#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr4 n PRO 26 N 0.00 3.49 -2.02 -0.24 -0.04 -1.26 -4.96 135.00 129.97 1sr4 n PRO 26 Ca 0.00 -2.28 -0.36 0.00 -0.04 0.00 0.00 63.50 60.82 1sr4 n PRO 26 Cb 0.00 -2.91 0.03 0.00 -0.04 0.00 0.00 33.50 30.58 1sr4 n PRO 26 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1sr4 s THR 27 N 2.43 2.64 -0.08 0.52 -1.32 -1.26 -4.89 115.64 113.68 1sr4 s THR 27 Ca 0.64 0.40 0.31 0.00 -1.21 0.00 0.00 61.69 61.83 1sr4 s THR 27 Cb 0.17 -3.16 0.34 0.00 -1.51 0.00 0.00 72.50 68.34 1sr4 s THR 27 CO -0.07 -0.08 1.90 0.74 -2.21 0.00 0.00 174.62 174.91 1sr4 h THR 28 N 0.94 0.00 -2.90 5.08 2.02 -2.01 -3.34 112.91 112.69 1sr4 h THR 28 Ca -0.50 -0.39 -0.61 0.00 0.77 0.00 0.00 66.41 65.68 1sr4 h THR 28 Cb 1.30 1.29 -0.41 0.00 -1.74 0.00 0.00 68.15 68.58 1sr4 h THR 28 CO 0.55 0.00 -0.65 -1.22 0.37 0.00 0.00 175.52 174.57 1sr4 n TYR 29 N -2.79 2.51 0.15 3.16 4.01 -1.26 -4.95 117.16 117.99 1sr4 n TYR 29 Ca 0.01 -4.12 0.02 0.00 -0.16 0.00 0.00 57.90 53.64 1sr4 n TYR 29 Cb 0.26 -0.47 0.09 0.00 -0.31 0.00 0.00 39.34 38.92 1sr4 n TYR 29 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1sr4 n PRO 30 N 2.04 0.03 0.11 -0.72 -0.04 -1.26 -1.58 135.00 133.59 1sr4 n PRO 30 Ca 0.22 0.32 0.13 0.00 -0.04 0.00 0.00 63.50 64.13 1sr4 n PRO 30 Cb 0.38 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.78 1sr4 n PRO 30 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1sr4 n ASP 31 N -1.37 0.72 -4.48 3.54 5.75 -1.26 -4.60 116.55 114.85 1sr4 n ASP 31 Ca 0.01 0.61 -0.42 0.00 -0.01 0.00 0.00 54.79 54.98 1sr4 n ASP 31 Cb 0.03 -0.79 -0.10 0.00 -1.03 0.00 0.00 41.12 39.24 1sr4 n ASP 31 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1sr4 s VAL 32 N -3.18 5.19 0.72 2.12 1.01 -0.61 -5.06 120.40 120.58 1sr4 s VAL 32 Ca 0.08 -0.43 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 1sr4 s VAL 32 Cb 0.11 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.59 1sr4 s VAL 32 CO 0.51 -0.30 1.13 -1.61 0.00 0.00 0.00 175.10 174.83 1sr4 s GLU 33 N 1.88 2.38 -0.04 2.72 2.02 -1.26 -4.99 118.70 121.40 1sr4 s GLU 33 Ca 0.08 1.44 -0.26 0.00 0.02 0.00 0.00 54.97 56.25 1sr4 s GLU 33 Cb -0.18 -1.89 -0.03 0.00 0.10 0.00 0.00 34.13 32.13 1sr4 s GLU 33 CO 0.11 -1.59 0.83 -1.17 0.02 0.00 0.00 175.26 173.47 1sr4 s LEU 34 N -5.31 4.33 -0.07 1.80 2.96 -1.26 -5.05 118.68 116.09 1sr4 s LEU 34 Ca 0.67 1.40 -0.13 0.00 -0.22 0.00 0.00 54.13 55.85 1sr4 s LEU 34 Cb -0.22 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 1sr4 s LEU 34 CO 0.47 -0.20 0.33 -0.44 -1.32 0.00 0.00 176.35 175.20 1sr4 s SER 35 N 0.91 6.64 0.99 3.68 0.01 -1.26 -5.10 113.70 119.56 1sr4 s SER 35 Ca 0.44 0.76 -0.14 0.00 1.31 0.00 0.00 55.95 58.31 1sr4 s SER 35 Cb -0.19 -2.20 0.18 0.00 0.21 0.00 0.00 66.02 64.02 1sr4 s SER 35 CO 0.22 0.27 1.17 -2.16 0.41 0.00 0.00 173.24 173.15 1sr4 s PRO 36 N -0.63 0.52 0.57 12.44 0.04 -1.26 -4.99 135.00 141.69 1sr4 s PRO 36 Ca 0.21 0.08 -0.21 0.00 0.04 0.00 0.00 61.00 61.12 1sr4 s PRO 36 Cb -0.15 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 1sr4 s PRO 36 CO 0.09 -2.58 1.31 -2.14 0.04 0.00 0.00 177.00 173.73 1sr4 s PRO 37 N -5.42 3.04 0.49 0.56 0.02 -1.26 -4.97 135.00 127.46 1sr4 s PRO 37 Ca 0.67 2.12 -0.22 0.00 0.02 0.00 0.00 61.00 63.59 1sr4 s PRO 37 Cb -0.12 -2.14 -0.07 0.00 0.02 0.00 0.00 34.50 32.20 1sr4 s PRO 37 CO 0.54 -1.24 1.16 -1.25 -0.33 0.00 0.00 177.00 175.88 1sr4 s PRO 38 N -3.04 3.60 -0.07 5.54 0.04 -1.26 -4.79 135.00 135.02 1sr4 s PRO 38 Ca 0.74 1.72 -0.13 0.00 0.04 0.00 0.00 61.00 63.37 1sr4 s PRO 38 Cb -0.38 -2.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.85 1sr4 s PRO 38 CO 0.43 -0.67 0.33 0.50 0.04 0.00 0.00 177.00 177.63 1sr4 s ARG 39 N -2.91 3.91 0.24 4.56 6.06 -1.26 -1.54 118.95 128.01 1sr4 s ARG 39 Ca 0.67 0.23 -0.06 0.00 -2.50 0.00 0.00 55.73 54.07 1sr4 s ARG 39 Cb -0.27 -3.27 -0.02 0.00 0.06 0.00 0.00 34.95 31.45 1sr4 s ARG 39 CO 0.32 0.58 0.32 0.96 -2.50 0.00 0.00 175.30 174.98 1sr4 s ILE 40 N -0.64 0.00 -0.01 4.11 -4.36 -0.11 -4.36 121.20 115.83 1sr4 s ILE 40 Ca 0.20 -1.70 0.06 0.00 -0.26 0.00 0.00 60.65 58.95 1sr4 s ILE 40 Cb -0.15 -2.38 -0.02 0.00 1.25 0.00 0.00 42.46 41.17 1sr4 s ILE 40 CO 0.09 0.00 -0.21 -0.44 0.24 0.00 0.00 174.94 174.62 1sr4 s SER 41 N -3.11 2.43 -0.27 4.36 0.01 -0.04 -1.44 113.70 115.63 1sr4 s SER 41 Ca 0.31 -0.39 -0.07 0.00 1.31 0.00 0.00 55.95 57.11 1sr4 s SER 41 Cb 0.03 -0.27 -0.01 0.00 0.21 0.00 0.00 66.02 65.98 1sr4 s SER 41 CO 0.12 0.25 0.07 -0.22 0.41 0.00 0.00 173.24 173.87 1sr4 s LEU 42 N -0.54 3.62 -0.02 2.44 2.96 -1.26 -1.62 118.68 124.26 1sr4 s LEU 42 Ca 0.08 -0.45 0.07 0.00 -0.22 0.00 0.00 54.13 53.60 1sr4 s LEU 42 Cb -0.08 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1sr4 s LEU 42 CO -0.01 -0.11 -0.22 -0.13 -1.32 0.00 0.00 176.35 174.56 1sr4 s ARG 43 N 1.56 1.78 0.19 1.98 0.52 -0.77 -0.16 118.95 124.05 1sr4 s ARG 43 Ca 0.05 -0.79 -0.30 0.00 -0.52 0.00 0.00 55.73 54.17 1sr4 s ARG 43 Cb -0.16 -1.72 -0.08 0.00 0.52 0.00 0.00 34.95 33.51 1sr4 s ARG 43 CO 0.03 0.47 1.20 0.45 0.02 0.00 0.00 175.30 177.47 1sr4 s SER 44 N -0.52 7.09 0.05 0.23 0.15 -1.18 -0.20 113.70 119.31 1sr4 s SER 44 Ca 0.08 2.25 0.24 0.00 0.70 0.00 0.00 55.95 59.23 1sr4 s SER 44 Cb -0.08 -2.61 0.99 0.00 -1.71 0.00 0.00 66.02 62.61 1sr4 s SER 44 CO -0.01 -0.36 1.76 0.18 1.20 0.00 0.00 173.24 176.01 1sr4 n LEU 45 N 2.38 0.16 -0.09 3.45 4.77 -0.51 0.48 117.00 127.65 1sr4 n LEU 45 Ca 0.04 0.52 -0.20 0.00 -0.03 0.00 0.00 56.01 56.34 1sr4 n LEU 45 Cb 0.45 -0.48 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 1sr4 n LEU 45 CO 0.56 -0.14 -0.28 0.25 -1.33 0.00 0.00 177.39 176.46 1sr4 h LEU 46 N 0.00 0.03 0.00 2.23 6.46 -1.78 -3.40 115.31 118.85 1sr4 h LEU 46 Ca 0.00 -0.67 -0.04 0.00 -0.12 0.00 0.00 57.88 57.05 1sr4 h LEU 46 Cb 0.45 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1sr4 h LEU 46 CO 0.00 1.38 -1.31 0.35 -0.62 0.00 0.00 178.44 178.24 1sr4 n THR 47 N -4.43 0.65 -0.85 1.05 -2.24 -1.22 -4.96 114.28 102.28 1sr4 n THR 47 Ca -0.26 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1sr4 n THR 47 Cb 0.65 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1sr4 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sr4 n ALA 48 N -2.25 0.00 -2.27 6.98 0.00 0.18 -4.97 120.51 118.17 1sr4 n ALA 48 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 1sr4 n ALA 48 Cb 0.63 -0.78 -0.05 0.00 0.00 0.00 0.00 19.45 19.25 1sr4 n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1sr4 s GLN 49 N -0.94 4.61 0.35 0.00 -0.21 -1.26 -4.75 119.66 117.46 1sr4 s GLN 49 Ca 0.00 1.26 -0.26 0.00 0.02 0.00 0.00 55.36 56.39 1sr4 s GLN 49 Cb 0.00 -3.36 -0.09 0.00 1.00 0.00 0.00 33.01 30.56 1sr4 s GLN 49 CO 0.00 0.29 1.00 -1.25 -2.12 0.00 0.00 175.29 173.21 1sr4 s PRO 50 N -0.18 4.42 0.10 2.91 0.04 -1.26 -3.12 135.00 137.90 1sr4 s PRO 50 Ca 0.42 1.45 -0.31 0.00 0.04 0.00 0.00 61.00 62.61 1sr4 s PRO 50 Cb -0.22 -2.74 -0.07 0.00 0.04 0.00 0.00 34.50 31.51 1sr4 s PRO 50 CO 0.27 0.11 1.23 0.08 0.04 0.00 0.00 177.00 178.73 1sr4 s VAL 51 N -1.58 3.80 0.24 -0.36 1.01 0.77 -4.98 120.40 119.29 1sr4 s VAL 51 Ca 0.53 1.33 0.08 0.00 0.00 0.00 0.00 61.98 63.91 1sr4 s VAL 51 Cb -0.21 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1sr4 s VAL 51 CO 0.27 0.13 0.11 -0.54 0.00 0.00 0.00 175.10 175.07 1sr4 s LYS 52 N 0.80 2.68 0.30 2.72 1.02 -1.26 -4.69 119.74 121.32 1sr4 s LYS 52 Ca 0.59 -1.14 0.08 0.00 0.02 0.00 0.00 55.97 55.52 1sr4 s LYS 52 Cb -0.32 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1sr4 s LYS 52 CO 0.31 0.41 0.11 0.54 -0.92 0.00 0.00 175.35 175.79 1sr4 s ASN 53 N -3.60 4.77 0.00 2.83 2.20 -0.18 -4.93 114.94 116.03 1sr4 s ASN 53 Ca 0.32 -0.65 0.23 0.00 -0.94 0.00 0.00 52.86 51.82 1sr4 s ASN 53 Cb -0.08 -0.87 0.47 0.00 -2.00 0.00 0.00 41.25 38.77 1sr4 s ASN 53 CO 0.23 -0.17 1.42 -0.90 -2.94 0.00 0.00 177.10 174.74 1sr4 n ASP 54 N -1.08 3.02 0.23 3.54 5.75 -1.26 -4.30 116.55 122.44 1sr4 n ASP 54 Ca -0.05 -1.93 0.11 0.00 -0.01 0.00 0.00 54.79 52.91 1sr4 n ASP 54 Cb 0.60 -0.18 0.40 0.00 -1.03 0.00 0.00 41.12 40.91 1sr4 n ASP 54 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 1sr4 h HIS 55 N 4.05 0.00 -2.68 2.11 2.76 -1.96 -3.44 115.15 115.99 1sr4 h HIS 55 Ca 0.00 0.00 -0.56 0.00 -2.20 0.00 0.00 60.37 57.61 1sr4 h HIS 55 Cb 0.89 0.00 -0.15 0.00 1.55 0.00 0.00 27.41 29.69 1sr4 h HIS 55 CO 0.18 0.15 -0.77 0.71 -1.30 0.00 0.00 177.93 176.90 1sr4 s TYR 56 N -3.47 2.08 0.32 5.26 2.02 -1.26 -5.08 117.35 117.22 1sr4 s TYR 56 Ca 0.03 -0.41 -0.29 0.00 -0.37 0.00 0.00 57.07 56.02 1sr4 s TYR 56 Cb 0.08 -0.95 -0.13 0.00 -0.40 0.00 0.00 41.96 40.57 1sr4 s TYR 56 CO 0.63 0.54 1.29 -3.47 -1.57 0.00 0.00 175.55 172.97 1sr4 n ASP 57 N -0.29 2.64 0.29 2.29 4.64 -1.26 -4.80 116.55 120.05 1sr4 n ASP 57 Ca -0.08 1.19 0.18 0.00 -1.38 0.00 0.00 54.79 54.70 1sr4 n ASP 57 Cb 0.59 -1.46 0.89 0.00 -1.04 0.00 0.00 41.12 40.11 1sr4 n ASP 57 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 1sr4 h SER 58 N 2.83 0.00 -0.33 1.67 4.64 -1.95 0.13 113.55 120.55 1sr4 h SER 58 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1sr4 h SER 58 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1sr4 h SER 58 CO 0.65 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 178.02 1sr4 n HIS 59 N -3.18 0.42 -3.53 4.77 8.25 -1.26 -4.87 115.22 115.81 1sr4 n HIS 59 Ca -0.00 -0.21 -0.37 0.00 -0.26 0.00 0.00 57.72 56.87 1sr4 n HIS 59 Cb 0.34 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.38 1sr4 n HIS 59 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1sr4 s ASN 60 N -1.56 6.59 0.52 0.41 3.84 0.45 -4.99 114.94 120.20 1sr4 s ASN 60 Ca 0.37 0.70 0.22 0.00 0.21 0.00 0.00 52.86 54.36 1sr4 s ASN 60 Cb 0.22 -2.21 1.38 0.00 -0.55 0.00 0.00 41.25 40.10 1sr4 s ASN 60 CO 0.31 0.20 2.11 0.10 -2.79 0.00 0.00 177.10 177.04 1sr4 h TYR 61 N 5.81 0.00 0.00 0.43 -0.00 -1.89 -1.90 116.97 119.42 1sr4 h TYR 61 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.27 1sr4 h TYR 61 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.92 1sr4 h TYR 61 CO 0.66 0.08 0.00 1.28 -0.00 0.00 0.00 178.16 180.18 1sr4 n LEU 62 N -4.09 0.49 0.02 0.10 4.77 -1.26 -0.64 117.00 116.40 1sr4 n LEU 62 Ca -0.03 0.71 0.09 0.00 -0.03 0.00 0.00 56.01 56.76 1sr4 n LEU 62 Cb 0.17 -0.76 0.39 0.00 -2.33 0.00 0.00 43.42 40.89 1sr4 n LEU 62 CO 0.32 -0.84 0.79 -1.54 -1.33 0.00 0.00 177.39 174.79 1sr4 n SER 63 N -2.15 0.14 -0.64 -1.43 3.41 -0.71 -2.37 113.62 109.86 1sr4 n SER 63 Ca -0.01 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.21 1sr4 n SER 63 Cb 0.05 -0.56 0.08 0.00 -0.26 0.00 0.00 64.21 63.52 1sr4 n SER 63 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1sr4 n THR 64 N -1.65 0.09 -3.80 6.66 -2.24 0.19 -1.01 114.28 112.52 1sr4 n THR 64 Ca 0.04 -0.55 -0.33 0.00 -2.27 0.00 0.00 64.05 60.94 1sr4 n THR 64 Cb 0.21 1.24 -0.05 0.00 -2.10 0.00 0.00 70.33 69.64 1sr4 n THR 64 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1sr4 s HIS 65 N -1.26 3.55 0.02 4.78 4.02 -1.00 -4.38 115.29 121.01 1sr4 s HIS 65 Ca 0.19 0.48 -0.04 0.00 1.02 0.00 0.00 55.06 56.72 1sr4 s HIS 65 Cb 0.13 -1.93 -0.01 0.00 -1.02 0.00 0.00 32.58 29.75 1sr4 s HIS 65 CO 0.20 0.59 0.06 -1.58 1.02 0.00 0.00 174.74 175.02 1sr4 s TRP 66 N -1.40 0.17 -0.18 1.40 0.52 -0.52 -4.48 118.94 114.45 1sr4 s TRP 66 Ca 0.31 -0.37 -0.08 0.00 0.02 0.00 0.00 56.10 55.97 1sr4 s TRP 66 Cb -0.13 -0.13 -0.04 0.00 -1.15 0.00 0.00 33.47 32.02 1sr4 s TRP 66 CO 0.20 -0.26 0.09 -1.21 0.02 0.00 0.00 176.95 175.79 1sr4 s GLU 67 N -1.65 3.95 -0.34 4.98 2.02 0.14 -0.94 118.70 126.88 1sr4 s GLU 67 Ca -0.13 -0.28 -0.19 0.00 0.02 0.00 0.00 54.97 54.39 1sr4 s GLU 67 Cb -0.07 -3.26 -0.01 0.00 0.10 0.00 0.00 34.13 30.89 1sr4 s GLU 67 CO -0.01 0.36 0.54 -1.17 0.02 0.00 0.00 175.26 175.00 1sr4 s LEU 68 N 0.16 4.27 0.01 1.80 2.96 -0.59 -1.02 118.68 126.27 1sr4 s LEU 68 Ca 0.06 0.11 0.07 0.00 -0.22 0.00 0.00 54.13 54.15 1sr4 s LEU 68 Cb -0.12 -2.64 -0.02 0.00 0.50 0.00 0.00 46.19 43.91 1sr4 s LEU 68 CO -0.00 -0.47 -0.21 0.27 -1.32 0.00 0.00 176.35 174.62 1sr4 s ILE 69 N 2.45 1.64 0.10 6.68 -5.25 -1.01 -4.19 121.20 121.61 1sr4 s ILE 69 Ca 0.20 -0.99 -0.26 0.00 -0.99 0.00 0.00 60.65 58.61 1sr4 s ILE 69 Cb -0.15 -1.38 -0.06 0.00 2.95 0.00 0.00 42.46 43.81 1sr4 s ILE 69 CO 0.13 0.37 0.81 -1.81 -1.79 0.00 0.00 174.94 172.65 1sr4 s ASP 70 N -0.74 7.34 -0.10 4.36 1.01 -1.26 -1.29 116.67 125.99 1sr4 s ASP 70 Ca 0.08 1.60 -0.24 0.00 0.71 0.00 0.00 52.55 54.70 1sr4 s ASP 70 Cb -0.08 -2.51 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 1sr4 s ASP 70 CO 0.00 0.07 0.74 -0.47 0.21 0.00 0.00 175.17 175.72 1sr4 s TYR 71 N -0.44 3.52 -1.72 4.23 5.04 -0.22 -4.90 117.35 122.87 1sr4 s TYR 71 Ca 0.39 1.24 0.22 0.00 -2.44 0.00 0.00 57.07 56.49 1sr4 s TYR 71 Cb -0.22 -2.88 -0.01 0.00 0.35 0.00 0.00 41.96 39.20 1sr4 s TYR 71 CO 0.26 -0.03 1.07 1.63 -1.34 0.00 0.00 175.55 177.14 1sr4 n LYS 72 N 4.28 0.84 -1.59 4.97 4.76 -1.26 -4.75 118.16 125.41 1sr4 n LYS 72 Ca 0.01 -0.68 -0.32 0.00 -2.87 0.00 0.00 58.31 54.44 1sr4 n LYS 72 Cb 0.50 -1.49 0.06 0.00 -1.84 0.00 0.00 35.03 32.27 1sr4 n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1sr4 s GLY 73 N -2.63 2.01 -0.08 0.72 0.00 -1.26 -4.98 107.32 101.09 1sr4 s GLY 73 Ca 0.16 0.47 0.14 0.00 0.00 0.00 0.00 44.72 45.48 1sr4 s GLY 73 CO 0.65 0.82 1.35 0.28 0.00 0.00 0.00 173.10 176.20 1sr4 n LYS 74 N -2.77 2.96 0.00 2.90 4.76 -1.26 -4.64 118.16 120.11 1sr4 n LYS 74 Ca 0.10 -2.43 0.14 0.00 -2.87 0.00 0.00 58.31 53.25 1sr4 n LYS 74 Cb 0.52 -1.55 0.72 0.00 -1.84 0.00 0.00 35.03 32.89 1sr4 n LYS 74 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1sr4 n GLU 75 N 0.14 0.38 -0.56 1.97 0.00 -1.26 -3.65 120.64 117.67 1sr4 n GLU 75 Ca 0.16 0.01 0.04 0.00 0.00 0.00 0.00 57.16 57.38 1sr4 n GLU 75 Cb 0.65 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.79 1sr4 n GLU 75 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1sr4 n TYR 76 N -1.30 0.38 0.18 -1.84 4.01 -1.26 -4.76 117.16 112.58 1sr4 n TYR 76 Ca 0.13 -1.41 0.05 0.00 -0.16 0.00 0.00 57.90 56.51 1sr4 n TYR 76 Cb 0.24 -0.31 0.33 0.00 -0.31 0.00 0.00 39.34 39.29 1sr4 n TYR 76 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1sr4 h GLU 77 N 0.89 0.00 -0.77 -0.72 4.39 -1.92 -3.17 114.58 113.29 1sr4 h GLU 77 Ca 0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1sr4 h GLU 77 Cb 1.23 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.84 1sr4 h GLU 77 CO 0.13 0.40 0.49 1.57 -1.16 0.00 0.00 179.01 180.43 1sr4 h LYS 78 N 0.00 1.02 -0.40 2.33 2.10 -1.90 -2.84 116.57 116.89 1sr4 h LYS 78 Ca -0.00 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1sr4 h LYS 78 Cb 0.87 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 1sr4 h LYS 78 CO 0.05 0.70 0.00 1.28 -2.00 0.00 0.00 179.45 179.48 1sr4 n LEU 79 N -4.40 3.87 0.25 7.07 4.77 -1.24 -4.61 117.00 122.71 1sr4 n LEU 79 Ca 0.08 -2.53 0.09 0.00 -0.03 0.00 0.00 56.01 53.62 1sr4 n LEU 79 Cb 0.05 -0.45 0.66 0.00 -2.33 0.00 0.00 43.42 41.34 1sr4 n LEU 79 CO 0.37 0.73 1.00 -0.09 -1.33 0.00 0.00 177.39 178.07 1sr4 h ARG 80 N 2.54 0.00 -5.67 3.23 2.43 -1.47 -3.46 114.38 111.99 1sr4 h ARG 80 Ca 0.00 0.00 -0.43 0.00 -0.81 0.00 0.00 59.98 58.74 1sr4 h ARG 80 Cb 1.23 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.74 1sr4 h ARG 80 CO 0.16 0.09 -0.66 -3.47 -1.51 0.00 0.00 179.97 174.58 1sr4 n ASP 81 N -4.17 -4.62 -0.16 -3.80 2.03 -1.26 -1.05 116.55 103.51 1sr4 n ASP 81 Ca -0.03 -0.55 -0.02 0.00 0.52 0.00 0.00 54.79 54.71 1sr4 n ASP 81 Cb 0.17 -3.74 -0.01 0.00 -0.72 0.00 0.00 41.12 36.82 1sr4 n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1sr4 n GLY 82 N -1.46 0.36 0.09 0.27 0.00 -1.26 -4.94 105.19 98.24 1sr4 n GLY 82 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 1sr4 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sr4 n GLY 83 N -0.44 0.27 3.27 -0.02 0.00 -0.22 -4.97 105.19 103.08 1sr4 n GLY 83 Ca -0.02 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 1sr4 n GLY 83 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sr4 s THR 84 N -0.16 2.93 0.04 2.61 2.01 -0.39 -4.89 115.64 117.80 1sr4 s THR 84 Ca 0.02 -0.66 -0.30 0.00 0.31 0.00 0.00 61.69 61.06 1sr4 s THR 84 Cb -0.00 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 1sr4 s THR 84 CO 0.01 0.48 1.06 -0.76 -0.69 0.00 0.00 174.62 174.72 1sr4 s LEU 85 N 1.16 4.39 0.31 4.42 1.43 -1.26 -0.79 118.68 128.33 1sr4 s LEU 85 Ca 0.01 1.82 -0.01 0.00 -1.03 0.00 0.00 54.13 54.93 1sr4 s LEU 85 Cb -0.14 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 1sr4 s LEU 85 CO -0.04 -0.31 0.37 0.68 0.23 0.00 0.00 176.35 177.28 1sr4 s VAL 86 N 0.87 0.00 0.04 -1.59 -7.23 0.49 -1.05 120.40 111.92 1sr4 s VAL 86 Ca 0.54 -1.75 0.01 0.00 -1.81 0.00 0.00 61.98 58.97 1sr4 s VAL 86 Cb -0.25 -2.54 -0.02 0.00 0.56 0.00 0.00 36.38 34.13 1sr4 s VAL 86 CO 0.29 0.00 -0.06 -1.10 -0.31 0.00 0.00 175.10 173.92 1sr4 s GLN 87 N -3.41 0.48 -0.35 4.82 -0.21 -0.42 -0.11 119.66 120.46 1sr4 s GLN 87 Ca 0.34 -0.76 -0.07 0.00 0.02 0.00 0.00 55.36 54.89 1sr4 s GLN 87 Cb 0.01 -0.14 0.04 0.00 1.00 0.00 0.00 33.01 33.92 1sr4 s GLN 87 CO 0.20 0.01 0.12 -0.06 -2.12 0.00 0.00 175.29 173.44 1sr4 s PHE 88 N -1.60 3.27 -0.09 0.91 0.08 -1.26 -2.41 117.98 116.87 1sr4 s PHE 88 Ca -0.10 -1.43 -0.06 0.00 0.12 0.00 0.00 56.93 55.46 1sr4 s PHE 88 Cb -0.09 -2.35 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 1sr4 s PHE 88 CO -0.01 -0.74 0.14 0.21 -0.10 0.00 0.00 175.22 174.72 1sr4 s LYS 89 N 1.40 3.41 0.32 0.44 2.20 -0.19 -0.56 119.74 126.77 1sr4 s LYS 89 Ca -0.01 -0.19 -0.28 0.00 -0.36 0.00 0.00 55.97 55.13 1sr4 s LYS 89 Cb -0.20 -3.15 -0.10 0.00 -1.51 0.00 0.00 37.83 32.88 1sr4 s LYS 89 CO 0.03 0.75 1.17 0.08 -0.36 0.00 0.00 175.35 177.03 1sr4 s VAL 90 N -1.08 3.19 0.09 4.02 1.01 -0.04 0.28 120.40 127.86 1sr4 s VAL 90 Ca 0.18 1.15 -0.31 0.00 0.00 0.00 0.00 61.98 63.00 1sr4 s VAL 90 Cb -0.12 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 1sr4 s VAL 90 CO 0.07 0.24 1.47 -0.69 0.00 0.00 0.00 175.10 176.19 1sr4 s VAL 91 N -1.22 3.22 0.00 2.92 1.01 -1.26 -3.00 120.40 122.06 1sr4 s VAL 91 Ca 0.49 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1sr4 s VAL 91 Cb -0.34 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1sr4 s VAL 91 CO 0.44 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1sr4 n GLY 92 N 3.66 0.42 3.19 4.51 0.00 -1.26 -5.02 105.19 110.70 1sr4 n GLY 92 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 1sr4 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sr4 s ALA 93 N -1.90 -0.47 -0.17 4.61 0.00 -1.16 -5.03 121.76 117.63 1sr4 s ALA 93 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 51.96 51.79 1sr4 s ALA 93 Cb 0.00 0.24 -0.07 0.00 0.00 0.00 0.00 23.12 23.29 1sr4 s ALA 93 CO 0.00 -0.34 2.92 0.00 0.00 0.00 0.00 175.76 178.34 1sr4 n ALA 94 N 0.82 5.87 -2.38 0.00 0.00 -1.26 -4.29 120.51 119.28 1sr4 n ALA 94 Ca -0.20 -1.88 -0.30 0.00 0.00 0.00 0.00 53.44 51.07 1sr4 n ALA 94 Cb 0.58 -1.94 -0.14 0.00 0.00 0.00 0.00 19.45 17.95 1sr4 n ALA 94 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1sr4 s LYS 95 N -0.30 1.59 0.04 0.00 -0.14 -1.26 -2.54 119.74 117.13 1sr4 s LYS 95 Ca 0.50 -1.24 0.03 0.00 -1.36 0.00 0.00 55.97 53.90 1sr4 s LYS 95 Cb 0.28 -1.95 -0.02 0.00 -1.68 0.00 0.00 37.83 34.46 1sr4 s LYS 95 CO -0.07 0.48 -0.08 0.00 -0.76 0.00 0.00 175.35 174.92 1sr4 n PHE 97 N 1.66 1.69 -3.49 0.00 7.35 0.28 -1.43 117.46 123.52 1sr4 n PHE 97 Ca -0.21 0.63 -0.11 0.00 -0.76 0.00 0.00 57.45 57.00 1sr4 n PHE 97 Cb 0.55 -2.32 -0.03 0.00 0.35 0.00 0.00 39.48 38.03 1sr4 n PHE 97 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1sr4 s ALA 98 N -0.95 -1.76 -1.29 3.13 0.00 -0.34 -4.47 121.76 116.08 1sr4 s ALA 98 Ca 0.59 0.94 -0.06 0.00 0.00 0.00 0.00 51.96 53.42 1sr4 s ALA 98 Cb -0.66 0.41 0.06 0.00 0.00 0.00 0.00 23.12 22.94 1sr4 s ALA 98 CO 0.60 -0.64 2.56 1.19 0.00 0.00 0.00 175.76 179.46 1sr4 n PHE 99 N -0.08 2.43 -3.90 0.00 3.72 -1.26 -3.87 117.46 114.50 1sr4 n PHE 99 Ca -0.12 -2.78 -0.10 0.00 -0.05 0.00 0.00 57.45 54.39 1sr4 n PHE 99 Cb 0.62 -1.93 -0.09 0.00 -0.94 0.00 0.00 39.48 37.14 1sr4 n PHE 99 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1sr4 s LEU 100 N -1.63 1.64 0.00 4.37 1.43 -1.26 -5.03 118.68 118.20 1sr4 s LEU 100 Ca 0.58 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 1sr4 s LEU 100 Cb 0.20 0.72 0.00 0.00 0.03 0.00 0.00 46.19 47.14 1sr4 s LEU 100 CO -0.10 -0.51 0.00 0.61 0.23 0.00 0.00 176.35 176.58 1sr4 n GLY 101 N 0.81 2.82 1.65 -3.19 0.00 -1.26 -0.66 105.19 105.36 1sr4 n GLY 101 Ca -0.19 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.05 1sr4 n GLY 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sr4 n LYS 102 N 14.00 4.12 0.00 1.61 4.76 -1.26 -4.87 118.16 136.52 1sr4 n LYS 102 Ca 0.00 -2.74 0.00 0.00 -2.87 0.00 0.00 58.31 52.70 1sr4 n LYS 102 Cb 0.00 -2.06 0.00 0.00 -1.84 0.00 0.00 35.03 31.13 1sr4 n LYS 102 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1sr4 n GLY 103 N 0.76 1.33 3.26 0.72 0.00 0.17 -4.52 105.19 106.91 1sr4 n GLY 103 Ca 0.24 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.17 1sr4 n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sr4 s THR 104 N -1.98 0.11 0.33 2.61 -4.23 -1.22 -1.20 115.64 110.06 1sr4 s THR 104 Ca 0.00 -1.29 -0.12 0.00 -1.18 0.00 0.00 61.69 59.10 1sr4 s THR 104 Cb 0.00 -1.58 0.02 0.00 1.34 0.00 0.00 72.50 72.28 1sr4 s THR 104 CO 0.00 -0.48 0.62 0.28 -0.54 0.00 0.00 174.62 174.50 1sr4 s THR 105 N -3.91 0.00 0.24 3.99 -1.32 -0.51 -4.63 115.64 109.49 1sr4 s THR 105 Ca 0.11 -1.26 -0.31 0.00 -1.21 0.00 0.00 61.69 59.01 1sr4 s THR 105 Cb 0.04 -2.53 -0.13 0.00 -1.51 0.00 0.00 72.50 68.37 1sr4 s THR 105 CO -0.06 0.00 1.44 -0.67 -2.21 0.00 0.00 174.62 173.12 1sr4 n ASP 106 N -1.04 2.87 0.29 8.08 -0.08 -1.26 -0.71 116.55 124.70 1sr4 n ASP 106 Ca -0.04 1.14 0.15 0.00 -1.51 0.00 0.00 54.79 54.54 1sr4 n ASP 106 Cb 0.61 -1.44 0.89 0.00 2.34 0.00 0.00 41.12 43.52 1sr4 n ASP 106 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sr4 h LYS 108 N 0.00 0.00 -4.28 0.00 6.56 -1.89 -3.33 116.57 113.63 1sr4 h LYS 108 Ca -0.00 0.00 -0.72 0.00 -1.06 0.00 0.00 60.65 58.87 1sr4 h LYS 108 Cb 0.12 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 31.69 1sr4 h LYS 108 CO 0.00 0.00 2.52 -3.47 -2.06 0.00 0.00 179.45 176.44 1sr4 n ASP 109 N -2.73 4.51 -0.06 0.86 2.03 -0.69 -4.78 116.55 115.69 1sr4 n ASP 109 Ca 0.01 -2.94 0.13 0.00 0.52 0.00 0.00 54.79 52.51 1sr4 n ASP 109 Cb 0.23 -1.62 0.54 0.00 -0.72 0.00 0.00 41.12 39.55 1sr4 n ASP 109 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1sr4 h THR 110 N 4.28 0.87 -0.11 5.18 1.35 -1.85 -1.55 112.91 121.09 1sr4 h THR 110 Ca 0.48 -0.11 0.03 0.00 -0.55 0.00 0.00 66.41 66.26 1sr4 h THR 110 Cb 0.70 0.52 -0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1sr4 h THR 110 CO 1.68 0.06 0.08 0.44 -0.25 0.00 0.00 175.52 177.54 1sr4 h ASP 111 N 0.33 0.00 -0.00 5.36 5.19 -1.93 -1.28 116.42 124.08 1sr4 h ASP 111 Ca 0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 1sr4 h ASP 111 Cb 0.60 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.11 1sr4 h ASP 111 CO -0.06 0.00 -0.60 1.41 -3.12 0.00 0.00 179.24 176.87 1sr4 n HIS 112 N -4.45 0.00 0.17 4.55 8.25 -0.65 -4.57 115.22 118.52 1sr4 n HIS 112 Ca -0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.48 1sr4 n HIS 112 Cb 0.20 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 1sr4 n HIS 112 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1sr4 n THR 113 N -1.08 0.00 -3.18 1.59 -2.24 -0.81 -4.37 114.28 104.19 1sr4 n THR 113 Ca 0.03 -0.30 -0.40 0.00 -2.27 0.00 0.00 64.05 61.11 1sr4 n THR 113 Cb 0.24 0.81 -0.07 0.00 -2.10 0.00 0.00 70.33 69.22 1sr4 n THR 113 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1sr4 s VAL 114 N -1.76 5.04 0.49 2.28 1.01 -0.52 -4.45 120.40 122.50 1sr4 s VAL 114 Ca 0.01 1.04 0.04 0.00 0.00 0.00 0.00 61.98 63.07 1sr4 s VAL 114 Cb 0.04 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1sr4 s VAL 114 CO 0.22 0.10 0.13 -0.36 0.00 0.00 0.00 175.10 175.19 1sr4 s PHE 115 N 2.11 2.03 -0.16 5.22 0.08 0.84 -1.47 117.98 126.62 1sr4 s PHE 115 Ca 0.25 -0.83 -0.02 0.00 0.12 0.00 0.00 56.93 56.45 1sr4 s PHE 115 Cb -0.16 -1.77 0.05 0.00 -0.57 0.00 0.00 43.02 40.58 1sr4 s PHE 115 CO 0.09 0.08 0.02 1.21 -0.10 0.00 0.00 175.22 176.52 1sr4 s ASN 116 N -3.96 2.62 -0.16 1.36 2.47 0.33 -0.38 114.94 117.23 1sr4 s ASN 116 Ca 0.22 -0.65 -0.28 0.00 0.42 0.00 0.00 52.86 52.58 1sr4 s ASN 116 Cb 0.02 -0.61 -0.01 0.00 -1.45 0.00 0.00 41.25 39.21 1sr4 s ASN 116 CO 0.13 -0.27 0.94 -0.76 -3.72 0.00 0.00 177.10 173.42 1sr4 s LEU 117 N 1.85 4.18 -0.28 3.21 1.43 0.03 -1.39 118.68 127.71 1sr4 s LEU 117 Ca 0.00 1.34 -0.04 0.00 -1.03 0.00 0.00 54.13 54.41 1sr4 s LEU 117 Cb -0.16 -3.41 0.03 0.00 0.03 0.00 0.00 46.19 42.68 1sr4 s LEU 117 CO -0.07 -0.48 0.02 -0.63 0.23 0.00 0.00 176.35 175.42 1sr4 s ILE 118 N 2.34 3.38 0.71 -0.59 -1.09 -0.63 -1.26 121.20 124.06 1sr4 s ILE 118 Ca 0.43 -0.98 -0.11 0.00 -2.23 0.00 0.00 60.65 57.76 1sr4 s ILE 118 Cb -0.17 -2.78 0.02 0.00 -1.58 0.00 0.00 42.46 37.95 1sr4 s ILE 118 CO 0.13 0.07 1.07 -2.16 -1.23 0.00 0.00 174.94 172.82 1sr4 s PRO 119 N 1.38 2.72 0.30 2.79 0.04 -1.26 -1.76 135.00 139.21 1sr4 s PRO 119 Ca -0.00 1.08 0.03 0.00 0.04 0.00 0.00 61.00 62.15 1sr4 s PRO 119 Cb -0.18 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 1sr4 s PRO 119 CO -0.01 -1.28 0.15 0.95 0.04 0.00 0.00 177.00 176.85 1sr4 s THR 120 N -2.90 0.39 -1.93 1.26 -4.23 -1.19 -4.87 115.64 102.17 1sr4 s THR 120 Ca 0.60 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.36 1sr4 s THR 120 Cb -0.16 -2.53 0.68 0.00 1.34 0.00 0.00 72.50 71.83 1sr4 s THR 120 CO 0.53 0.00 1.85 -0.46 -0.54 0.00 0.00 174.62 176.00 1sr4 n ASN 121 N -0.88 0.00 -0.00 3.99 6.94 -1.26 -3.27 115.26 120.78 1sr4 n ASN 121 Ca 0.01 -0.70 0.04 0.00 -0.02 0.00 0.00 54.58 53.91 1sr4 n ASN 121 Cb 0.65 -0.03 -0.06 0.00 -2.36 0.00 0.00 39.78 37.98 1sr4 n ASN 121 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1sr4 n THR 122 N -1.03 0.00 0.00 5.53 -2.24 -1.26 -4.99 114.28 110.29 1sr4 n THR 122 Ca 0.18 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1sr4 n THR 122 Cb 0.10 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1sr4 n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sr4 n GLY 123 N 1.43 0.55 3.87 3.38 0.00 -1.20 -5.06 105.19 108.15 1sr4 n GLY 123 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1sr4 n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sr4 s ALA 124 N -2.13 2.79 0.10 4.61 0.00 -1.26 -4.84 121.76 121.03 1sr4 s ALA 124 Ca 0.00 -0.31 0.08 0.00 0.00 0.00 0.00 51.96 51.72 1sr4 s ALA 124 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1sr4 s ALA 124 CO 0.00 -1.23 -0.20 -0.06 0.00 0.00 0.00 175.76 174.28 1sr4 s PHE 125 N -3.32 1.70 0.08 0.00 0.08 -0.38 -3.15 117.98 112.98 1sr4 s PHE 125 Ca 0.59 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 57.21 1sr4 s PHE 125 Cb -0.12 -0.93 -0.04 0.00 -0.57 0.00 0.00 43.02 41.36 1sr4 s PHE 125 CO 0.52 0.18 0.23 -0.51 -0.10 0.00 0.00 175.22 175.54 1sr4 s LEU 126 N -1.90 4.35 -0.09 -0.37 1.02 -0.72 -0.18 118.68 120.79 1sr4 s LEU 126 Ca 0.05 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.47 1sr4 s LEU 126 Cb -0.10 -2.96 0.02 0.00 0.02 0.00 0.00 46.19 43.17 1sr4 s LEU 126 CO 0.04 0.15 -0.06 -0.63 0.02 0.00 0.00 176.35 175.86 1sr4 s ILE 127 N -1.55 0.85 0.28 -0.59 1.01 -1.26 -1.60 121.20 118.34 1sr4 s ILE 127 Ca 0.35 -0.22 0.09 0.00 0.00 0.00 0.00 60.65 60.88 1sr4 s ILE 127 Cb -0.13 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 1sr4 s ILE 127 CO 0.28 0.33 0.02 -0.54 0.00 0.00 0.00 174.94 175.03 1sr4 s LYS 128 N 1.49 2.31 0.25 2.79 1.02 -0.48 -0.30 119.74 126.82 1sr4 s LYS 128 Ca -0.00 -1.44 -0.17 0.00 0.02 0.00 0.00 55.97 54.39 1sr4 s LYS 128 Cb -0.13 -2.16 -0.08 0.00 -0.52 0.00 0.00 37.83 34.93 1sr4 s LYS 128 CO -0.05 0.33 0.69 0.16 -0.92 0.00 0.00 175.35 175.56 1sr4 s ASP 129 N -3.70 6.89 0.22 2.83 -4.77 -0.64 0.12 116.67 117.63 1sr4 s ASP 129 Ca 0.32 1.29 0.00 0.00 -3.30 0.00 0.00 52.55 50.87 1sr4 s ASP 129 Cb -0.06 -2.37 0.22 0.00 -1.09 0.00 0.00 42.92 39.62 1sr4 s ASP 129 CO 0.20 -0.05 1.57 0.00 0.70 0.00 0.00 175.17 177.59 1sr4 h ALA 130 N 2.95 0.83 0.02 2.11 0.00 -1.54 -2.24 119.26 121.39 1sr4 h ALA 130 Ca -0.48 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 53.94 1sr4 h ALA 130 Cb 1.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1sr4 h ALA 130 CO 0.66 0.67 -0.01 1.25 0.00 0.00 0.00 179.25 181.82 1sr4 h LEU 131 N 0.35 -0.03 0.00 0.00 5.85 -1.80 -3.38 115.31 116.30 1sr4 h LEU 131 Ca 0.01 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1sr4 h LEU 131 Cb 1.01 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1sr4 h LEU 131 CO 0.09 0.43 -1.75 0.18 -0.34 0.00 0.00 178.44 177.05 1sr4 n LEU 132 N -4.88 0.18 -0.44 2.25 4.77 -1.26 -4.99 117.00 112.62 1sr4 n LEU 132 Ca -0.08 -0.09 -0.05 0.00 -0.03 0.00 0.00 56.01 55.75 1sr4 n LEU 132 Cb 0.24 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.31 1sr4 n LEU 132 CO 0.33 0.04 -0.05 0.61 -1.33 0.00 0.00 177.39 176.99 1sr4 n GLY 133 N 1.36 0.65 3.91 -0.72 0.00 -0.84 -5.02 105.19 104.53 1sr4 n GLY 133 Ca -0.02 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 44.94 1sr4 n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sr4 s PHE 134 N -2.21 3.33 -0.05 1.61 0.40 -1.26 -4.64 117.98 115.16 1sr4 s PHE 134 Ca 0.00 0.68 -0.01 0.00 -0.60 0.00 0.00 56.93 57.00 1sr4 s PHE 134 Cb 0.00 -2.63 -0.04 0.00 0.51 0.00 0.00 43.02 40.86 1sr4 s PHE 134 CO 0.00 -0.69 0.04 0.00 0.70 0.00 0.00 175.22 175.27 1sr4 s ILE 136 N -1.04 5.01 0.15 0.00 1.01 0.59 -1.02 121.20 125.91 1sr4 s ILE 136 Ca 0.18 1.43 0.05 0.00 0.00 0.00 0.00 60.65 62.31 1sr4 s ILE 136 Cb -0.12 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 1sr4 s ILE 136 CO 0.08 0.18 -0.10 0.42 0.00 0.00 0.00 174.94 175.52 1sr4 s THR 137 N 1.25 1.19 -0.23 2.92 -4.23 0.08 -4.63 115.64 111.98 1sr4 s THR 137 Ca 0.36 -2.07 -0.03 0.00 -1.18 0.00 0.00 61.69 58.78 1sr4 s THR 137 Cb -0.17 -1.88 0.11 0.00 1.34 0.00 0.00 72.50 71.91 1sr4 s THR 137 CO 0.16 -0.72 0.27 -0.55 -0.54 0.00 0.00 174.62 173.23 1sr4 s SER 138 N -3.18 1.23 0.00 3.99 0.15 -0.06 -1.98 113.70 113.85 1sr4 s SER 138 Ca 0.17 -0.27 0.24 0.00 0.70 0.00 0.00 55.95 56.80 1sr4 s SER 138 Cb 0.03 0.56 0.25 0.00 -1.71 0.00 0.00 66.02 65.15 1sr4 s SER 138 CO 0.01 -0.34 1.26 1.41 1.20 0.00 0.00 173.24 176.79 1sr4 n HIS 139 N 5.33 0.00 -3.74 3.44 8.25 -1.26 -4.43 115.22 122.80 1sr4 n HIS 139 Ca -0.04 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.41 1sr4 n HIS 139 Cb 0.49 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.58 1sr4 n HIS 139 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1sr4 s ASP 140 N -2.30 -0.09 0.12 0.41 2.15 -1.26 -5.04 116.67 110.66 1sr4 s ASP 140 Ca 0.24 -0.34 -0.35 0.00 0.43 0.00 0.00 52.55 52.53 1sr4 s ASP 140 Cb 0.19 0.34 -0.17 0.00 -0.30 0.00 0.00 42.92 42.99 1sr4 s ASP 140 CO 0.47 -0.65 1.10 0.49 -0.17 0.00 0.00 175.17 176.40 1sr4 n PHE 141 N -0.55 0.98 -2.56 -5.34 3.72 -1.26 -1.62 117.46 110.83 1sr4 n PHE 141 Ca -0.06 0.79 -0.08 0.00 -0.05 0.00 0.00 57.45 58.06 1sr4 n PHE 141 Cb 0.61 -2.21 -0.00 0.00 -0.94 0.00 0.00 39.48 36.94 1sr4 n PHE 141 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1sr4 n ASP 142 N 1.98 -2.52 -4.52 4.37 8.00 -1.26 -4.92 116.55 117.69 1sr4 n ASP 142 Ca 0.17 0.28 -0.35 0.00 0.71 0.00 0.00 54.79 55.60 1sr4 n ASP 142 Cb 0.20 -2.21 -0.12 0.00 -0.02 0.00 0.00 41.12 38.98 1sr4 n ASP 142 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1sr4 s ASP 143 N -2.07 5.13 -0.23 -2.24 2.15 -0.64 -5.08 116.67 113.68 1sr4 s ASP 143 Ca 0.04 -0.10 -0.04 0.00 0.43 0.00 0.00 52.55 52.88 1sr4 s ASP 143 Cb -0.02 -1.88 0.12 0.00 -0.30 0.00 0.00 42.92 40.84 1sr4 s ASP 143 CO 0.04 0.11 0.41 -0.22 -0.17 0.00 0.00 175.17 175.34 1sr4 s LEU 144 N 0.76 -0.69 0.15 -1.34 2.96 -1.26 -4.41 118.68 114.85 1sr4 s LEU 144 Ca 0.01 0.57 -0.03 0.00 -0.22 0.00 0.00 54.13 54.47 1sr4 s LEU 144 Cb -0.14 1.28 -0.03 0.00 0.50 0.00 0.00 46.19 47.80 1sr4 s LEU 144 CO 0.02 -0.27 0.12 -1.59 -1.32 0.00 0.00 176.35 173.31 1sr4 s LYS 145 N 2.59 1.02 -0.34 1.98 -2.85 -0.84 -5.00 119.74 116.31 1sr4 s LYS 145 Ca 0.08 -1.40 -0.02 0.00 -1.00 0.00 0.00 55.97 53.62 1sr4 s LYS 145 Cb -0.14 0.28 0.07 0.00 -2.06 0.00 0.00 37.83 35.98 1sr4 s LYS 145 CO -0.15 -0.32 0.08 -1.17 0.10 0.00 0.00 175.35 173.89 1sr4 s LEU 146 N -3.04 4.44 0.20 2.77 2.96 -1.26 -0.74 118.68 124.00 1sr4 s LEU 146 Ca 0.24 -1.58 0.10 0.00 -0.22 0.00 0.00 54.13 52.67 1sr4 s LEU 146 Cb 0.06 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 1sr4 s LEU 146 CO 0.03 -0.37 -0.19 -1.83 -1.32 0.00 0.00 176.35 172.67 1sr4 s GLU 147 N 1.20 1.42 0.33 1.98 -1.05 -0.19 -4.87 118.70 117.53 1sr4 s GLU 147 Ca 0.01 -1.53 -0.29 0.00 -0.15 0.00 0.00 54.97 53.00 1sr4 s GLU 147 Cb -0.21 -1.51 -0.12 0.00 -0.44 0.00 0.00 34.13 31.85 1sr4 s GLU 147 CO -0.02 0.30 1.46 -2.30 0.95 0.00 0.00 175.26 175.64 1sr4 n PRO 148 N 0.01 2.48 -1.81 -4.83 -0.02 -1.26 -0.73 135.00 128.83 1sr4 n PRO 148 Ca -0.11 0.87 0.01 0.00 -2.02 0.00 0.00 63.50 62.25 1sr4 n PRO 148 Cb 0.58 -2.57 0.06 0.00 -0.02 0.00 0.00 33.50 31.54 1sr4 n PRO 148 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sr4 n GLY 150 N -0.18 -1.06 0.00 0.00 0.00 -1.26 -4.86 105.19 97.83 1sr4 n GLY 150 Ca 0.12 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1sr4 n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sr4 n GLY 151 N 0.00 1.19 3.56 -0.02 0.00 -1.26 -4.95 105.19 103.71 1sr4 n GLY 151 Ca 0.00 -1.56 -0.47 0.00 0.00 0.00 0.00 46.02 43.99 1sr4 n GLY 151 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sr4 n SER 152 N 0.00 0.94 -0.50 1.61 2.88 -1.26 -4.86 113.62 112.43 1sr4 n SER 152 Ca 0.00 1.16 0.13 0.00 -1.33 0.00 0.00 58.87 58.83 1sr4 n SER 152 Cb 0.00 -1.20 0.49 0.00 -0.75 0.00 0.00 64.21 62.75 1sr4 n SER 152 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1sr4 n VAL 153 N 0.80 0.04 -1.66 2.46 0.24 -1.26 -4.93 118.33 114.02 1sr4 n VAL 153 Ca 0.13 -0.27 -0.49 0.00 -2.04 0.00 0.00 64.34 61.67 1sr4 n VAL 153 Cb 0.27 0.49 -0.05 0.00 -1.47 0.00 0.00 33.84 33.09 1sr4 n VAL 153 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1sr4 n SER 154 N 0.22 2.77 0.00 -1.34 7.64 -1.26 -1.70 113.62 119.96 1sr4 n SER 154 Ca 0.18 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.13 1sr4 n SER 154 Cb 0.36 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 1sr4 n SER 154 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sr4 n GLY 155 N 3.47 0.47 3.92 0.23 0.00 -1.26 -5.00 105.19 107.02 1sr4 n GLY 155 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1sr4 n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sr4 s ARG 156 N -0.58 3.56 -0.00 1.61 0.52 -0.69 -5.09 118.95 118.27 1sr4 s ARG 156 Ca 0.00 -0.18 -0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1sr4 s ARG 156 Cb 0.00 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.73 1sr4 s ARG 156 CO 0.00 0.24 0.07 0.95 0.02 0.00 0.00 175.30 176.58 1sr4 s THR 157 N -2.09 4.62 0.01 0.02 -4.23 -1.26 -5.09 115.64 107.62 1sr4 s THR 157 Ca 0.41 -0.45 0.01 0.00 -1.18 0.00 0.00 61.69 60.49 1sr4 s THR 157 Cb -0.10 -3.10 -0.01 0.00 1.34 0.00 0.00 72.50 70.62 1sr4 s THR 157 CO 0.31 0.36 -0.05 -0.36 -0.54 0.00 0.00 174.62 174.34 1sr4 s PHE 158 N -1.17 0.43 0.91 3.99 0.08 -1.26 -5.16 117.98 115.80 1sr4 s PHE 158 Ca 0.22 -0.27 -0.12 0.00 0.12 0.00 0.00 56.93 56.88 1sr4 s PHE 158 Cb -0.12 -0.27 0.14 0.00 -0.57 0.00 0.00 43.02 42.20 1sr4 s PHE 158 CO 0.13 -0.06 1.13 -1.54 -0.10 0.00 0.00 175.22 174.78 1sr4 s SER 159 N -0.76 3.48 0.63 1.36 1.04 -1.26 -4.93 113.70 113.27 1sr4 s SER 159 Ca -0.05 1.02 0.35 0.00 0.48 0.00 0.00 55.95 57.75 1sr4 s SER 159 Cb -0.05 -1.62 1.99 0.00 0.10 0.00 0.00 66.02 66.44 1sr4 s SER 159 CO -0.00 -2.57 2.23 -0.07 0.98 0.00 0.00 173.24 173.81 1sr4 h LEU 160 N -1.51 0.00 -2.47 2.42 3.38 -1.95 -2.09 115.31 113.10 1sr4 h LEU 160 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1sr4 h LEU 160 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 1sr4 h LEU 160 CO 0.61 0.00 0.01 0.00 0.09 0.00 0.00 178.44 179.15 1sr4 h ALA 161 N 1.89 1.53 -0.01 1.53 0.00 -1.92 -1.06 119.26 121.22 1sr4 h ALA 161 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1sr4 h ALA 161 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1sr4 h ALA 161 CO -0.00 -0.01 -0.46 0.66 0.00 0.00 0.00 179.25 179.43 1sr4 n TYR 162 N -3.84 0.00 -3.81 0.00 4.01 -0.78 -0.88 117.16 111.86 1sr4 n TYR 162 Ca -0.03 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.34 1sr4 n TYR 162 Cb 0.09 -0.03 -0.06 0.00 -0.31 0.00 0.00 39.34 39.03 1sr4 n TYR 162 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1sr4 s GLN 163 N -2.53 3.53 0.02 -0.72 -0.21 -0.40 -4.37 119.66 114.97 1sr4 s GLN 163 Ca 0.19 -0.05 0.05 0.00 0.02 0.00 0.00 55.36 55.57 1sr4 s GLN 163 Cb 0.18 -3.18 -0.02 0.00 1.00 0.00 0.00 33.01 30.99 1sr4 s GLN 163 CO 0.58 0.75 -0.15 -1.58 -2.12 0.00 0.00 175.29 172.77 1sr4 s TRP 164 N -1.07 1.34 -0.18 0.91 0.52 0.75 -1.43 118.94 119.77 1sr4 s TRP 164 Ca 0.18 -0.32 -0.06 0.00 0.02 0.00 0.00 56.10 55.92 1sr4 s TRP 164 Cb -0.13 -0.82 -0.03 0.00 -1.15 0.00 0.00 33.47 31.34 1sr4 s TRP 164 CO 0.07 0.02 0.02 0.20 0.02 0.00 0.00 176.95 177.28 1sr4 s GLY 165 N -0.88 1.80 -0.62 0.98 0.00 0.72 -1.24 107.32 108.08 1sr4 s GLY 165 Ca 0.04 -0.84 -0.16 0.00 0.00 0.00 0.00 44.72 43.75 1sr4 s GLY 165 CO 0.01 0.08 0.60 -0.42 0.00 0.00 0.00 173.10 173.37 1sr4 s ILE 166 N 0.58 5.24 0.45 0.90 1.09 -1.26 -1.85 121.20 126.34 1sr4 s ILE 166 Ca 0.00 -1.65 0.05 0.00 -1.10 0.00 0.00 60.65 57.96 1sr4 s ILE 166 Cb -0.14 -4.40 -0.05 0.00 -1.06 0.00 0.00 42.46 36.82 1sr4 s ILE 166 CO 0.02 -0.95 0.07 -0.76 -0.10 0.00 0.00 174.94 173.22 1sr4 s LEU 167 N 1.45 2.76 0.62 2.97 1.43 -0.64 -4.96 118.68 122.31 1sr4 s LEU 167 Ca 0.08 -1.38 -0.18 0.00 -1.03 0.00 0.00 54.13 51.62 1sr4 s LEU 167 Cb -0.24 -0.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.95 1sr4 s LEU 167 CO 0.01 -0.63 1.05 -2.65 0.23 0.00 0.00 176.35 174.36 1sr4 n PRO 168 N -1.16 0.95 -2.17 1.29 -0.02 -1.26 -0.86 135.00 131.76 1sr4 n PRO 168 Ca -0.08 0.37 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 1sr4 n PRO 168 Cb 0.66 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 1sr4 n PRO 168 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1sr4 s PRO 169 N -2.92 4.34 0.41 0.52 0.04 -1.26 -3.84 135.00 132.29 1sr4 s PRO 169 Ca 0.78 2.08 -0.27 0.00 0.04 0.00 0.00 61.00 63.63 1sr4 s PRO 169 Cb -0.41 -3.22 -0.10 0.00 0.04 0.00 0.00 34.50 30.82 1sr4 s PRO 169 CO 0.45 -0.38 1.45 0.12 0.04 0.00 0.00 177.00 178.69 1sr4 s PHE 170 N 0.73 2.53 -3.42 0.56 5.36 -1.26 -4.85 117.98 117.63 1sr4 s PHE 170 Ca 0.62 1.22 0.00 0.00 -0.96 0.00 0.00 56.93 57.81 1sr4 s PHE 170 Cb -0.37 -3.97 0.00 0.00 -0.34 0.00 0.00 43.02 38.34 1sr4 s PHE 170 CO 0.33 -2.94 0.00 0.41 -1.46 0.00 0.00 175.22 171.56 1sr4 n GLY 171 N 0.52 0.81 3.81 13.12 0.00 -1.26 -4.83 105.19 117.37 1sr4 n GLY 171 Ca 0.03 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 1sr4 n GLY 171 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1sr4 s PRO 172 N -1.37 2.84 0.06 1.61 0.04 -1.26 -5.07 135.00 131.84 1sr4 s PRO 172 Ca 0.00 1.00 -0.26 0.00 0.04 0.00 0.00 61.00 61.78 1sr4 s PRO 172 Cb 0.00 -1.98 0.09 0.00 0.04 0.00 0.00 34.50 32.65 1sr4 s PRO 172 CO 0.00 -1.18 0.76 -1.54 0.04 0.00 0.00 177.00 175.08 1sr4 s SER 173 N -3.68 -0.47 -0.09 6.66 1.04 -1.26 -5.11 113.70 110.80 1sr4 s SER 173 Ca 0.59 0.05 0.03 0.00 0.48 0.00 0.00 55.95 57.09 1sr4 s SER 173 Cb -0.15 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.44 1sr4 s SER 173 CO 0.54 -0.76 -0.16 -0.75 0.98 0.00 0.00 173.24 173.09 1sr4 s LYS 174 N -3.22 2.89 0.19 4.02 2.20 -1.26 -5.08 119.74 119.48 1sr4 s LYS 174 Ca 0.02 -0.73 -0.32 0.00 -0.36 0.00 0.00 55.97 54.58 1sr4 s LYS 174 Cb -0.01 -2.44 -0.12 0.00 -1.51 0.00 0.00 37.83 33.75 1sr4 s LYS 174 CO -0.09 0.40 1.75 -0.89 -0.36 0.00 0.00 175.35 176.15 1sr4 n ILE 175 N 2.96 0.08 -2.41 5.43 2.08 -1.26 -4.93 119.36 121.31 1sr4 n ILE 175 Ca -0.18 -0.01 -0.41 0.00 0.56 0.00 0.00 62.75 62.71 1sr4 n ILE 175 Cb 0.52 -2.01 -0.03 0.00 -0.75 0.00 0.00 39.64 37.37 1sr4 n ILE 175 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1sr4 s LEU 176 N 1.50 4.45 -0.14 1.39 1.43 -1.26 -5.03 118.68 121.01 1sr4 s LEU 176 Ca 0.77 2.17 0.02 0.00 -1.03 0.00 0.00 54.13 56.06 1sr4 s LEU 176 Cb -0.50 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.13 1sr4 s LEU 176 CO 0.33 -0.35 -0.20 -0.63 0.23 0.00 0.00 176.35 175.73 1sr4 s ILE 177 N 0.06 1.96 -2.00 -0.59 1.01 -1.26 -5.35 121.20 115.03 1sr4 s ILE 177 Ca 0.53 -0.91 0.19 0.00 0.00 0.00 0.00 60.65 60.46 1sr4 s ILE 177 Cb -0.31 -1.75 0.55 0.00 0.01 0.00 0.00 42.46 40.96 1sr4 s ILE 177 CO 0.35 0.53 1.55 -0.81 0.00 0.00 0.00 174.94 176.56