruy s GLU 85 Cb -0.14 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1ruy s GLU 85 CO -0.08 0.48 0.05 0.95 0.02 0.00 0.00 175.26 176.68 1ruy s THR 86 N -1.62 1.54 -1.04 3.63 -4.23 -1.26 -0.53 115.64 112.13 1ruy s THR 86 Ca 0.27 -1.94 0.13 0.00 -1.18 0.00 0.00 61.69 58.98 1ruy s THR 86 Cb -0.10 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.39 1ruy s THR 86 CO 0.19 0.00 1.43 -2.65 -0.54 0.00 0.00 174.62 173.04 1ruy n PRO 87 N -1.21 0.02 -0.68 3.99 -0.02 -1.26 -2.36 135.00 133.48 1ruy n PRO 87 Ca -0.12 0.26 0.02 0.00 -2.02 0.00 0.00 63.50 61.63 1ruy n PRO 87 Cb 0.67 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.85 1ruy n PRO 87 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ruy n ASN 88 N -1.48 2.10 -4.39 2.55 5.03 -1.26 -4.87 115.26 112.94 1ruy n ASN 88 Ca 0.04 -3.81 -0.44 0.00 0.87 0.00 0.00 54.58 51.23 1ruy n ASN 88 Cb 0.15 -0.58 0.00 0.00 -1.02 0.00 0.00 39.78 38.34 1ruy n ASN 88 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1ruy n SER 89 N -1.12 5.23 -0.01 6.41 7.64 -1.00 -4.18 113.62 126.58 1ruy n SER 89 Ca 0.25 -3.00 0.07 0.00 1.01 0.00 0.00 58.87 57.21 1ruy n SER 89 Cb 0.85 -1.55 -0.14 0.00 -1.01 0.00 0.00 64.21 62.36 1ruy n SER 89 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ruy n ASP 90 N 5.33 0.94 -4.56 6.43 8.00 -0.51 -4.36 116.55 127.82 1ruy n ASP 90 Ca 0.37 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.47 1ruy n ASP 90 Cb 0.42 1.73 -0.03 0.00 -0.02 0.00 0.00 41.12 43.22 1ruy n ASP 90 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ruy s ASN 91 N -4.13 5.84 0.00 -2.24 0.02 -0.25 -4.78 114.94 109.40 1ruy s ASN 91 Ca -0.07 -0.02 0.00 0.00 -1.02 0.00 0.00 52.86 51.75 1ruy s ASN 91 Cb 0.11 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.83 1ruy s ASN 91 CO 0.73 -2.00 0.00 0.61 0.02 0.00 0.00 177.10 176.46 1ruy n GLY 92 N 5.47 1.79 3.46 0.66 0.00 -1.26 -2.45 105.19 112.86 1ruy n GLY 92 Ca 0.11 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1ruy n GLY 92 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ruy s THR 93 N 1.48 4.37 0.46 2.61 -4.23 -1.26 -3.94 115.64 115.14 1ruy s THR 93 Ca 0.00 -0.65 0.23 0.00 -1.18 0.00 0.00 61.69 60.09 1ruy s THR 93 Cb 0.00 -4.74 0.27 0.00 1.34 0.00 0.00 72.50 69.37 1ruy s THR 93 CO 0.00 -1.52 2.08 0.00 -0.54 0.00 0.00 174.62 174.65 1ruy s TYR 95 N -4.45 3.22 0.09 0.00 5.04 -1.26 -4.61 117.35 115.38 1ruy s TYR 95 Ca -0.04 0.02 -0.36 0.00 -2.44 0.00 0.00 57.07 54.25 1ruy s TYR 95 Cb 0.14 -2.54 -0.17 0.00 0.35 0.00 0.00 41.96 39.74 1ruy s TYR 95 CO 0.62 -0.33 1.27 -0.35 -1.34 0.00 0.00 175.55 175.42 1ruy n PRO 96 N 5.23 0.98 0.00 4.97 -0.04 -1.26 -4.66 135.00 140.22 1ruy n PRO 96 Ca -0.11 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 1ruy n PRO 96 Cb 0.50 -1.94 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1ruy n PRO 96 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ruy n GLY 97 N 2.30 -0.23 3.77 0.55 0.00 -1.25 -0.86 105.19 109.46 1ruy n GLY 97 Ca 0.18 -1.12 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 1ruy n GLY 97 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ruy s ASP 98 N 0.00 6.47 -0.49 1.61 2.15 -1.24 -4.94 116.67 120.23 1ruy s ASP 98 Ca 0.00 0.55 -0.11 0.00 0.43 0.00 0.00 52.55 53.42 1ruy s ASP 98 Cb 0.00 -2.17 0.12 0.00 -0.30 0.00 0.00 42.92 40.57 1ruy s ASP 98 CO 0.00 0.19 0.39 0.12 -0.17 0.00 0.00 175.17 175.70 1ruy s PHE 99 N -0.04 3.37 0.30 -5.34 5.99 -1.26 -0.57 117.98 120.43 1ruy s PHE 99 Ca 0.17 -1.69 -0.29 0.00 0.00 0.00 0.00 56.93 55.11 1ruy s PHE 99 Cb -0.13 -3.56 -0.11 0.00 0.00 0.00 0.00 43.02 39.22 1ruy s PHE 99 CO 0.05 -0.99 1.49 0.42 -0.00 0.00 0.00 175.22 176.18 1ruy s ILE 100 N 1.43 2.35 -1.56 3.12 -1.09 -0.48 -2.95 121.20 122.03 1ruy s ILE 100 Ca 0.05 0.31 -0.11 0.00 -2.23 0.00 0.00 60.65 58.67 1ruy s ILE 100 Cb -0.27 -3.20 0.09 0.00 -1.58 0.00 0.00 42.46 37.50 1ruy s ILE 100 CO 0.00 0.06 0.70 0.47 -1.23 0.00 0.00 174.94 174.95 1ruy n ASP 101 N 1.77 -2.56 -0.08 3.58 8.00 -1.26 -4.76 116.55 121.25 1ruy n ASP 101 Ca 0.05 -0.96 -0.11 0.00 0.71 0.00 0.00 54.79 54.49 1ruy n ASP 101 Cb 0.39 -3.13 -0.04 0.00 -0.02 0.00 0.00 41.12 38.31 1ruy n ASP 101 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1ruy h TYR 102 N -1.74 0.43 -0.92 1.24 3.20 -1.93 -2.46 116.97 114.79 1ruy h TYR 102 Ca -0.60 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.21 1ruy h TYR 102 Cb 1.38 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 39.49 1ruy h TYR 102 CO 0.57 0.56 0.61 0.93 -1.64 0.00 0.00 178.16 179.18 1ruy h GLU 103 N 0.18 1.20 -0.73 1.82 3.07 -1.89 -1.58 114.58 116.65 1ruy h GLU 103 Ca 0.07 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 1ruy h GLU 103 Cb 0.38 -0.27 -0.04 0.00 -0.84 0.00 0.00 28.75 27.98 1ruy h GLU 103 CO 0.01 0.80 0.48 0.93 -1.40 0.00 0.00 179.01 179.83 1ruy h GLU 104 N 1.24 0.96 -0.74 2.33 4.39 -1.91 -0.27 114.58 120.58 1ruy h GLU 104 Ca 0.34 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.93 1ruy h GLU 104 Cb -0.14 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.26 1ruy h GLU 104 CO -0.07 0.64 0.30 1.25 -1.16 0.00 0.00 179.01 179.96 1ruy h LEU 105 N 0.99 1.02 -0.50 1.33 5.85 -0.86 0.27 115.31 123.41 1ruy h LEU 105 Ca 0.27 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.82 1ruy h LEU 105 Cb -0.11 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.63 1ruy h LEU 105 CO -0.06 0.91 0.33 0.03 -0.34 0.00 0.00 178.44 179.32 1ruy h ARG 106 N 1.06 0.65 -0.90 1.25 3.08 -0.70 -0.30 114.38 118.52 1ruy h ARG 106 Ca 0.25 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.27 1ruy h ARG 106 Cb 0.21 -0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1ruy h ARG 106 CO -0.02 0.43 0.59 1.49 -1.07 0.00 0.00 179.97 181.39 1ruy h GLU 107 N 0.67 1.16 -0.30 0.04 4.57 -0.35 -2.43 114.58 117.94 1ruy h GLU 107 Ca 0.18 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1ruy h GLU 107 Cb -0.08 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.24 1ruy h GLU 107 CO -0.04 0.77 0.20 1.96 -1.18 0.00 0.00 179.01 180.71 1ruy h GLN 108 N 1.20 0.39 0.00 1.92 1.08 0.02 -2.37 115.11 117.35 1ruy h GLN 108 Ca 0.34 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.51 1ruy h GLN 108 Cb -0.10 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.24 1ruy h GLN 108 CO -0.08 0.26 -0.02 -0.07 -0.95 0.00 0.00 178.83 177.96 1ruy h LEU 109 N 0.40 0.00 -1.45 1.46 -0.00 -0.62 -2.85 115.31 112.24 1ruy h LEU 109 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 1ruy h LEU 109 Cb -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.62 1ruy h LEU 109 CO -0.03 0.02 0.00 0.28 -0.00 0.00 0.00 178.44 178.71 1ruy h SER 110 N 0.00 0.00 -0.05 -0.43 0.02 -1.03 -1.35 113.55 110.70 1ruy h SER 110 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ruy h SER 110 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1ruy h SER 110 CO 0.00 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.15 1ruy n SER 111 N -2.36 2.64 -4.45 3.07 3.41 -1.08 -3.41 113.62 111.44 1ruy n SER 111 Ca -0.01 -3.03 -0.38 0.00 -0.26 0.00 0.00 58.87 55.19 1ruy n SER 111 Cb 0.08 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 63.48 1ruy n SER 111 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ruy s VAL 112 N -2.80 4.53 -0.74 -3.33 1.01 -0.51 -1.54 120.40 117.02 1ruy s VAL 112 Ca 0.33 -0.28 0.23 0.00 0.00 0.00 0.00 61.98 62.26 1ruy s VAL 112 Cb 0.28 -3.23 -0.11 0.00 0.00 0.00 0.00 36.38 33.33 1ruy s VAL 112 CO 0.04 0.19 1.08 -1.54 0.00 0.00 0.00 175.10 174.87 1ruy n SER 113 N 4.96 0.64 -3.58 3.32 3.41 -0.36 -4.88 113.62 117.13 1ruy n SER 113 Ca -0.15 -0.33 0.02 0.00 -0.26 0.00 0.00 58.87 58.15 1ruy n SER 113 Cb 0.50 0.72 -0.01 0.00 -0.26 0.00 0.00 64.21 65.17 1ruy n SER 113 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ruy s SER 114 N -3.61 -0.01 0.28 4.04 1.04 -1.20 -2.06 113.70 112.17 1ruy s SER 114 Ca 0.06 -0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.39 1ruy s SER 114 Cb 0.15 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.30 1ruy s SER 114 CO 0.79 -0.05 0.45 0.72 0.98 0.00 0.00 173.24 176.14 1ruy s PHE 115 N -2.08 0.67 -0.31 5.02 -0.12 -0.68 -0.12 117.98 120.36 1ruy s PHE 115 Ca 0.14 -0.99 0.03 0.00 -0.05 0.00 0.00 56.93 56.06 1ruy s PHE 115 Cb 0.05 0.05 0.09 0.00 -0.63 0.00 0.00 43.02 42.58 1ruy s PHE 115 CO -0.05 -1.03 0.01 -1.21 -0.05 0.00 0.00 175.22 172.89 1ruy s GLU 116 N -3.63 1.58 0.23 1.99 8.01 0.07 -4.81 118.70 122.15 1ruy s GLU 116 Ca 0.27 -1.62 -0.30 0.00 0.01 0.00 0.00 54.97 53.33 1ruy s GLU 116 Cb 0.00 -2.98 -0.09 0.00 -4.31 0.00 0.00 34.13 26.76 1ruy s GLU 116 CO 0.13 -0.84 1.14 0.50 0.01 0.00 0.00 175.26 176.21 1ruy s ARG 117 N 1.05 4.57 0.03 1.61 3.52 -1.26 -1.95 118.95 126.51 1ruy s ARG 117 Ca 0.05 1.83 -0.13 0.00 -0.13 0.00 0.00 55.73 57.35 1ruy s ARG 117 Cb -0.19 -3.22 0.02 0.00 -1.56 0.00 0.00 34.95 30.00 1ruy s ARG 117 CO -0.09 0.06 0.28 -0.59 -0.81 0.00 0.00 175.30 174.16 1ruy s PHE 118 N -0.58 -0.09 -1.09 5.12 -0.12 -0.73 -4.99 117.98 115.51 1ruy s PHE 118 Ca 0.49 -0.03 -0.19 0.00 -0.05 0.00 0.00 56.93 57.15 1ruy s PHE 118 Cb -0.32 0.07 0.09 0.00 -0.63 0.00 0.00 43.02 42.23 1ruy s PHE 118 CO 0.39 -0.47 1.44 -2.00 -0.05 0.00 0.00 175.22 174.53 1ruy s GLU 119 N -2.34 3.76 0.28 1.99 2.12 -1.26 -1.01 118.70 122.25 1ruy s GLU 119 Ca -0.07 -1.70 0.01 0.00 0.36 0.00 0.00 54.97 53.58 1ruy s GLU 119 Cb -0.02 -5.25 0.59 0.00 0.26 0.00 0.00 34.13 29.71 1ruy s GLU 119 CO -0.02 -2.05 1.78 0.97 -0.54 0.00 0.00 175.26 175.40 1ruy h ILE 120 N 5.96 0.76 -2.97 -3.70 2.10 -1.73 -3.29 117.51 114.64 1ruy h ILE 120 Ca 0.27 -0.25 -0.61 0.00 1.08 0.00 0.00 64.86 65.35 1ruy h ILE 120 Cb 0.96 -0.03 -0.40 0.00 -1.09 0.00 0.00 36.82 36.25 1ruy h ILE 120 CO 1.33 0.13 -0.74 -0.36 -1.08 0.00 0.00 178.15 177.44 1ruy s PHE 121 N -5.94 2.06 0.11 2.19 2.99 -1.17 -5.03 117.98 113.19 1ruy s PHE 121 Ca -0.12 -2.50 -0.36 0.00 0.00 0.00 0.00 56.93 53.96 1ruy s PHE 121 Cb 0.23 -1.90 -0.17 0.00 0.00 0.00 0.00 43.02 41.18 1ruy s PHE 121 CO 0.79 -0.77 1.28 -2.30 -0.00 0.00 0.00 175.22 174.23 1ruy n PRO 122 N 3.39 1.11 -0.14 0.24 -0.02 -1.24 -4.68 135.00 133.66 1ruy n PRO 122 Ca 0.11 0.40 -0.08 0.00 -2.02 0.00 0.00 63.50 61.91 1ruy n PRO 122 Cb 0.35 -2.00 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 1ruy n PRO 122 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ruy h LYS 123 N 4.20 0.59 -0.42 -0.52 3.64 -1.94 -1.96 116.57 120.17 1ruy h LYS 123 Ca -0.47 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1ruy h LYS 123 Cb 1.34 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1ruy h LYS 123 CO 0.75 0.42 0.00 0.25 -2.27 0.00 0.00 179.45 178.60 1ruy n THR 124 N -4.75 0.30 -0.43 1.00 -2.24 -1.26 -4.20 114.28 102.71 1ruy n THR 124 Ca 0.01 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1ruy n THR 124 Cb 0.04 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1ruy n THR 124 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ruy n SER 125 N -0.02 0.00 0.06 3.42 3.41 -1.17 -4.93 113.62 114.38 1ruy n SER 125 Ca 0.05 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.78 1ruy n SER 125 Cb 0.23 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.34 1ruy n SER 125 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ruy n SER 126 N 0.00 0.68 -3.16 4.04 7.64 -0.74 -4.55 113.62 117.53 1ruy n SER 126 Ca 0.00 0.09 -0.24 0.00 1.01 0.00 0.00 58.87 59.73 1ruy n SER 126 Cb 0.00 0.22 -0.05 0.00 -1.01 0.00 0.00 64.21 63.36 1ruy n SER 126 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1ruy n TRP 127 N -2.08 2.17 -0.23 1.43 7.02 -1.26 -4.93 117.44 119.56 1ruy n TRP 127 Ca 0.03 -3.91 0.19 0.00 -1.02 0.00 0.00 57.50 52.79 1ruy n TRP 127 Cb 0.44 -0.46 0.51 0.00 -2.42 0.00 0.00 31.31 29.38 1ruy n TRP 127 CO 0.00 0.00 0.00 -1.35 -2.02 0.00 0.00 177.69 174.32 1ruy h PRO 128 N 3.42 0.39 -0.54 -0.99 0.11 -1.95 -2.79 132.00 129.65 1ruy h PRO 128 Ca 0.13 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.06 1ruy h PRO 128 Cb 0.73 -0.09 -0.09 0.00 0.11 0.00 0.00 31.00 31.66 1ruy h PRO 128 CO 0.68 0.26 0.14 0.09 -0.21 0.00 0.00 178.00 178.95 1ruy n ASN 129 N -4.50 4.21 -3.85 -2.05 3.02 -1.26 -4.97 115.26 105.86 1ruy n ASN 129 Ca 0.18 -3.26 -0.11 0.00 -0.03 0.00 0.00 54.58 51.37 1ruy n ASN 129 Cb 0.68 -0.67 -0.09 0.00 -0.61 0.00 0.00 39.78 39.08 1ruy n ASN 129 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1ruy s HIS 130 N -2.99 0.05 0.20 3.10 3.76 -1.06 -4.61 115.29 113.73 1ruy s HIS 130 Ca 0.50 -0.22 -0.29 0.00 -0.15 0.00 0.00 55.06 54.90 1ruy s HIS 130 Cb 0.41 -0.03 -0.08 0.00 1.11 0.00 0.00 32.58 33.98 1ruy s HIS 130 CO 0.10 -0.39 0.92 1.21 -0.85 0.00 0.00 174.74 175.74 1ruy s ASN 131 N -1.86 7.58 -0.03 1.40 3.84 -0.70 -4.92 114.94 120.25 1ruy s ASN 131 Ca -0.08 1.87 0.05 0.00 0.21 0.00 0.00 52.86 54.91 1ruy s ASN 131 Cb -0.03 -2.59 0.09 0.00 -0.55 0.00 0.00 41.25 38.18 1ruy s ASN 131 CO -0.02 0.11 1.06 0.35 -2.79 0.00 0.00 177.10 175.81 1ruy n THR 132 N 1.85 1.21 0.07 -5.21 -2.24 -1.26 -3.04 114.28 105.67 1ruy n THR 132 Ca -0.01 -1.28 0.01 0.00 -2.27 0.00 0.00 64.05 60.50 1ruy n THR 132 Cb 0.48 0.33 -0.01 0.00 -2.10 0.00 0.00 70.33 69.03 1ruy n THR 132 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ruy n ASN 133 N -0.61 0.90 -1.26 3.42 3.02 -1.26 -4.65 115.26 114.82 1ruy n ASN 133 Ca 0.05 -0.45 0.11 0.00 -0.03 0.00 0.00 54.58 54.26 1ruy n ASN 133 Cb 0.36 1.02 0.30 0.00 -0.61 0.00 0.00 39.78 40.84 1ruy n ASN 133 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ruy n LYS 133 N -1.14 2.60 -1.27 3.52 5.02 -1.26 -4.72 118.16 120.90 1ruy n LYS 133 Ca 0.00 -2.45 -0.28 0.00 -2.02 0.00 0.00 58.31 53.56 1ruy n LYS 133 Cb 0.03 -1.53 -0.08 0.00 -0.02 0.00 0.00 35.03 33.43 1ruy n LYS 133 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ruy n GLY 134 N 1.57 3.88 3.48 0.72 0.00 -1.25 -4.89 105.19 108.70 1ruy n GLY 134 Ca 0.23 -1.48 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 1ruy n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ruy s VAL 135 N 1.03 1.70 -0.01 1.61 -7.23 -1.26 -4.53 120.40 111.72 1ruy s VAL 135 Ca 0.66 -2.09 -0.23 0.00 -1.81 0.00 0.00 61.98 58.51 1ruy s VAL 135 Cb 0.25 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.61 1ruy s VAL 135 CO -0.05 -0.18 0.50 0.28 -0.31 0.00 0.00 175.10 175.33 1ruy s THR 136 N -2.96 0.03 -0.96 5.32 -1.32 0.09 -4.87 115.64 110.97 1ruy s THR 136 Ca 0.32 -0.25 0.15 0.00 -1.21 0.00 0.00 61.69 60.70 1ruy s THR 136 Cb 0.05 -0.87 0.13 0.00 -1.51 0.00 0.00 72.50 70.30 1ruy s THR 136 CO 0.14 -0.14 1.48 0.00 -2.21 0.00 0.00 174.62 173.89 1ruy n ALA 137 N 0.86 1.66 0.25 11.08 0.00 -1.26 -1.88 120.51 131.22 1ruy n ALA 137 Ca -0.20 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.33 1ruy n ALA 137 Cb 0.58 -1.24 0.22 0.00 0.00 0.00 0.00 19.45 19.00 1ruy n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ruy h ALA 138 N 2.48 1.00 -2.14 0.00 0.00 -1.88 -3.35 119.26 115.37 1ruy h ALA 138 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 1ruy h ALA 138 Cb 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.64 1ruy h ALA 138 CO 0.00 0.00 -0.81 0.00 0.00 0.00 0.00 179.25 178.44 1ruy s PRO 140 N -2.35 3.43 -0.15 0.00 0.04 -1.25 -1.46 135.00 133.25 1ruy s PRO 140 Ca 0.41 0.94 -0.07 0.00 0.04 0.00 0.00 61.00 62.32 1ruy s PRO 140 Cb 0.21 -2.06 0.06 0.00 0.04 0.00 0.00 34.50 32.75 1ruy s PRO 140 CO -0.07 -0.70 0.34 -0.47 0.04 0.00 0.00 177.00 176.14 1ruy s TYR 141 N -2.88 -0.54 -1.41 0.56 5.04 -0.06 -4.74 117.35 113.32 1ruy s TYR 141 Ca 0.58 1.15 -0.07 0.00 -2.44 0.00 0.00 57.07 56.29 1ruy s TYR 141 Cb -0.13 0.16 0.04 0.00 0.35 0.00 0.00 41.96 42.38 1ruy s TYR 141 CO 0.46 -0.35 0.89 0.00 -1.34 0.00 0.00 175.55 175.22 1ruy n ALA 142 N 4.70 -1.62 0.00 3.97 0.00 -1.26 -1.48 120.51 124.82 1ruy n ALA 142 Ca -0.17 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ruy n ALA 142 Cb 0.52 -3.48 0.00 0.00 0.00 0.00 0.00 19.45 16.49 1ruy n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ruy n GLY 143 N -1.65 1.51 3.90 0.00 0.00 -1.26 -4.95 105.19 102.74 1ruy n GLY 143 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 1ruy n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ruy s ALA 144 N -0.44 3.53 0.39 4.61 0.00 -0.55 -5.02 121.76 124.28 1ruy s ALA 144 Ca 0.00 -0.53 -0.27 0.00 0.00 0.00 0.00 51.96 51.16 1ruy s ALA 144 Cb 0.00 -2.42 -0.09 0.00 0.00 0.00 0.00 23.12 20.61 1ruy s ALA 144 CO 0.00 0.02 1.32 -1.12 0.00 0.00 0.00 175.76 175.98 1ruy s SER 145 N -3.51 6.39 0.00 0.00 0.01 -1.26 -0.88 113.70 114.45 1ruy s SER 145 Ca 0.46 2.70 0.00 0.00 1.31 0.00 0.00 55.95 60.42 1ruy s SER 145 Cb -0.10 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1ruy s SER 145 CO 0.34 -0.80 0.00 -0.24 0.41 0.00 0.00 173.24 172.96 1ruy n SER 146 N 0.29 0.17 -3.62 2.44 2.88 -0.54 -4.71 113.62 110.53 1ruy n SER 146 Ca 0.03 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1ruy n SER 146 Cb 0.43 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.89 1ruy n SER 146 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1ruy s PHE 147 N 0.49 -0.00 0.40 0.66 5.36 -1.13 -0.73 117.98 123.03 1ruy s PHE 147 Ca 0.00 -0.23 -0.26 0.00 -0.96 0.00 0.00 56.93 55.48 1ruy s PHE 147 Cb 0.00 0.61 -0.10 0.00 -0.34 0.00 0.00 43.02 43.19 1ruy s PHE 147 CO 0.00 -0.55 1.35 0.66 -1.46 0.00 0.00 175.22 175.22 1ruy n TYR 148 N -0.67 2.43 0.13 10.12 4.01 -1.26 -4.49 117.16 127.43 1ruy n TYR 148 Ca -0.03 0.49 0.01 0.00 -0.16 0.00 0.00 57.90 58.20 1ruy n TYR 148 Cb 0.60 -2.43 0.10 0.00 -0.31 0.00 0.00 39.34 37.30 1ruy n TYR 148 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ruy h ARG 149 N 2.37 0.00 -0.27 -0.72 2.47 -0.87 -3.31 114.38 114.04 1ruy h ARG 149 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1ruy h ARG 149 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.60 1ruy h ARG 149 CO 0.61 0.60 0.00 0.09 0.56 0.00 0.00 179.97 181.83 1ruy n ASN 150 N -3.41 2.97 -4.36 7.04 3.02 -0.90 -4.72 115.26 114.89 1ruy n ASN 150 Ca 0.00 -1.92 -0.19 0.00 -0.03 0.00 0.00 54.58 52.44 1ruy n ASN 150 Cb 0.70 -0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.60 1ruy n ASN 150 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ruy s LEU 151 N -1.61 2.44 -0.18 3.41 1.43 -1.25 -1.21 118.68 121.71 1ruy s LEU 151 Ca 0.36 -1.13 -0.02 0.00 -1.03 0.00 0.00 54.13 52.31 1ruy s LEU 151 Cb 0.21 -0.52 0.05 0.00 0.03 0.00 0.00 46.19 45.96 1ruy s LEU 151 CO 0.30 -0.34 -0.00 -0.22 0.23 0.00 0.00 176.35 176.32 1ruy s LEU 152 N -3.35 1.39 -0.72 1.79 0.20 0.32 -4.73 118.68 113.59 1ruy s LEU 152 Ca 0.26 -0.74 -0.27 0.00 0.69 0.00 0.00 54.13 54.07 1ruy s LEU 152 Cb 0.03 -0.73 0.03 0.00 -0.43 0.00 0.00 46.19 45.09 1ruy s LEU 152 CO 0.08 -0.25 1.26 0.86 -0.29 0.00 0.00 176.35 178.01 1ruy s TRP 153 N 1.76 2.34 0.05 5.38 -0.11 -1.26 -1.54 118.94 125.55 1ruy s TRP 153 Ca -0.00 -0.02 -0.25 0.00 1.22 0.00 0.00 56.10 57.05 1ruy s TRP 153 Cb -0.16 -4.60 -0.06 0.00 -1.50 0.00 0.00 33.47 27.15 1ruy s TRP 153 CO -0.07 -2.00 0.77 -0.51 -4.62 0.00 0.00 176.95 170.51 1ruy s LEU 154 N 5.57 4.46 0.32 5.86 1.43 -1.24 -3.84 118.68 131.24 1ruy s LEU 154 Ca 0.35 1.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.95 1ruy s LEU 154 Cb -0.08 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 42.84 1ruy s LEU 154 CO 0.16 0.03 0.08 0.68 0.23 0.00 0.00 176.35 177.52 1ruy s VAL 155 N -0.12 0.94 0.77 -1.59 -7.23 -1.17 -4.73 120.40 107.27 1ruy s VAL 155 Ca 0.38 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.41 1ruy s VAL 155 Cb -0.21 -2.69 0.06 0.00 0.56 0.00 0.00 36.38 34.11 1ruy s VAL 155 CO 0.23 0.00 1.22 -1.59 -0.31 0.00 0.00 175.10 174.65 1ruy s LYS 156 N -3.90 1.87 -0.18 4.82 -2.85 0.56 -1.71 119.74 118.35 1ruy s LYS 156 Ca 0.35 1.80 0.00 0.00 -1.00 0.00 0.00 55.97 57.12 1ruy s LYS 156 Cb 0.08 -1.80 0.01 0.00 -2.06 0.00 0.00 37.83 34.06 1ruy s LYS 156 CO 0.15 -2.05 -0.17 0.21 0.10 0.00 0.00 175.35 173.59 1ruy s LYS 157 N -3.99 3.10 -1.29 1.78 2.20 -0.46 -4.22 119.74 116.86 1ruy s LYS 157 Ca 0.75 -0.78 -0.16 0.00 -0.36 0.00 0.00 55.97 55.41 1ruy s LYS 157 Cb -0.30 -2.64 0.01 0.00 -1.51 0.00 0.00 37.83 33.39 1ruy s LYS 157 CO 0.48 -0.14 0.55 0.41 -0.36 0.00 0.00 175.35 176.29 1ruy n GLY 158 N 4.46 -0.61 2.57 5.54 0.00 -1.26 -1.15 105.19 114.75 1ruy n GLY 158 Ca -0.20 0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.94 1ruy n GLY 158 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ruy n ASN 159 N -2.64 -5.02 -3.75 1.61 3.02 -1.26 -4.97 115.26 102.24 1ruy n ASN 159 Ca -0.19 -0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.23 1ruy n ASN 159 Cb 0.62 -4.18 -0.13 0.00 -0.61 0.00 0.00 39.78 35.48 1ruy n ASN 159 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ruy s SER 160 N -2.18 -0.18 -0.48 6.41 0.15 -0.30 -4.97 113.70 112.15 1ruy s SER 160 Ca 0.07 0.40 0.03 0.00 0.70 0.00 0.00 55.95 57.15 1ruy s SER 160 Cb -0.03 0.31 0.15 0.00 -1.71 0.00 0.00 66.02 64.73 1ruy s SER 160 CO 0.09 -0.14 0.30 -0.47 1.20 0.00 0.00 173.24 174.22 1ruy s TYR 161 N 0.99 2.02 0.72 3.44 5.04 -1.26 -1.36 117.35 126.95 1ruy s TYR 161 Ca -0.07 -2.53 -0.14 0.00 -2.44 0.00 0.00 57.07 51.89 1ruy s TYR 161 Cb -0.09 -1.79 0.03 0.00 0.35 0.00 0.00 41.96 40.47 1ruy s TYR 161 CO -0.06 -0.75 1.14 -2.14 -1.34 0.00 0.00 175.55 172.40 1ruy s PRO 162 N 0.01 2.35 -0.02 4.97 0.02 -1.26 -4.82 135.00 136.25 1ruy s PRO 162 Ca 0.22 1.49 -0.30 0.00 0.02 0.00 0.00 61.00 62.44 1ruy s PRO 162 Cb -0.15 -1.89 -0.07 0.00 0.02 0.00 0.00 34.50 32.41 1ruy s PRO 162 CO -0.07 -1.62 1.89 0.21 -0.33 0.00 0.00 177.00 177.08 1ruy s LYS 163 N -4.20 4.05 0.16 5.54 2.20 -1.26 -4.75 119.74 121.49 1ruy s LYS 163 Ca 0.68 2.41 -0.01 0.00 -0.36 0.00 0.00 55.97 58.70 1ruy s LYS 163 Cb -0.23 -4.13 -0.04 0.00 -1.51 0.00 0.00 37.83 31.92 1ruy s LYS 163 CO 0.46 -1.04 0.35 -0.48 -0.36 0.00 0.00 175.35 174.28 1ruy s LEU 164 N 4.70 4.27 -0.19 5.43 0.05 0.21 -4.93 118.68 128.22 1ruy s LEU 164 Ca 0.85 0.40 -0.04 0.00 0.05 0.00 0.00 54.13 55.39 1ruy s LEU 164 Cb -0.39 -3.14 0.09 0.00 -2.05 0.00 0.00 46.19 40.70 1ruy s LEU 164 CO 0.37 0.02 0.28 -0.55 -0.55 0.00 0.00 176.35 175.93 1ruy s SER 165 N -2.89 0.71 -0.05 1.48 0.15 -1.26 -1.82 113.70 110.02 1ruy s SER 165 Ca 0.38 0.21 0.02 0.00 0.70 0.00 0.00 55.95 57.26 1ruy s SER 165 Cb -0.12 0.69 0.01 0.00 -1.71 0.00 0.00 66.02 64.90 1ruy s SER 165 CO 0.28 -0.29 -0.08 -0.75 1.20 0.00 0.00 173.24 173.60 1ruy s LYS 166 N 2.42 1.20 0.22 5.44 2.47 0.38 -4.98 119.74 126.89 1ruy s LYS 166 Ca 0.06 -0.27 0.09 0.00 -1.56 0.00 0.00 55.97 54.30 1ruy s LYS 166 Cb -0.14 -1.07 -0.05 0.00 -1.46 0.00 0.00 37.83 35.11 1ruy s LYS 166 CO -0.12 0.00 -0.17 -1.12 0.16 0.00 0.00 175.35 174.10 1ruy s SER 167 N 0.67 2.92 -0.05 1.43 0.01 -1.26 0.40 113.70 117.82 1ruy s SER 167 Ca -0.11 -0.98 -0.02 0.00 1.31 0.00 0.00 55.95 56.14 1ruy s SER 167 Cb -0.14 -0.19 0.03 0.00 0.21 0.00 0.00 66.02 65.93 1ruy s SER 167 CO 0.02 -0.07 0.11 -0.47 0.41 0.00 0.00 173.24 173.24 1ruy s TYR 168 N -2.59 -0.11 -0.18 2.43 5.04 -0.02 -4.98 117.35 116.94 1ruy s TYR 168 Ca 0.23 0.37 -0.06 0.00 -2.44 0.00 0.00 57.07 55.18 1ruy s TYR 168 Cb -0.03 -0.10 -0.03 0.00 0.35 0.00 0.00 41.96 42.14 1ruy s TYR 168 CO 0.09 -0.14 0.03 0.08 -1.34 0.00 0.00 175.55 174.27 1ruy s VAL 169 N 1.01 4.41 -0.53 3.14 1.01 -1.26 -1.44 120.40 126.74 1ruy s VAL 169 Ca -0.08 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 61.48 1ruy s VAL 169 Cb -0.11 -2.97 0.04 0.00 0.00 0.00 0.00 36.38 33.34 1ruy s VAL 169 CO -0.05 0.46 0.95 0.21 0.00 0.00 0.00 175.10 176.68 1ruy s ASN 170 N 0.50 6.39 -0.17 3.32 2.47 -0.57 -4.86 114.94 122.02 1ruy s ASN 170 Ca 0.01 -0.20 0.16 0.00 0.42 0.00 0.00 52.86 53.24 1ruy s ASN 170 Cb -0.13 -2.45 0.40 0.00 -1.45 0.00 0.00 41.25 37.62 1ruy s ASN 170 CO 0.02 -1.20 1.28 -0.46 -3.72 0.00 0.00 177.10 173.01 1ruy n ASN 171 N 7.46 2.73 0.00 -4.21 6.94 -1.26 0.73 115.26 127.64 1ruy n ASN 171 Ca 0.03 -3.26 0.12 0.00 -0.02 0.00 0.00 54.58 51.46 1ruy n ASN 171 Cb 0.48 -0.50 0.69 0.00 -2.36 0.00 0.00 39.78 38.09 1ruy n ASN 171 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1ruy n LYS 172 N -1.09 0.61 -1.35 -3.83 4.76 -1.26 -4.86 118.16 111.14 1ruy n LYS 172 Ca 0.20 0.02 -0.12 0.00 -2.87 0.00 0.00 58.31 55.54 1ruy n LYS 172 Cb 0.77 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 32.41 1ruy n LYS 172 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ruy n GLY 173 N 0.64 1.28 3.82 0.72 0.00 -1.26 -4.94 105.19 105.46 1ruy n GLY 173 Ca 0.16 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 1ruy n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ruy s LYS 174 N -2.93 1.62 0.42 1.61 -2.85 -1.26 -4.94 119.74 111.41 1ruy s LYS 174 Ca 0.00 -0.91 -0.25 0.00 -1.00 0.00 0.00 55.97 53.80 1ruy s LYS 174 Cb 0.00 0.54 -0.10 0.00 -2.06 0.00 0.00 37.83 36.21 1ruy s LYS 174 CO 0.00 -0.74 1.27 0.39 0.10 0.00 0.00 175.35 176.37 1ruy n GLU 175 N -0.47 1.94 -4.05 1.78 1.02 -1.26 -4.09 120.64 115.49 1ruy n GLU 175 Ca -0.05 0.69 -0.30 0.00 -0.02 0.00 0.00 57.16 57.48 1ruy n GLU 175 Cb 0.60 -2.39 -0.17 0.00 -0.02 0.00 0.00 31.44 29.46 1ruy n GLU 175 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ruy s VAL 176 N -1.20 1.53 -0.37 2.62 1.01 -0.14 -0.98 120.40 122.86 1ruy s VAL 176 Ca 0.61 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.71 1ruy s VAL 176 Cb -0.51 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1ruy s VAL 176 CO 0.58 0.45 0.95 -0.22 0.00 0.00 0.00 175.10 176.86 1ruy s LEU 177 N 1.46 3.97 -0.15 3.92 2.96 0.21 -0.42 118.68 130.62 1ruy s LEU 177 Ca 0.04 0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1ruy s LEU 177 Cb -0.13 -3.30 -0.02 0.00 0.50 0.00 0.00 46.19 43.24 1ruy s LEU 177 CO -0.10 -0.89 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.27 1ruy s VAL 178 N 3.56 3.47 0.14 1.68 1.01 -0.48 -1.90 120.40 127.88 1ruy s VAL 178 Ca 0.39 -0.51 0.10 0.00 0.00 0.00 0.00 61.98 61.97 1ruy s VAL 178 Cb -0.12 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1ruy s VAL 178 CO 0.19 0.50 -0.23 -0.76 0.00 0.00 0.00 175.10 174.81 1ruy s LEU 179 N 0.41 2.48 0.30 3.92 1.02 -1.26 -1.62 118.68 123.92 1ruy s LEU 179 Ca -0.07 -0.70 -0.20 0.00 0.02 0.00 0.00 54.13 53.18 1ruy s LEU 179 Cb -0.15 -1.33 0.04 0.00 0.02 0.00 0.00 46.19 44.77 1ruy s LEU 179 CO 0.04 0.17 0.79 -1.66 0.02 0.00 0.00 176.35 175.70 1ruy s TRP 180 N -1.20 -0.07 0.17 0.29 -2.14 -0.21 -4.10 118.94 111.68 1ruy s TRP 180 Ca 0.17 -0.44 -0.00 0.00 2.66 0.00 0.00 56.10 58.48 1ruy s TRP 180 Cb -0.10 0.74 -0.04 0.00 -3.10 0.00 0.00 33.47 30.97 1ruy s TRP 180 CO 0.08 -1.29 0.06 0.20 -2.66 0.00 0.00 176.95 173.34 1ruy s GLY 181 N -3.00 1.20 -0.11 3.67 0.00 -0.19 -0.55 107.32 108.34 1ruy s GLY 181 Ca 0.13 -1.58 -0.01 0.00 0.00 0.00 0.00 44.72 43.26 1ruy s GLY 181 CO 0.08 -1.44 -0.06 0.14 0.00 0.00 0.00 173.10 171.83 1ruy s VAL 182 N -3.93 0.90 0.24 1.40 1.01 -0.03 -0.46 120.40 119.53 1ruy s VAL 182 Ca 0.28 -0.26 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 1ruy s VAL 182 Cb 0.07 -0.97 -0.08 0.00 0.00 0.00 0.00 36.38 35.40 1ruy s VAL 182 CO 0.05 0.30 0.66 -2.28 0.00 0.00 0.00 175.10 173.84 1ruy s HIS 183 N 1.76 3.51 -0.37 5.22 2.46 0.36 -1.38 115.29 126.84 1ruy s HIS 183 Ca 0.04 1.18 0.01 0.00 0.47 0.00 0.00 55.06 56.76 1ruy s HIS 183 Cb -0.13 -2.48 0.12 0.00 -0.13 0.00 0.00 32.58 29.96 1ruy s HIS 183 CO -0.08 0.26 0.17 -1.01 -2.47 0.00 0.00 174.74 171.61 1ruy s HIS 184 N -1.72 1.77 0.74 3.88 3.76 0.14 -4.80 115.29 119.07 1ruy s HIS 184 Ca 0.47 -2.06 -0.15 0.00 -0.15 0.00 0.00 55.06 53.16 1ruy s HIS 184 Cb -0.13 -1.74 0.05 0.00 1.11 0.00 0.00 32.58 31.87 1ruy s HIS 184 CO 0.19 -0.83 1.23 -2.14 -0.85 0.00 0.00 174.74 172.34 1ruy s PRO 185 N 0.97 2.02 0.41 8.40 0.02 -1.26 -1.73 135.00 143.83 1ruy s PRO 185 Ca 0.14 1.83 0.23 0.00 0.02 0.00 0.00 61.00 63.22 1ruy s PRO 185 Cb -0.21 -1.81 0.59 0.00 0.02 0.00 0.00 34.50 33.09 1ruy s PRO 185 CO -0.10 -1.95 1.69 -1.00 -0.33 0.00 0.00 177.00 175.31 1ruy h PRO 186 N -0.37 0.00 -4.20 5.54 0.13 -1.83 -3.17 132.00 128.10 1ruy h PRO 186 Ca -0.48 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.49 1ruy h PRO 186 Cb 1.30 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.26 1ruy h PRO 186 CO 0.49 0.20 -0.69 0.95 -0.23 0.00 0.00 178.00 178.72 1ruy s THR 187 N -3.34 0.24 0.43 1.56 -4.23 -1.26 -2.92 115.64 106.12 1ruy s THR 187 Ca 0.03 -1.44 0.31 0.00 -1.18 0.00 0.00 61.69 59.41 1ruy s THR 187 Cb 0.08 -1.01 0.34 0.00 1.34 0.00 0.00 72.50 73.24 1ruy s THR 187 CO 0.66 -0.76 2.12 0.77 -0.54 0.00 0.00 174.62 176.87 1ruy h SER 188 N 3.77 0.00 0.02 3.99 4.64 -1.94 -0.06 113.55 123.96 1ruy h SER 188 Ca -0.34 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1ruy h SER 188 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1ruy h SER 188 CO 0.55 0.08 -0.01 0.74 -0.87 0.00 0.00 176.83 177.32 1ruy h THR 189 N 0.00 1.22 -0.43 2.95 2.02 -1.99 -1.96 112.91 114.72 1ruy h THR 189 Ca -0.00 -0.73 -0.04 0.00 0.77 0.00 0.00 66.41 66.41 1ruy h THR 189 Cb 0.28 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 1ruy h THR 189 CO 0.01 0.19 0.10 0.44 0.37 0.00 0.00 175.52 176.63 1ruy h ASP 190 N -0.34 0.59 -0.76 4.18 3.32 -1.75 -0.67 116.42 121.00 1ruy h ASP 190 Ca -0.00 -0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.03 1ruy h ASP 190 Cb 0.32 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.67 1ruy h ASP 190 CO 0.00 0.60 0.50 -0.61 -1.72 0.00 0.00 179.24 178.01 1ruy h GLN 191 N 0.63 0.74 0.10 3.56 5.75 -0.79 -0.39 115.11 124.71 1ruy h GLN 191 Ca 0.14 -0.04 -0.27 0.00 -0.15 0.00 0.00 58.65 58.33 1ruy h GLN 191 Cb 0.24 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1ruy h GLN 191 CO -0.00 0.49 -1.30 0.37 -2.65 0.00 0.00 178.83 175.74 1ruy h GLN 192 N 0.76 0.22 -0.51 1.69 4.15 -0.45 -1.10 115.11 119.87 1ruy h GLN 192 Ca 0.34 -0.37 -0.10 0.00 0.77 0.00 0.00 58.65 59.28 1ruy h GLN 192 Cb 0.33 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 1ruy h GLN 192 CO -0.12 1.14 -0.08 -0.91 -1.93 0.00 0.00 178.83 176.92 1ruy h ASN 193 N 0.06 0.90 0.10 -0.69 2.35 -0.49 -0.29 115.58 117.52 1ruy h ASN 193 Ca -0.15 -0.27 -0.18 0.00 -0.55 0.00 0.00 56.30 55.15 1ruy h ASN 193 Cb 1.96 -0.24 0.01 0.00 0.05 0.00 0.00 38.32 40.09 1ruy h ASN 193 CO 0.18 1.01 -0.85 -0.07 -1.65 0.00 0.00 177.43 176.05 1ruy h LEU 194 N 0.83 0.33 -2.01 1.61 3.38 -1.17 -3.43 115.31 114.85 1ruy h LEU 194 Ca 0.14 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1ruy h LEU 194 Cb 0.60 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1ruy h LEU 194 CO 0.04 1.39 0.00 -1.22 0.09 0.00 0.00 178.44 178.73 1ruy n TYR 195 N -4.18 0.00 0.00 1.13 4.02 -0.42 -0.32 117.16 117.38 1ruy n TYR 195 Ca -0.17 -0.27 0.00 0.00 -0.01 0.00 0.00 57.90 57.45 1ruy n TYR 195 Cb 0.77 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 40.06 1ruy n TYR 195 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1ruy n GLN 196 N -0.27 0.00 -1.87 -0.72 1.13 -0.12 -4.51 117.38 111.02 1ruy n GLN 196 Ca 0.00 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.64 1ruy n GLN 196 Cb 0.26 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.59 1ruy n GLN 196 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1ruy s ASN 197 N 0.00 6.53 0.16 1.08 -0.87 -1.26 -4.63 114.94 115.95 1ruy s ASN 197 Ca 0.00 2.36 -0.11 0.00 -1.57 0.00 0.00 52.86 53.54 1ruy s ASN 197 Cb 0.00 -2.53 0.03 0.00 -0.02 0.00 0.00 41.25 38.72 1ruy s ASN 197 CO 0.00 -1.03 1.59 0.00 -2.57 0.00 0.00 177.10 175.09 1ruy h ALA 198 N 10.20 0.71 -2.55 0.60 0.00 -1.89 -3.34 119.26 122.99 1ruy h ALA 198 Ca -0.43 -0.33 -0.67 0.00 0.00 0.00 0.00 54.91 53.48 1ruy h ALA 198 Cb 1.20 -0.19 -0.38 0.00 0.00 0.00 0.00 17.79 18.42 1ruy h ALA 198 CO 0.95 0.59 -0.24 -0.25 0.00 0.00 0.00 179.25 180.30 1ruy n ASP 199 N -4.22 4.11 -4.63 0.00 8.00 -1.26 -5.04 116.55 113.52 1ruy n ASP 199 Ca 0.01 -3.29 -0.25 0.00 0.71 0.00 0.00 54.79 51.96 1ruy n ASP 199 Cb 0.38 -0.89 0.11 0.00 -0.02 0.00 0.00 41.12 40.70 1ruy n ASP 199 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ruy s ALA 200 N -1.96 3.23 0.03 2.24 0.00 -1.25 -5.06 121.76 118.98 1ruy s ALA 200 Ca 0.32 -1.38 -0.27 0.00 0.00 0.00 0.00 51.96 50.62 1ruy s ALA 200 Cb 0.03 -2.34 0.08 0.00 0.00 0.00 0.00 23.12 20.88 1ruy s ALA 200 CO -0.07 -1.60 0.70 1.52 0.00 0.00 0.00 175.76 176.31 1ruy s TYR 201 N -3.32 -0.55 -0.04 0.00 -0.85 -1.26 -4.32 117.35 107.01 1ruy s TYR 201 Ca 0.66 0.65 0.06 0.00 -0.52 0.00 0.00 57.07 57.92 1ruy s TYR 201 Cb -0.07 0.49 -0.01 0.00 0.38 0.00 0.00 41.96 42.75 1ruy s TYR 201 CO 0.46 -0.67 -0.22 0.08 -1.52 0.00 0.00 175.55 173.68 1ruy s VAL 202 N -2.45 1.77 -0.05 -3.49 1.01 -0.36 -1.83 120.40 115.01 1ruy s VAL 202 Ca -0.03 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1ruy s VAL 202 Cb -0.01 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.89 1ruy s VAL 202 CO -0.02 0.50 -0.10 -0.55 0.00 0.00 0.00 175.10 174.92 1ruy s SER 203 N -0.24 1.54 -0.04 3.32 0.15 0.27 -0.31 113.70 118.39 1ruy s SER 203 Ca 0.01 -0.25 0.03 0.00 0.70 0.00 0.00 55.95 56.44 1ruy s SER 203 Cb -0.11 -0.67 0.00 0.00 -1.71 0.00 0.00 66.02 63.54 1ruy s SER 203 CO 0.02 0.03 -0.11 -0.69 1.20 0.00 0.00 173.24 173.68 1ruy s VAL 204 N 0.61 1.00 -0.00 4.45 1.01 -0.75 -0.53 120.40 126.19 1ruy s VAL 204 Ca -0.12 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.17 1ruy s VAL 204 Cb -0.14 -0.89 0.05 0.00 0.00 0.00 0.00 36.38 35.40 1ruy s VAL 204 CO 0.03 0.31 0.52 -0.83 0.00 0.00 0.00 175.10 175.12 1ruy s GLY 205 N 0.29 -0.40 0.00 4.51 0.00 -0.66 -1.67 107.32 109.39 1ruy s GLY 205 Ca -0.06 0.76 0.00 0.00 0.00 0.00 0.00 44.72 45.42 1ruy s GLY 205 CO 0.01 0.46 0.00 -1.14 0.00 0.00 0.00 173.10 172.44 1ruy n SER 206 N 0.80 0.00 0.22 1.64 3.41 0.58 -0.23 113.62 120.04 1ruy n SER 206 Ca -0.19 -0.47 0.09 0.00 -0.26 0.00 0.00 58.87 58.03 1ruy n SER 206 Cb 0.58 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 65.04 1ruy n SER 206 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ruy h SER 207 N 0.00 0.00 0.00 4.04 0.02 -1.98 -3.33 113.55 112.30 1ruy h SER 207 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ruy h SER 207 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ruy h SER 207 CO 0.00 0.25 -0.62 0.29 -1.14 0.00 0.00 176.83 175.61 1ruy n LYS 208 N -3.65 2.17 -4.01 3.45 5.02 -1.26 -5.03 118.16 114.85 1ruy n LYS 208 Ca -0.01 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.92 1ruy n LYS 208 Cb 0.37 -0.79 -0.07 0.00 -0.02 0.00 0.00 35.03 34.52 1ruy n LYS 208 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1ruy s TYR 209 N -1.41 3.48 -0.28 2.13 5.04 -1.25 -5.07 117.35 119.97 1ruy s TYR 209 Ca 0.00 0.42 -0.02 0.00 -2.44 0.00 0.00 57.07 55.03 1ruy s TYR 209 Cb 0.00 -1.89 0.17 0.00 0.35 0.00 0.00 41.96 40.59 1ruy s TYR 209 CO 0.00 0.66 0.54 1.21 -1.34 0.00 0.00 175.55 176.62 1ruy s ASN 210 N -1.10 -0.91 -0.09 4.32 2.47 -1.26 -0.31 114.94 118.05 1ruy s ASN 210 Ca 0.16 0.76 -0.17 0.00 0.42 0.00 0.00 52.86 54.03 1ruy s ASN 210 Cb -0.12 1.88 0.04 0.00 -1.45 0.00 0.00 41.25 41.60 1ruy s ASN 210 CO 0.05 -0.27 0.41 -0.60 -3.72 0.00 0.00 177.10 172.98 1ruy s ARG 211 N 2.77 0.63 -0.02 0.43 3.52 -0.67 -5.04 118.95 120.57 1ruy s ARG 211 Ca 0.16 0.26 0.08 0.00 -0.13 0.00 0.00 55.73 56.10 1ruy s ARG 211 Cb -0.15 0.29 -0.02 0.00 -1.56 0.00 0.00 34.95 33.52 1ruy s ARG 211 CO -0.19 -0.14 -0.25 0.50 -0.81 0.00 0.00 175.30 174.41 1ruy s ARG 212 N -0.52 2.17 0.01 5.12 3.52 -1.26 -1.80 118.95 126.19 1ruy s ARG 212 Ca -0.06 -0.91 0.07 0.00 -0.13 0.00 0.00 55.73 54.69 1ruy s ARG 212 Cb -0.03 -2.07 -0.02 0.00 -1.56 0.00 0.00 34.95 31.27 1ruy s ARG 212 CO 0.03 0.55 -0.21 -0.06 -0.81 0.00 0.00 175.30 174.80 1ruy s PHE 213 N -0.58 1.86 -0.05 5.12 0.40 0.58 -4.98 117.98 120.32 1ruy s PHE 213 Ca 0.09 -0.36 0.05 0.00 -0.60 0.00 0.00 56.93 56.11 1ruy s PHE 213 Cb -0.10 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.27 1ruy s PHE 213 CO -0.01 0.03 -0.22 0.99 0.70 0.00 0.00 175.22 176.72 1ruy s THR 214 N -0.64 1.81 0.37 0.64 2.01 -1.26 -1.22 115.64 117.35 1ruy s THR 214 Ca 0.08 -0.93 -0.28 0.00 0.31 0.00 0.00 61.69 60.87 1ruy s THR 214 Cb -0.08 -1.54 -0.11 0.00 0.01 0.00 0.00 72.50 70.77 1ruy s THR 214 CO 0.00 0.51 1.49 -2.65 -0.69 0.00 0.00 174.62 173.28 1ruy n PRO 215 N 3.05 2.67 -3.91 4.92 -0.02 -1.26 -4.94 135.00 135.51 1ruy n PRO 215 Ca -0.18 0.94 -0.31 0.00 -2.02 0.00 0.00 63.50 61.93 1ruy n PRO 215 Cb 0.52 -2.67 -0.13 0.00 -0.02 0.00 0.00 33.50 31.20 1ruy n PRO 215 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ruy s GLU 216 N -2.03 2.04 -0.06 -0.52 2.02 -1.26 -5.07 118.70 113.82 1ruy s GLU 216 Ca 0.54 -2.55 -0.30 0.00 0.02 0.00 0.00 54.97 52.68 1ruy s GLU 216 Cb -0.48 -3.38 -0.03 0.00 0.10 0.00 0.00 34.13 30.34 1ruy s GLU 216 CO 0.63 -1.11 1.10 0.42 0.02 0.00 0.00 175.26 176.32 1ruy s ILE 217 N -0.16 4.52 0.00 -1.63 1.09 -1.26 -4.72 121.20 119.04 1ruy s ILE 217 Ca 0.16 1.81 0.00 0.00 -1.10 0.00 0.00 60.65 61.53 1ruy s ILE 217 Cb -0.24 -4.16 0.00 0.00 -1.06 0.00 0.00 42.46 36.99 1ruy s ILE 217 CO -0.01 0.02 0.00 0.00 -0.10 0.00 0.00 174.94 174.85 1ruy n ALA 218 N 4.91 0.00 -2.69 9.38 0.00 -1.15 -4.93 120.51 126.02 1ruy n ALA 218 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.13 1ruy n ALA 218 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 1ruy n ALA 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ruy s ALA 219 N -1.74 3.42 0.24 0.00 0.00 -1.16 -4.22 121.76 118.30 1ruy s ALA 219 Ca 0.00 0.05 0.11 0.00 0.00 0.00 0.00 51.96 52.12 1ruy s ALA 219 Cb 0.00 -3.07 -0.05 0.00 0.00 0.00 0.00 23.12 20.01 1ruy s ALA 219 CO 0.00 -0.37 -0.15 1.03 0.00 0.00 0.00 175.76 176.27 1ruy s ARG 220 N 1.44 1.84 0.08 0.00 0.52 -0.08 -5.06 118.95 117.69 1ruy s ARG 220 Ca 0.37 -1.56 -0.37 0.00 -0.52 0.00 0.00 55.73 53.66 1ruy s ARG 220 Cb -0.17 -1.93 -0.18 0.00 0.52 0.00 0.00 34.95 33.19 1ruy s ARG 220 CO 0.15 0.37 1.20 -2.30 0.02 0.00 0.00 175.30 174.74 1ruy n PRO 221 N -0.36 0.76 -2.01 3.54 -0.02 -1.26 -4.44 135.00 131.21 1ruy n PRO 221 Ca -0.08 0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 61.27 1ruy n PRO 221 Cb 0.58 -1.83 -0.02 0.00 -0.02 0.00 0.00 33.50 32.22 1ruy n PRO 221 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ruy s LYS 222 N 0.14 4.27 -0.06 -0.52 1.02 -1.26 -4.76 119.74 118.57 1ruy s LYS 222 Ca 0.84 2.33 -0.01 0.00 0.02 0.00 0.00 55.97 59.15 1ruy s LYS 222 Cb -1.03 -3.04 0.03 0.00 -0.52 0.00 0.00 37.83 33.26 1ruy s LYS 222 CO 0.51 -0.32 0.01 0.08 -0.92 0.00 0.00 175.35 174.71 1ruy s VAL 223 N -1.00 0.28 -1.49 3.17 1.01 -0.81 -4.75 120.40 116.81 1ruy s VAL 223 Ca 0.51 0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.54 1ruy s VAL 223 Cb -0.42 -0.44 0.07 0.00 0.00 0.00 0.00 36.38 35.59 1ruy s VAL 223 CO 0.55 0.23 0.99 0.54 0.00 0.00 0.00 175.10 177.41 1ruy n ARG 224 N 5.01 -5.86 -0.52 2.72 1.74 -1.26 -1.05 116.66 117.44 1ruy n ARG 224 Ca -0.09 0.64 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 1ruy n ARG 224 Cb 0.50 -5.53 0.00 0.00 -1.02 0.00 0.00 32.46 26.41 1ruy n ARG 224 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ruy n GLY 225 N -1.73 1.32 3.71 -0.13 0.00 -1.26 -4.48 105.19 102.62 1ruy n GLY 225 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1ruy n GLY 225 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ruy s GLN 226 N -0.16 4.15 0.03 1.61 -1.52 -0.22 -4.93 119.66 118.63 1ruy s GLN 226 Ca 0.00 -0.22 0.23 0.00 -1.95 0.00 0.00 55.36 53.41 1ruy s GLN 226 Cb 0.00 -3.46 0.05 0.00 -0.22 0.00 0.00 33.01 29.38 1ruy s GLN 226 CO 0.00 0.21 1.04 0.00 -0.25 0.00 0.00 175.29 176.30 1ruy n ALA 227 N 3.79 3.68 -2.00 6.09 0.00 -1.26 -1.93 120.51 128.88 1ruy n ALA 227 Ca -0.15 -0.44 -0.24 0.00 0.00 0.00 0.00 53.44 52.61 1ruy n ALA 227 Cb 0.52 -0.95 0.12 0.00 0.00 0.00 0.00 19.45 19.15 1ruy n ALA 227 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ruy s GLY 228 N -3.45 1.75 0.07 0.00 0.00 -1.26 -0.90 107.32 103.52 1ruy s GLY 228 Ca 0.05 -1.87 0.01 0.00 0.00 0.00 0.00 44.72 42.91 1ruy s GLY 228 CO 0.80 -1.24 -0.05 0.50 0.00 0.00 0.00 173.10 173.12 1ruy s ARG 229 N -5.21 0.70 -0.13 2.90 1.81 -0.71 -4.84 118.95 113.47 1ruy s ARG 229 Ca 0.68 -1.22 -0.03 0.00 -1.72 0.00 0.00 55.73 53.45 1ruy s ARG 229 Cb -0.04 -0.02 0.05 0.00 -0.45 0.00 0.00 34.95 34.49 1ruy s ARG 229 CO 0.45 -0.05 0.04 1.41 -0.68 0.00 0.00 175.30 176.47 1ruy s MET 230 N -3.63 0.39 0.03 3.54 1.75 -0.04 0.27 119.30 121.61 1ruy s MET 230 Ca 0.07 -0.06 -0.15 0.00 -1.25 0.00 0.00 55.69 54.30 1ruy s MET 230 Cb 0.05 -1.46 -0.06 0.00 2.84 0.00 0.00 34.83 36.20 1ruy s MET 230 CO -0.07 -0.50 0.44 -0.80 -0.65 0.00 0.00 175.02 173.45 1ruy s ASN 231 N 2.01 6.84 -0.10 1.11 0.01 -0.48 -3.60 114.94 120.74 1ruy s ASN 231 Ca 0.02 1.01 -0.01 0.00 -0.71 0.00 0.00 52.86 53.18 1ruy s ASN 231 Cb -0.15 -2.27 -0.03 0.00 0.41 0.00 0.00 41.25 39.22 1ruy s ASN 231 CO -0.07 0.29 -0.04 -0.31 -1.51 0.00 0.00 177.10 175.46 1ruy s TYR 232 N -1.13 3.02 0.18 2.20 1.51 0.27 -0.85 117.35 122.55 1ruy s TYR 232 Ca 0.26 -0.02 0.04 0.00 -1.01 0.00 0.00 57.07 56.34 1ruy s TYR 232 Cb -0.17 -1.80 -0.05 0.00 -0.11 0.00 0.00 41.96 39.84 1ruy s TYR 232 CO 0.15 0.27 -0.05 0.71 -1.11 0.00 0.00 175.55 175.52 1ruy s TYR 233 N -0.52 1.37 0.21 2.71 1.51 0.29 -1.38 117.35 121.54 1ruy s TYR 233 Ca 0.08 -0.85 -0.17 0.00 -1.01 0.00 0.00 57.07 55.12 1ruy s TYR 233 Cb -0.12 -0.75 0.02 0.00 -0.11 0.00 0.00 41.96 41.01 1ruy s TYR 233 CO 0.02 0.00 0.52 1.67 -1.11 0.00 0.00 175.55 176.65 1ruy s TRP 234 N -3.40 -0.03 0.02 2.71 1.48 -1.26 -1.04 118.94 117.41 1ruy s TRP 234 Ca 0.22 -0.32 -0.28 0.00 -1.06 0.00 0.00 56.10 54.66 1ruy s TRP 234 Cb 0.04 0.36 0.09 0.00 -1.16 0.00 0.00 33.47 32.80 1ruy s TRP 234 CO 0.04 -0.94 0.75 -0.08 -4.06 0.00 0.00 176.95 172.66 1ruy s THR 235 N -3.90 0.00 -0.43 0.66 -1.32 -0.64 -5.00 115.64 105.00 1ruy s THR 235 Ca 0.11 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.50 1ruy s THR 235 Cb -0.01 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.07 1ruy s THR 235 CO -0.00 0.00 0.29 -0.76 -2.21 0.00 0.00 174.62 171.93 1ruy s LEU 236 N -2.04 5.30 -0.05 9.08 1.43 -1.26 -1.38 118.68 129.75 1ruy s LEU 236 Ca -0.01 -1.57 -0.30 0.00 -1.03 0.00 0.00 54.13 51.22 1ruy s LEU 236 Cb -0.01 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1ruy s LEU 236 CO -0.04 -0.58 1.18 -0.22 0.23 0.00 0.00 176.35 176.92 1ruy s LEU 237 N 1.43 4.28 0.63 1.79 2.96 0.43 -4.81 118.68 125.39 1ruy s LEU 237 Ca 0.04 1.80 -0.13 0.00 -0.22 0.00 0.00 54.13 55.61 1ruy s LEU 237 Cb -0.24 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 42.87 1ruy s LEU 237 CO 0.02 -0.56 1.05 -1.61 -1.32 0.00 0.00 176.35 173.93 1ruy s GLU 238 N 2.10 3.27 0.19 1.98 2.02 -1.26 -0.97 118.70 126.02 1ruy s GLU 238 Ca 0.55 1.03 -0.33 0.00 0.02 0.00 0.00 54.97 56.24 1ruy s GLU 238 Cb -0.24 -2.03 -0.14 0.00 0.10 0.00 0.00 34.13 31.81 1ruy s GLU 238 CO 0.22 -0.84 1.43 -2.30 0.02 0.00 0.00 175.26 173.80 1ruy n PRO 239 N -2.49 1.88 0.00 0.39 -0.02 -1.26 -1.09 135.00 132.42 1ruy n PRO 239 Ca 0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1ruy n PRO 239 Cb 0.53 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1ruy n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ruy n GLY 240 N 2.62 2.92 3.89 -1.23 0.00 0.22 -5.01 105.19 108.61 1ruy n GLY 240 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1ruy n GLY 240 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ruy s ASP 241 N -2.11 4.76 -0.02 1.61 3.68 -0.25 -4.61 116.67 119.72 1ruy s ASP 241 Ca 0.00 0.88 0.06 0.00 2.13 0.00 0.00 52.55 55.62 1ruy s ASP 241 Cb 0.00 -1.46 -0.01 0.00 -1.45 0.00 0.00 42.92 40.00 1ruy s ASP 241 CO 0.00 -1.76 -0.20 -0.89 0.13 0.00 0.00 175.17 172.46 1ruy s THR 242 N -3.52 1.56 -0.09 1.71 2.01 -1.26 -1.51 115.64 114.54 1ruy s THR 242 Ca 0.61 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.80 1ruy s THR 242 Cb -0.11 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 1ruy s THR 242 CO 0.50 0.44 -0.17 -0.51 -0.69 0.00 0.00 174.62 174.19 1ruy s ILE 243 N -0.40 2.70 -0.09 1.82 2.07 -0.52 -4.04 121.20 122.74 1ruy s ILE 243 Ca 0.06 -0.81 0.04 0.00 -1.41 0.00 0.00 60.65 58.53 1ruy s ILE 243 Cb -0.08 -2.07 0.00 0.00 0.13 0.00 0.00 42.46 40.43 1ruy s ILE 243 CO -0.00 0.55 -0.22 -0.89 -1.91 0.00 0.00 174.94 172.47 1ruy s THR 244 N 0.02 1.89 -0.15 4.00 2.01 0.68 -0.84 115.64 123.25 1ruy s THR 244 Ca -0.06 -0.93 -0.02 0.00 0.31 0.00 0.00 61.69 60.99 1ruy s THR 244 Cb -0.15 -1.64 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 1ruy s THR 244 CO 0.05 0.52 -0.07 -0.36 -0.69 0.00 0.00 174.62 174.07 1ruy s PHE 245 N 0.31 2.94 -0.05 4.92 0.40 0.16 -1.65 117.98 125.02 1ruy s PHE 245 Ca -0.16 -0.47 0.02 0.00 -0.60 0.00 0.00 56.93 55.72 1ruy s PHE 245 Cb -0.17 -1.93 0.01 0.00 0.51 0.00 0.00 43.02 41.45 1ruy s PHE 245 CO 0.07 -0.14 -0.08 -2.00 0.70 0.00 0.00 175.22 173.77 1ruy s GLU 246 N 0.44 1.16 -0.03 0.44 2.12 0.31 -0.47 118.70 122.67 1ruy s GLU 246 Ca -0.06 -0.26 -0.27 0.00 0.36 0.00 0.00 54.97 54.74 1ruy s GLU 246 Cb -0.15 -1.05 0.06 0.00 0.26 0.00 0.00 34.13 33.25 1ruy s GLU 246 CO 0.04 0.01 0.58 0.00 -0.54 0.00 0.00 175.26 175.35 1ruy s ALA 247 N 0.63 -1.51 -0.20 6.30 0.00 -0.76 0.94 121.76 127.17 1ruy s ALA 247 Ca -0.11 1.03 0.12 0.00 0.00 0.00 0.00 51.96 53.00 1ruy s ALA 247 Cb -0.13 0.05 0.40 0.00 0.00 0.00 0.00 23.12 23.44 1ruy s ALA 247 CO 0.02 -0.36 1.22 0.25 0.00 0.00 0.00 175.76 176.88 1ruy n THR 248 N 0.95 2.17 0.00 0.00 -2.24 -0.76 -0.62 114.28 113.77 1ruy n THR 248 Ca -0.20 -3.07 0.00 0.00 -2.27 0.00 0.00 64.05 58.52 1ruy n THR 248 Cb 0.57 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1ruy n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ruy n GLY 249 N -1.17 3.34 3.67 3.38 0.00 -1.26 -4.57 105.19 108.58 1ruy n GLY 249 Ca 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.49 1ruy n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ruy n ASN 250 N 0.00 -1.07 -4.69 1.61 3.02 -1.26 -4.48 115.26 108.39 1ruy n ASN 250 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 1ruy n ASN 250 Cb 0.00 -2.33 -0.05 0.00 -0.61 0.00 0.00 39.78 36.80 1ruy n ASN 250 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ruy s LEU 251 N 0.00 4.23 -0.69 3.41 2.96 -1.26 -0.49 118.68 126.83 1ruy s LEU 251 Ca 0.00 1.10 -0.15 0.00 -0.22 0.00 0.00 54.13 54.86 1ruy s LEU 251 Cb 0.00 -3.09 0.17 0.00 0.50 0.00 0.00 46.19 43.77 1ruy s LEU 251 CO 0.00 -0.26 0.66 -0.69 -1.32 0.00 0.00 176.35 174.75 1ruy s VAL 252 N 1.55 5.37 0.64 1.68 1.01 0.39 -3.73 120.40 127.31 1ruy s VAL 252 Ca 0.36 -1.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.21 1ruy s VAL 252 Cb -0.17 -4.42 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 1ruy s VAL 252 CO 0.14 -0.98 1.22 0.00 0.00 0.00 0.00 175.10 175.48 1ruy s ALA 253 N 0.99 2.40 0.45 5.51 0.00 -0.59 -1.02 121.76 129.50 1ruy s ALA 253 Ca 0.12 1.00 -0.23 0.00 0.00 0.00 0.00 51.96 52.84 1ruy s ALA 253 Cb -0.19 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.38 1ruy s ALA 253 CO -0.03 -1.43 1.17 -2.14 0.00 0.00 0.00 175.76 173.33 1ruy s PRO 254 N -3.52 3.81 0.02 0.00 0.02 -1.26 -0.52 135.00 133.56 1ruy s PRO 254 Ca 0.77 1.79 -0.01 0.00 0.02 0.00 0.00 61.00 63.58 1ruy s PRO 254 Cb -0.31 -2.46 -0.00 0.00 0.02 0.00 0.00 34.50 31.74 1ruy s PRO 254 CO 0.38 -0.51 -0.02 -2.13 -0.33 0.00 0.00 177.00 174.39 1ruy n ARG 255 N -0.38 0.03 -4.58 5.54 0.63 -0.35 -4.45 116.66 113.10 1ruy n ARG 255 Ca 0.07 0.01 -0.31 0.00 -0.92 0.00 0.00 57.85 56.70 1ruy n ARG 255 Cb 0.48 -0.55 -0.12 0.00 0.45 0.00 0.00 32.46 32.72 1ruy n ARG 255 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1ruy s TYR 256 N -2.03 2.57 0.32 -0.14 1.51 -0.76 -2.02 117.35 116.80 1ruy s TYR 256 Ca -0.02 -0.25 0.03 0.00 -1.01 0.00 0.00 57.07 55.83 1ruy s TYR 256 Cb 0.01 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.37 1ruy s TYR 256 CO 0.02 0.28 0.14 0.00 -1.11 0.00 0.00 175.55 174.88 1ruy s ALA 257 N -0.97 2.14 -0.07 3.71 0.00 -0.18 -4.71 121.76 121.68 1ruy s ALA 257 Ca 0.15 -1.71 0.02 0.00 0.00 0.00 0.00 51.96 50.42 1ruy s ALA 257 Cb -0.11 1.02 0.02 0.00 0.00 0.00 0.00 23.12 24.05 1ruy s ALA 257 CO 0.06 -0.45 -0.11 -0.06 0.00 0.00 0.00 175.76 175.21 1ruy s PHE 258 N -3.52 1.39 -0.37 0.00 0.40 -0.80 -1.77 117.98 113.32 1ruy s PHE 258 Ca 0.34 -0.55 -0.21 0.00 -0.60 0.00 0.00 56.93 55.91 1ruy s PHE 258 Cb 0.05 -1.06 0.01 0.00 0.51 0.00 0.00 43.02 42.53 1ruy s PHE 258 CO 0.16 -0.32 0.66 0.00 0.70 0.00 0.00 175.22 176.43 1ruy s ALA 259 N 0.89 3.43 0.25 5.36 0.00 -0.82 0.65 121.76 131.51 1ruy s ALA 259 Ca -0.10 -0.88 -0.18 0.00 0.00 0.00 0.00 51.96 50.79 1ruy s ALA 259 Cb -0.15 -3.23 -0.08 0.00 0.00 0.00 0.00 23.12 19.65 1ruy s ALA 259 CO 0.01 -1.45 0.73 -0.51 0.00 0.00 0.00 175.76 174.54 1ruy s LEU 260 N 2.81 4.27 -0.24 0.00 1.43 -0.15 -0.75 118.68 126.04 1ruy s LEU 260 Ca 0.25 1.39 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 1ruy s LEU 260 Cb -0.14 -3.73 0.05 0.00 0.03 0.00 0.00 46.19 42.40 1ruy s LEU 260 CO 0.16 -0.03 -0.13 0.20 0.23 0.00 0.00 176.35 176.78 1ruy s ASN 261 N -1.82 4.10 0.51 2.29 0.01 0.82 -4.39 114.94 116.46 1ruy s ASN 261 Ca 0.46 -1.14 -0.19 0.00 -0.71 0.00 0.00 52.86 51.28 1ruy s ASN 261 Cb -0.15 -1.55 -0.07 0.00 0.41 0.00 0.00 41.25 39.89 1ruy s ASN 261 CO 0.20 -0.14 1.03 -0.13 -1.51 0.00 0.00 177.10 176.55 1ruy s ARG 262 N 1.18 3.75 -0.40 -0.60 1.81 -1.26 -1.23 118.95 122.19 1ruy s ARG 262 Ca -0.04 1.24 0.02 0.00 -1.72 0.00 0.00 55.73 55.24 1ruy s ARG 262 Cb -0.18 -2.09 0.27 0.00 -0.45 0.00 0.00 34.95 32.50 1ruy s ARG 262 CO -0.07 -0.46 1.11 0.41 -0.68 0.00 0.00 175.30 175.61 1ruy n GLY 263 N -0.64 -0.82 0.79 -3.53 0.00 -0.59 -4.68 105.19 95.72 1ruy n GLY 263 Ca 0.09 0.56 -0.09 0.00 0.00 0.00 0.00 46.02 46.58 1ruy n GLY 263 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ruy n SER 264 N 1.35 -1.56 -0.95 1.61 3.41 -1.26 -4.53 113.62 111.69 1ruy n SER 264 Ca 0.04 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1ruy n SER 264 Cb 0.68 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1ruy n SER 264 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ruy n GLY 265 N 0.90 0.51 3.75 5.00 0.00 -1.26 -5.07 105.19 109.02 1ruy n GLY 265 Ca -0.00 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1ruy n GLY 265 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ruy s SER 266 N -2.80 0.20 0.00 1.61 0.15 -1.26 -4.77 113.70 106.83 1ruy s SER 266 Ca 0.00 -1.23 0.00 0.00 0.70 0.00 0.00 55.95 55.42 1ruy s SER 266 Cb 0.00 0.82 0.00 0.00 -1.71 0.00 0.00 66.02 65.13 1ruy s SER 266 CO 0.00 -1.63 0.00 0.61 1.20 0.00 0.00 173.24 173.42 1ruy n GLY 267 N -0.54 -1.22 3.42 9.45 0.00 -1.22 -4.69 105.19 110.39 1ruy n GLY 267 Ca -0.07 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 1ruy n GLY 267 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ruy s ILE 268 N -3.00 2.78 0.08 -0.61 1.01 -1.26 -1.32 121.20 118.88 1ruy s ILE 268 Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1ruy s ILE 268 Cb 0.00 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 1ruy s ILE 268 CO 0.00 0.58 -0.08 0.27 0.00 0.00 0.00 174.94 175.72 1ruy s ILE 269 N -0.62 0.72 -0.21 2.92 -4.36 -0.41 -4.97 121.20 114.28 1ruy s ILE 269 Ca 0.09 -1.65 -0.05 0.00 -0.26 0.00 0.00 60.65 58.78 1ruy s ILE 269 Cb -0.11 -1.34 -0.02 0.00 1.25 0.00 0.00 42.46 42.24 1ruy s ILE 269 CO 0.01 -0.67 0.00 -0.63 0.24 0.00 0.00 174.94 173.89 1ruy s ILE 270 N -2.76 3.92 -0.03 8.37 1.09 -1.26 -0.90 121.20 129.63 1ruy s ILE 270 Ca 0.05 -0.32 -0.26 0.00 -1.10 0.00 0.00 60.65 59.02 1ruy s ILE 270 Cb -0.01 -2.78 0.06 0.00 -1.06 0.00 0.00 42.46 38.67 1ruy s ILE 270 CO -0.02 0.41 0.57 -0.55 -0.10 0.00 0.00 174.94 175.25 1ruy s SER 271 N 1.15 -0.51 0.00 3.58 0.15 0.31 -4.83 113.70 113.54 1ruy s SER 271 Ca 0.03 0.49 0.13 0.00 0.70 0.00 0.00 55.95 57.30 1ruy s SER 271 Cb -0.14 0.48 0.19 0.00 -1.71 0.00 0.00 66.02 64.83 1ruy s SER 271 CO 0.01 -0.58 1.04 0.59 1.20 0.00 0.00 173.24 175.50 1ruy n ASN 272 N 0.94 2.40 -4.77 5.45 3.02 -1.26 -4.32 115.26 116.73 1ruy n ASN 272 Ca -0.20 -1.69 -0.38 0.00 -0.03 0.00 0.00 54.58 52.28 1ruy n ASN 272 Cb 0.57 -0.09 -0.00 0.00 -0.61 0.00 0.00 39.78 39.65 1ruy n ASN 272 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ruy s ALA 273 N -1.04 3.09 0.26 5.41 0.00 -1.26 -4.97 121.76 123.25 1ruy s ALA 273 Ca 0.19 1.09 -0.29 0.00 0.00 0.00 0.00 51.96 52.95 1ruy s ALA 273 Cb 0.12 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.70 1ruy s ALA 273 CO 0.17 -0.77 0.96 -1.25 0.00 0.00 0.00 175.76 174.86 1ruy s PRO 274 N -2.47 4.80 0.63 0.00 0.04 -1.26 -4.68 135.00 132.06 1ruy s PRO 274 Ca 0.61 1.50 -0.16 0.00 0.04 0.00 0.00 61.00 62.98 1ruy s PRO 274 Cb -0.34 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 1ruy s PRO 274 CO 0.42 0.45 1.12 0.08 0.04 0.00 0.00 177.00 179.11 1ruy s VAL 275 N -1.24 3.21 -0.04 -0.36 1.01 -1.26 -0.89 120.40 120.82 1ruy s VAL 275 Ca 0.43 0.61 -0.25 0.00 0.00 0.00 0.00 61.98 62.76 1ruy s VAL 275 Cb -0.25 -3.14 0.05 0.00 0.00 0.00 0.00 36.38 33.03 1ruy s VAL 275 CO 0.32 -0.30 0.55 -2.28 0.00 0.00 0.00 175.10 173.38 1ruy s HIS 276 N -2.19 -0.49 -0.88 5.22 2.46 -0.53 -4.79 115.29 114.09 1ruy s HIS 276 Ca 0.69 0.84 -0.25 0.00 0.47 0.00 0.00 55.06 56.81 1ruy s HIS 276 Cb -0.22 0.30 -0.04 0.00 -0.13 0.00 0.00 32.58 32.49 1ruy s HIS 276 CO 0.38 -0.52 1.93 0.34 -2.47 0.00 0.00 174.74 174.40 1ruy s ASP 277 N -1.19 5.17 0.11 9.88 2.15 -1.26 -4.59 116.67 126.94 1ruy s ASP 277 Ca -0.12 -0.59 -0.25 0.00 0.43 0.00 0.00 52.55 52.03 1ruy s ASP 277 Cb -0.02 -2.56 0.08 0.00 -0.30 0.00 0.00 42.92 40.12 1ruy s ASP 277 CO 0.08 -2.69 0.68 0.00 -0.17 0.00 0.00 175.17 173.07 1ruy s ASN 279 N -2.67 2.93 0.21 0.00 0.01 -1.26 -1.51 114.94 112.65 1ruy s ASN 279 Ca 0.02 -0.82 -0.22 0.00 -0.71 0.00 0.00 52.86 51.13 1ruy s ASN 279 Cb -0.01 -0.19 0.05 0.00 0.41 0.00 0.00 41.25 41.51 1ruy s ASN 279 CO -0.12 0.04 0.67 0.28 -1.51 0.00 0.00 177.10 176.46 1ruy s THR 280 N -1.70 0.00 -0.54 1.60 -1.32 -1.00 -4.89 115.64 107.79 1ruy s THR 280 Ca 0.15 -0.48 0.10 0.00 -1.21 0.00 0.00 61.69 60.26 1ruy s THR 280 Cb -0.07 -1.48 -0.10 0.00 -1.51 0.00 0.00 72.50 69.34 1ruy s THR 280 CO 0.07 0.00 0.45 0.29 -2.21 0.00 0.00 174.62 173.23 1ruy n LYS 281 N -0.42 3.48 -3.92 7.08 5.02 -1.26 -4.46 118.16 123.68 1ruy n LYS 281 Ca -0.11 -0.08 -0.19 0.00 -2.02 0.00 0.00 58.31 55.91 1ruy n LYS 281 Cb 0.62 -0.99 -0.17 0.00 -0.02 0.00 0.00 35.03 34.48 1ruy n LYS 281 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ruy s GLN 283 N 1.28 1.32 0.18 0.00 2.00 -0.39 -2.15 119.66 121.91 1ruy s GLN 283 Ca -0.06 -0.54 0.04 0.00 -2.00 0.00 0.00 55.36 52.80 1ruy s GLN 283 Cb -0.13 -1.25 -0.05 0.00 0.80 0.00 0.00 33.01 32.38 1ruy s GLN 283 CO -0.02 0.30 -0.06 0.95 -0.50 0.00 0.00 175.29 175.95 1ruy s THR 284 N -0.24 1.10 0.63 -0.34 -4.23 -0.89 -0.68 115.64 110.98 1ruy s THR 284 Ca 0.03 -2.05 0.34 0.00 -1.18 0.00 0.00 61.69 58.83 1ruy s THR 284 Cb -0.07 -2.03 0.38 0.00 1.34 0.00 0.00 72.50 72.11 1ruy s THR 284 CO -0.00 -0.59 2.18 -0.65 -0.54 0.00 0.00 174.62 175.02 1ruy h PRO 285 N 2.67 0.00 0.00 3.99 0.11 -1.88 -1.86 132.00 135.03 1ruy h PRO 285 Ca -0.37 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.57 1ruy h PRO 285 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1ruy h PRO 285 CO 0.64 0.00 -1.33 0.45 -0.21 0.00 0.00 178.00 177.55 1ruy h HIS 286 N 0.00 0.00 0.00 0.65 3.86 -1.93 -3.39 115.15 114.34 1ruy h HIS 286 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1ruy h HIS 286 Cb 0.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1ruy h HIS 286 CO 0.00 0.59 0.00 0.41 0.86 0.00 0.00 177.93 179.79 1ruy n GLY 287 N 1.38 0.45 3.81 2.45 0.00 -0.70 -3.72 105.19 108.87 1ruy n GLY 287 Ca -0.09 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 1ruy n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ruy s ALA 288 N -1.93 3.34 -0.01 4.61 0.00 -1.00 -2.10 121.76 124.67 1ruy s ALA 288 Ca 0.00 0.23 -0.00 0.00 0.00 0.00 0.00 51.96 52.19 1ruy s ALA 288 Cb 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 1ruy s ALA 288 CO 0.00 0.29 0.06 0.42 0.00 0.00 0.00 175.76 176.53 1ruy s ILE 289 N -1.63 4.60 -0.38 0.00 -1.09 -0.91 -2.15 121.20 119.63 1ruy s ILE 289 Ca 0.47 -0.44 0.02 0.00 -2.23 0.00 0.00 60.65 58.47 1ruy s ILE 289 Cb -0.16 -3.09 0.15 0.00 -1.58 0.00 0.00 42.46 37.79 1ruy s ILE 289 CO 0.21 0.37 0.29 0.21 -1.23 0.00 0.00 174.94 174.79 1ruy s ASN 290 N -1.66 2.05 0.16 3.58 2.47 -1.26 -4.05 114.94 116.23 1ruy s ASN 290 Ca 0.22 -2.35 -0.12 0.00 0.42 0.00 0.00 52.86 51.03 1ruy s ASN 290 Cb -0.12 -0.18 0.01 0.00 -1.45 0.00 0.00 41.25 39.51 1ruy s ASN 290 CO 0.13 -0.25 0.36 -0.55 -3.72 0.00 0.00 177.10 173.07 1ruy s SER 291 N 0.81 -0.08 -0.00 -4.21 0.15 -1.26 -5.02 113.70 104.09 1ruy s SER 291 Ca 0.23 -0.66 0.12 0.00 0.70 0.00 0.00 55.95 56.34 1ruy s SER 291 Cb -0.13 0.48 -0.14 0.00 -1.71 0.00 0.00 66.02 64.52 1ruy s SER 291 CO -0.06 -0.92 0.45 -1.20 1.20 0.00 0.00 173.24 172.71 1ruy n SER 292 N -0.24 0.90 -4.72 5.45 7.64 -1.26 -4.93 113.62 116.46 1ruy n SER 292 Ca -0.10 -0.62 -0.39 0.00 1.01 0.00 0.00 58.87 58.77 1ruy n SER 292 Cb 0.63 1.11 0.03 0.00 -1.01 0.00 0.00 64.21 64.97 1ruy n SER 292 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ruy n LEU 293 N -1.41 4.77 0.29 -3.43 4.77 -1.26 -4.90 117.00 115.83 1ruy n LEU 293 Ca 0.01 1.02 0.18 0.00 -0.03 0.00 0.00 56.01 57.19 1ruy n LEU 293 Cb 0.21 -1.53 0.76 0.00 -2.33 0.00 0.00 43.42 40.53 1ruy n LEU 293 CO 0.24 -0.69 1.02 1.55 -1.33 0.00 0.00 177.39 178.18 1ruy h PRO 294 N 1.66 0.00 -5.08 3.23 0.13 -1.93 -3.42 132.00 126.59 1ruy h PRO 294 Ca -0.50 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.24 1ruy h PRO 294 Cb 1.30 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 1ruy h PRO 294 CO 0.58 0.01 -0.64 -0.06 -0.23 0.00 0.00 178.00 177.66 1ruy s PHE 295 N -3.75 1.63 -0.10 1.56 0.40 -0.91 -1.67 117.98 115.14 1ruy s PHE 295 Ca 0.00 -0.97 -0.30 0.00 -0.60 0.00 0.00 56.93 55.06 1ruy s PHE 295 Cb 0.10 -0.97 0.07 0.00 0.51 0.00 0.00 43.02 42.73 1ruy s PHE 295 CO 0.53 -0.08 0.69 1.14 0.70 0.00 0.00 175.22 178.20 1ruy s GLN 296 N -3.90 1.01 -0.15 0.44 1.03 -1.05 -0.13 119.66 116.91 1ruy s GLN 296 Ca 0.31 0.41 0.15 0.00 0.04 0.00 0.00 55.36 56.27 1ruy s GLN 296 Cb 0.07 0.48 0.40 0.00 0.03 0.00 0.00 33.01 33.98 1ruy s GLN 296 CO 0.11 -0.28 1.20 0.27 -2.54 0.00 0.00 175.29 174.04 1ruy n ASN 297 N 1.27 1.57 0.01 12.60 0.23 -0.96 -1.77 115.26 128.21 1ruy n ASN 297 Ca -0.18 -3.37 -0.09 0.00 -0.53 0.00 0.00 54.58 50.41 1ruy n ASN 297 Cb 0.57 -0.46 -0.07 0.00 -2.08 0.00 0.00 39.78 37.73 1ruy n ASN 297 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 1ruy h ILE 298 N 2.33 0.82 -1.78 1.53 1.08 -1.88 -3.49 117.51 116.13 1ruy h ILE 298 Ca -0.05 -1.34 0.01 0.00 -0.39 0.00 0.00 64.86 63.10 1ruy h ILE 298 Cb 1.20 1.46 -0.23 0.00 -3.07 0.00 0.00 36.82 36.19 1ruy h ILE 298 CO 0.02 0.24 0.34 -2.28 -0.69 0.00 0.00 178.15 175.78 1ruy s HIS 299 N -2.74 -0.57 0.21 1.37 2.46 -1.26 -4.97 115.29 109.78 1ruy s HIS 299 Ca -0.11 1.24 0.02 0.00 0.47 0.00 0.00 55.06 56.68 1ruy s HIS 299 Cb -0.00 0.37 0.15 0.00 -0.13 0.00 0.00 32.58 32.97 1ruy s HIS 299 CO 0.40 -0.37 1.50 -1.00 -2.47 0.00 0.00 174.74 172.80 1ruy h PRO 300 N 3.82 0.29 -6.32 2.88 0.13 -1.95 -3.43 132.00 127.41 1ruy h PRO 300 Ca -0.26 -0.23 -0.55 0.00 -0.87 0.00 0.00 66.00 64.09 1ruy h PRO 300 Cb 1.16 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1ruy h PRO 300 CO 0.19 0.86 0.58 0.08 -0.23 0.00 0.00 178.00 179.49 1ruy s VAL 301 N -3.65 4.54 0.03 1.56 1.01 -1.26 -4.91 120.40 117.71 1ruy s VAL 301 Ca -0.04 1.83 -0.08 0.00 0.00 0.00 0.00 61.98 63.68 1ruy s VAL 301 Cb 0.11 -4.17 -0.00 0.00 0.00 0.00 0.00 36.38 32.32 1ruy s VAL 301 CO 0.82 0.04 0.16 0.28 0.00 0.00 0.00 175.10 176.39 1ruy s THR 302 N 1.84 0.11 -0.10 3.92 -1.32 -1.26 -4.32 115.64 114.51 1ruy s THR 302 Ca 0.53 -0.90 -0.02 0.00 -1.21 0.00 0.00 61.69 60.09 1ruy s THR 302 Cb -0.22 -0.81 0.03 0.00 -1.51 0.00 0.00 72.50 69.99 1ruy s THR 302 CO 0.22 -0.50 0.01 -0.63 -2.21 0.00 0.00 174.62 171.51 1ruy s ILE 303 N -2.33 0.41 0.00 5.08 1.01 0.14 -4.97 121.20 120.54 1ruy s ILE 303 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.56 1ruy s ILE 303 Cb -0.02 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.81 1ruy s ILE 303 CO -0.03 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1ruy n GLY 304 N 5.13 0.30 3.46 6.18 0.00 -1.26 -1.26 105.19 117.73 1ruy n GLY 304 Ca -0.08 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1ruy n GLY 304 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ruy s GLU 305 N 0.00 3.09 0.20 1.61 0.41 0.14 -4.96 118.70 119.19 1ruy s GLU 305 Ca 0.00 -0.89 0.01 0.00 -0.41 0.00 0.00 54.97 53.69 1ruy s GLU 305 Cb 0.00 -4.03 -0.05 0.00 -1.78 0.00 0.00 34.13 28.27 1ruy s GLU 305 CO 0.00 -0.99 0.04 0.00 -0.49 0.00 0.00 175.26 173.83 1ruy s PRO 307 N -3.98 4.17 0.10 0.00 0.02 -1.26 -4.96 135.00 129.09 1ruy s PRO 307 Ca 0.30 1.45 -0.31 0.00 0.02 0.00 0.00 61.00 62.46 1ruy s PRO 307 Cb 0.07 -2.49 -0.10 0.00 0.02 0.00 0.00 34.50 31.99 1ruy s PRO 307 CO 0.08 -0.12 1.88 1.17 -0.33 0.00 0.00 177.00 179.67 1ruy n LYS 308 N -0.14 2.81 -2.21 5.54 3.00 -0.67 -4.51 118.16 121.98 1ruy n LYS 308 Ca 0.05 1.02 -0.36 0.00 -0.00 0.00 0.00 58.31 59.02 1ruy n LYS 308 Cb 0.50 -2.94 0.00 0.00 0.00 0.00 0.00 35.03 32.60 1ruy n LYS 308 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1ruy s TYR 309 N 3.17 2.72 -0.02 5.64 5.04 -1.26 -2.52 117.35 130.12 1ruy s TYR 309 Ca 0.84 1.53 -0.27 0.00 -2.44 0.00 0.00 57.07 56.73 1ruy s TYR 309 Cb -0.47 -3.38 0.06 0.00 0.35 0.00 0.00 41.96 38.52 1ruy s TYR 309 CO 0.39 -1.68 0.60 0.54 -1.34 0.00 0.00 175.55 174.06 1ruy s VAL 310 N -1.62 0.01 -1.76 3.14 0.11 -0.73 -4.90 120.40 114.65 1ruy s VAL 310 Ca 0.69 -0.10 0.29 0.00 -2.93 0.00 0.00 61.98 59.92 1ruy s VAL 310 Cb -0.28 -0.94 0.68 0.00 -1.53 0.00 0.00 36.38 34.32 1ruy s VAL 310 CO 0.32 -0.06 2.03 0.29 -3.33 0.00 0.00 175.10 174.35 1ruy n LYS 311 N 0.84 0.69 -1.71 1.54 5.02 -1.26 -4.26 118.16 119.02 1ruy n LYS 311 Ca -0.19 0.01 -0.37 0.00 -2.02 0.00 0.00 58.31 55.74 1ruy n LYS 311 Cb 0.58 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.15 1ruy n LYS 311 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1ruy n SER 312 N -1.12 1.85 -0.11 4.39 7.64 -1.26 -4.95 113.62 120.06 1ruy n SER 312 Ca 0.18 0.82 -0.13 0.00 1.01 0.00 0.00 58.87 60.75 1ruy n SER 312 Cb 0.15 -1.53 -0.14 0.00 -1.01 0.00 0.00 64.21 61.68 1ruy n SER 312 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1ruy n THR 313 N -1.90 1.44 -3.82 0.44 -1.04 -1.26 -4.77 114.28 103.36 1ruy n THR 313 Ca 0.16 -0.74 -0.12 0.00 -2.04 0.00 0.00 64.05 61.30 1ruy n THR 313 Cb 0.48 -0.87 -0.13 0.00 -1.82 0.00 0.00 70.33 67.99 1ruy n THR 313 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1ruy s LYS 314 N -2.51 0.16 -0.46 -2.82 2.20 -1.26 -5.09 119.74 109.96 1ruy s LYS 314 Ca -0.20 0.19 0.05 0.00 -0.36 0.00 0.00 55.97 55.66 1ruy s LYS 314 Cb 0.07 0.07 0.18 0.00 -1.51 0.00 0.00 37.83 36.64 1ruy s LYS 314 CO 0.74 -0.02 0.53 -0.51 -0.36 0.00 0.00 175.35 175.73 1ruy s LEU 315 N 0.10 -0.07 -0.16 5.43 1.43 -1.26 -5.04 118.68 119.12 1ruy s LEU 315 Ca -0.00 -2.35 -0.02 0.00 -1.03 0.00 0.00 54.13 50.73 1ruy s LEU 315 Cb -0.01 0.76 -0.02 0.00 0.03 0.00 0.00 46.19 46.95 1ruy s LEU 315 CO 0.00 -0.11 -0.08 -0.60 0.23 0.00 0.00 176.35 175.78 1ruy s ARG 316 N 0.52 3.47 -0.20 1.70 3.52 -1.26 -0.67 118.95 126.03 1ruy s ARG 316 Ca 0.31 -0.62 -0.08 0.00 -0.13 0.00 0.00 55.73 55.21 1ruy s ARG 316 Cb 0.01 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.56 1ruy s ARG 316 CO -0.12 0.13 0.08 1.41 -0.81 0.00 0.00 175.30 175.99 1ruy s MET 317 N 0.60 3.94 0.11 5.12 -2.45 -0.45 -4.84 119.30 121.33 1ruy s MET 317 Ca -0.05 -0.35 -0.30 0.00 -1.25 0.00 0.00 55.69 53.73 1ruy s MET 317 Cb -0.15 -3.29 -0.07 0.00 1.25 0.00 0.00 34.83 32.57 1ruy s MET 317 CO 0.03 0.16 1.20 0.00 1.05 0.00 0.00 175.02 177.46 1ruy s ALA 318 N 0.70 3.41 -0.10 4.11 0.00 -1.26 -1.38 121.76 127.23 1ruy s ALA 318 Ca 0.04 0.89 -0.01 0.00 0.00 0.00 0.00 51.96 52.88 1ruy s ALA 318 Cb -0.13 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.50 1ruy s ALA 318 CO 0.02 -0.41 -0.10 0.25 0.00 0.00 0.00 175.76 175.52 1ruy n THR 319 N 3.43 0.55 -0.17 0.00 -2.24 0.05 -4.94 114.28 110.96 1ruy n THR 319 Ca 0.07 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1ruy n THR 319 Cb 0.46 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 1ruy n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ruy n GLY 320 N 2.84 0.30 3.73 3.38 0.00 0.07 -4.93 105.19 110.58 1ruy n GLY 320 Ca -0.18 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 43.94 1ruy n GLY 320 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ruy s LEU 321 N 0.00 2.61 0.16 0.99 2.34 -1.26 -4.77 118.68 118.75 1ruy s LEU 321 Ca 0.00 -1.45 -0.34 0.00 0.06 0.00 0.00 54.13 52.40 1ruy s LEU 321 Cb 0.00 -0.92 -0.14 0.00 -0.56 0.00 0.00 46.19 44.57 1ruy s LEU 321 CO 0.00 -0.72 1.58 -1.14 -1.06 0.00 0.00 176.35 175.01 1ruy n ARG 322 N -1.23 2.16 -3.05 1.48 0.63 -1.26 -0.94 116.66 114.45 1ruy n ARG 322 Ca -0.11 0.78 -0.43 0.00 -0.92 0.00 0.00 57.85 57.17 1ruy n ARG 322 Cb 0.66 -2.55 -0.06 0.00 0.45 0.00 0.00 32.46 30.96 1ruy n ARG 322 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1ruy s ASN 323 N 0.96 6.28 -0.75 6.15 2.47 -0.60 -4.77 114.94 124.69 1ruy s ASN 323 Ca 0.79 -0.62 0.04 0.00 0.42 0.00 0.00 52.86 53.48 1ruy s ASN 323 Cb -0.68 -2.34 0.22 0.00 -1.45 0.00 0.00 41.25 37.01 1ruy s ASN 323 CO 0.38 -0.97 0.73 -0.38 -3.72 0.00 0.00 177.10 173.14 1ruy n ILE 324 N 5.84 2.49 0.14 -5.21 2.08 -1.26 -4.87 119.36 118.57 1ruy n ILE 324 Ca -0.03 -5.15 0.02 0.00 0.56 0.00 0.00 62.75 58.15 1ruy n ILE 324 Cb 0.46 -2.18 0.34 0.00 -0.75 0.00 0.00 39.64 37.52 1ruy n ILE 324 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1ruy h PRO 325 N 5.00 0.13 -6.84 0.38 0.11 -1.94 -3.47 132.00 125.38 1ruy h PRO 325 Ca 0.18 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.67 1ruy h PRO 325 Cb 0.71 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.77 1ruy h PRO 325 CO 0.84 0.42 -0.99 0.00 -0.21 0.00 0.00 178.00 178.07 1ruy n ALA 326 N -2.48 -2.44 1.95 -0.75 0.00 -1.26 -5.07 120.51 110.46 1ruy n ALA 326 Ca -0.01 -0.48 0.16 0.00 0.00 0.00 0.00 53.44 53.10 1ruy n ALA 326 Cb 0.37 -2.41 0.91 0.00 0.00 0.00 0.00 19.45 18.32 1ruy n ALA 326 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39