#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x2t s PHE 3 N 0.00 2.86 -0.30 1.61 5.36 -1.25 -4.51 117.98 121.76 2x2t s PHE 3 Ca 0.00 0.78 0.07 0.00 -0.96 0.00 0.00 56.93 56.82 2x2t s PHE 3 Cb 0.00 -4.33 0.46 0.00 -0.34 0.00 0.00 43.02 38.81 2x2t s PHE 3 CO 0.00 -1.20 1.18 1.63 -1.46 0.00 0.00 175.22 175.37 2x2t n LYS 4 N 7.70 3.57 0.00 10.12 4.76 -1.26 -5.10 118.16 137.95 2x2t n LYS 4 Ca 0.12 -4.17 0.00 0.00 -2.87 0.00 0.00 58.31 51.39 2x2t n LYS 4 Cb 0.49 -2.26 0.00 0.00 -1.84 0.00 0.00 35.03 31.41 2x2t n LYS 4 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2x2t n GLY 5 N -0.70 -0.93 3.72 0.72 0.00 -1.26 -4.95 105.19 101.80 2x2t n GLY 5 Ca 0.43 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.46 2x2t n GLY 5 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2x2t n VAL 6 N 0.00 3.45 -0.39 1.61 0.24 -1.26 -4.92 118.33 117.07 2x2t n VAL 6 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2x2t n VAL 6 Cb 0.00 -1.61 0.00 0.00 -1.47 0.00 0.00 33.84 30.76 2x2t n VAL 6 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x2t n GLY 7 N 0.80 -2.09 3.72 7.63 0.00 -1.06 -5.01 105.19 109.19 2x2t n GLY 7 Ca 0.09 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 2x2t n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x2t s THR 8 N -1.94 5.02 0.03 2.61 2.01 -1.26 -1.01 115.64 121.11 2x2t s THR 8 Ca 0.00 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.04 2x2t s THR 8 Cb 0.00 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 2x2t s THR 8 CO 0.00 0.51 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.09 2x2t s TYR 9 N -0.10 0.36 0.14 4.92 2.02 -0.10 -0.41 117.35 124.18 2x2t s TYR 9 Ca 0.08 -0.65 -0.26 0.00 -0.37 0.00 0.00 57.07 55.87 2x2t s TYR 9 Cb -0.12 -0.26 -0.07 0.00 -0.40 0.00 0.00 41.96 41.11 2x2t s TYR 9 CO 0.01 -0.22 0.80 -1.21 -1.57 0.00 0.00 175.55 173.36 2x2t s GLU 10 N -2.03 4.59 -0.30 -0.62 2.02 -0.54 -1.19 118.70 120.64 2x2t s GLU 10 Ca -0.10 1.19 -0.06 0.00 0.02 0.00 0.00 54.97 56.02 2x2t s GLU 10 Cb -0.06 -3.29 0.01 0.00 0.10 0.00 0.00 34.13 30.89 2x2t s GLU 10 CO -0.03 0.48 0.07 0.42 0.02 0.00 0.00 175.26 176.22 2x2t s ILE 11 N -0.85 3.84 -0.16 -1.63 1.01 -1.26 -1.01 121.20 121.14 2x2t s ILE 11 Ca 0.38 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 60.25 2x2t s ILE 11 Cb -0.23 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.25 2x2t s ILE 11 CO 0.26 0.06 -0.18 -0.69 0.00 0.00 0.00 174.94 174.39 2x2t s VAL 12 N 1.47 2.38 0.21 2.92 1.01 -0.08 -0.34 120.40 127.97 2x2t s VAL 12 Ca 0.02 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 2x2t s VAL 12 Cb -0.17 -1.99 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 2x2t s VAL 12 CO 0.02 0.53 1.40 -2.16 0.00 0.00 0.00 175.10 174.89 2x2t s PRO 13 N 0.94 4.31 0.26 2.72 0.04 -1.26 -0.81 135.00 141.20 2x2t s PRO 13 Ca -0.03 2.21 -0.02 0.00 0.04 0.00 0.00 61.00 63.20 2x2t s PRO 13 Cb -0.15 -3.15 0.47 0.00 0.04 0.00 0.00 34.50 31.71 2x2t s PRO 13 CO -0.03 -0.38 1.82 -0.92 0.04 0.00 0.00 177.00 177.52 2x2t h TYR 14 N 5.45 0.98 0.00 0.56 3.20 -1.35 -2.02 116.97 123.79 2x2t h TYR 14 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2x2t h TYR 14 Cb 1.21 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.18 2x2t h TYR 14 CO 0.62 0.39 0.00 1.04 -1.64 0.00 0.00 178.16 178.57 2x2t n GLN 15 N -4.69 0.13 -3.09 1.82 6.02 -1.26 -4.37 117.38 111.93 2x2t n GLN 15 Ca 0.16 0.17 -0.18 0.00 -0.01 0.00 0.00 57.00 57.14 2x2t n GLN 15 Cb 0.32 -1.67 -0.04 0.00 1.02 0.00 0.00 30.24 29.86 2x2t n GLN 15 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2x2t n ALA 16 N -1.65 1.09 1.32 -1.58 0.00 -0.76 -4.88 120.51 114.05 2x2t n ALA 16 Ca 0.05 -2.53 0.11 0.00 0.00 0.00 0.00 53.44 51.08 2x2t n ALA 16 Cb 0.34 -1.01 0.63 0.00 0.00 0.00 0.00 19.45 19.42 2x2t n ALA 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2x2t n PRO 17 N 2.15 0.62 0.00 0.00 -0.04 -1.21 -1.60 135.00 134.93 2x2t n PRO 17 Ca 0.21 0.01 0.15 0.00 -0.04 0.00 0.00 63.50 63.83 2x2t n PRO 17 Cb 0.54 -1.50 0.76 0.00 -0.04 0.00 0.00 33.50 33.26 2x2t n PRO 17 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2x2t n SER 18 N -1.05 0.62 -4.67 3.54 3.41 -1.26 -4.91 113.62 109.31 2x2t n SER 18 Ca 0.15 -1.16 -0.23 0.00 -0.26 0.00 0.00 58.87 57.37 2x2t n SER 18 Cb 0.09 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.96 2x2t n SER 18 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2x2t s LEU 19 N -2.04 3.19 0.27 1.04 1.43 -0.63 -1.25 118.68 120.69 2x2t s LEU 19 Ca 0.42 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 2x2t s LEU 19 Cb 0.21 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 2x2t s LEU 19 CO 0.36 -0.10 0.21 0.54 0.23 0.00 0.00 176.35 177.60 2x2t s ASN 20 N -3.72 0.93 -0.16 2.29 2.20 -0.04 -4.16 114.94 112.27 2x2t s ASN 20 Ca 0.33 -1.57 -0.29 0.00 -0.94 0.00 0.00 52.86 50.39 2x2t s ASN 20 Cb -0.05 0.48 -0.01 0.00 -2.00 0.00 0.00 41.25 39.67 2x2t s ASN 20 CO 0.21 -0.96 1.14 -0.22 -2.94 0.00 0.00 177.10 174.32 2x2t s LEU 21 N -3.27 4.18 -0.09 3.54 2.96 0.54 -1.74 118.68 124.79 2x2t s LEU 21 Ca 0.40 1.59 0.01 0.00 -0.22 0.00 0.00 54.13 55.90 2x2t s LEU 21 Cb 0.04 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.21 2x2t s LEU 21 CO 0.20 -0.65 -0.09 0.21 -1.32 0.00 0.00 176.35 174.69 2x2t s ASN 22 N 1.51 2.00 -0.56 3.68 3.84 0.14 -4.49 114.94 121.05 2x2t s ASN 22 Ca 0.50 -0.30 -0.28 0.00 0.21 0.00 0.00 52.86 53.00 2x2t s ASN 22 Cb -0.20 -0.83 0.02 0.00 -0.55 0.00 0.00 41.25 39.70 2x2t s ASN 22 CO 0.14 -0.06 1.35 0.00 -2.79 0.00 0.00 177.10 175.74 2x2t s ALA 23 N 1.31 2.87 0.17 1.71 0.00 -0.81 -1.39 121.76 125.60 2x2t s ALA 23 Ca -0.03 -0.70 -0.32 0.00 0.00 0.00 0.00 51.96 50.92 2x2t s ALA 23 Cb -0.14 -4.08 -0.11 0.00 0.00 0.00 0.00 23.12 18.79 2x2t s ALA 23 CO -0.04 -2.84 1.75 -0.46 0.00 0.00 0.00 175.76 174.17 2x2t s TRP 24 N 5.73 2.59 0.00 0.00 -0.11 -0.06 -1.65 118.94 125.44 2x2t s TRP 24 Ca 0.50 0.22 0.00 0.00 1.22 0.00 0.00 56.10 58.04 2x2t s TRP 24 Cb -0.10 -4.13 0.00 0.00 -1.50 0.00 0.00 33.47 27.74 2x2t s TRP 24 CO 0.25 -4.45 0.00 0.39 -4.62 0.00 0.00 176.95 168.52 2x2t n GLU 25 N 4.73 0.00 -3.35 5.86 1.02 -1.26 -4.60 120.64 123.04 2x2t n GLU 25 Ca 0.16 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 57.07 2x2t n GLU 25 Cb 0.37 -0.50 0.05 0.00 -0.02 0.00 0.00 31.44 31.34 2x2t n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x2t n GLY 26 N -1.52 -0.53 3.98 0.62 0.00 -0.66 -4.99 105.19 102.09 2x2t n GLY 26 Ca 0.00 0.19 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 2x2t n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x2t s LYS 27 N -6.05 2.89 0.16 1.61 1.02 -1.26 -4.94 119.74 113.17 2x2t s LYS 27 Ca 0.46 -0.80 0.24 0.00 0.02 0.00 0.00 55.97 55.89 2x2t s LYS 27 Cb -0.21 -2.62 0.25 0.00 -0.52 0.00 0.00 37.83 34.73 2x2t s LYS 27 CO 0.57 -0.33 1.27 -0.07 -0.92 0.00 0.00 175.35 175.87 2x2t h LEU 28 N 0.45 0.00 -9.87 3.17 3.38 -1.94 -3.44 115.31 107.06 2x2t h LEU 28 Ca -0.44 -0.14 -0.53 0.00 0.09 0.00 0.00 57.88 56.86 2x2t h LEU 28 Cb 1.27 0.00 0.08 0.00 0.09 0.00 0.00 40.66 42.10 2x2t h LEU 28 CO 0.53 0.07 0.74 -1.83 0.09 0.00 0.00 178.44 178.04 2x2t s GLU 29 N -3.23 4.22 0.72 1.13 -1.05 -1.26 -4.98 118.70 114.26 2x2t s GLU 29 Ca 0.04 2.40 -0.14 0.00 -0.15 0.00 0.00 54.97 57.12 2x2t s GLU 29 Cb 0.12 -3.04 0.03 0.00 -0.44 0.00 0.00 34.13 30.81 2x2t s GLU 29 CO 0.74 -0.41 1.15 -1.25 0.95 0.00 0.00 175.26 176.44 2x2t s PRO 30 N -1.47 2.31 0.00 -4.83 0.04 -1.26 -4.33 135.00 125.46 2x2t s PRO 30 Ca 0.54 1.54 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2x2t s PRO 30 Cb -0.43 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.23 2x2t s PRO 30 CO 0.54 -1.66 0.00 0.41 0.04 0.00 0.00 177.00 176.33 2x2t n GLY 31 N -0.13 1.02 3.73 0.56 0.00 0.73 -4.89 105.19 106.20 2x2t n GLY 31 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2x2t n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x2t n ALA 32 N -1.93 1.73 -1.95 4.61 0.00 -1.25 -4.58 120.51 117.14 2x2t n ALA 32 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 53.44 53.49 2x2t n ALA 32 Cb 0.00 -2.32 0.03 0.00 0.00 0.00 0.00 19.45 17.16 2x2t n ALA 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2x2t s VAL 33 N -1.11 4.06 -0.08 0.00 -7.23 -1.26 -0.79 120.40 113.99 2x2t s VAL 33 Ca 0.55 0.51 0.04 0.00 -1.81 0.00 0.00 61.98 61.27 2x2t s VAL 33 Cb -0.53 -3.64 -0.01 0.00 0.56 0.00 0.00 36.38 32.76 2x2t s VAL 33 CO 0.63 -0.80 -0.20 -0.69 -0.31 0.00 0.00 175.10 173.73 2x2t s VAL 34 N -3.18 2.51 0.18 1.32 1.01 -0.71 -0.89 120.40 120.65 2x2t s VAL 34 Ca 0.55 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2x2t s VAL 34 Cb -0.11 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2x2t s VAL 34 CO 0.51 0.56 0.06 -0.13 0.00 0.00 0.00 175.10 176.10 2x2t s ARG 35 N -0.09 1.11 0.47 2.72 0.52 -0.49 -1.95 118.95 121.24 2x2t s ARG 35 Ca -0.04 -1.56 -0.21 0.00 -0.52 0.00 0.00 55.73 53.40 2x2t s ARG 35 Cb -0.14 0.03 -0.08 0.00 0.52 0.00 0.00 34.95 35.28 2x2t s ARG 35 CO 0.04 -0.26 1.06 0.95 0.02 0.00 0.00 175.30 177.11 2x2t s THR 36 N -3.92 3.66 0.01 0.02 -4.23 -0.38 -0.69 115.64 110.11 2x2t s THR 36 Ca 0.29 1.10 -0.23 0.00 -1.18 0.00 0.00 61.69 61.67 2x2t s THR 36 Cb 0.07 -3.48 0.05 0.00 1.34 0.00 0.00 72.50 70.48 2x2t s THR 36 CO 0.06 -0.17 0.52 -0.47 -0.54 0.00 0.00 174.62 174.03 2x2t s TYR 37 N -1.86 -0.43 0.00 3.99 5.04 -0.71 -0.20 117.35 123.18 2x2t s TYR 37 Ca 0.66 0.59 -0.39 0.00 -2.44 0.00 0.00 57.07 55.49 2x2t s TYR 37 Cb -0.19 0.31 -0.18 0.00 0.35 0.00 0.00 41.96 42.25 2x2t s TYR 37 CO 0.23 -0.59 1.27 2.41 -1.34 0.00 0.00 175.55 177.53 2x2t n THR 38 N 0.68 0.02 -0.07 4.34 -1.04 -1.26 -0.87 114.28 116.08 2x2t n THR 38 Ca -0.19 -0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.71 2x2t n THR 38 Cb 0.59 -0.50 -0.04 0.00 -1.82 0.00 0.00 70.33 68.56 2x2t n THR 38 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2x2t h ARG 39 N 4.11 0.34 -0.38 -2.82 3.08 -1.47 -3.44 114.38 113.80 2x2t h ARG 39 Ca -0.49 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 59.54 2x2t h ARG 39 Cb 1.37 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.35 2x2t h ARG 39 CO 0.75 0.40 -0.10 0.41 -1.07 0.00 0.00 179.97 180.36 2x2t n GLY 40 N -0.69 -2.05 0.32 0.04 0.00 -1.26 -3.98 105.19 97.58 2x2t n GLY 40 Ca -0.03 -1.45 -0.04 0.00 0.00 0.00 0.00 46.02 44.49 2x2t n GLY 40 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2x2t h ASP 41 N -0.16 0.93 -3.44 1.61 3.32 -2.00 -3.38 116.42 113.29 2x2t h ASP 41 Ca -0.01 -0.15 -0.60 0.00 0.02 0.00 0.00 57.03 56.30 2x2t h ASP 41 Cb 0.15 -0.24 -0.37 0.00 0.22 0.00 0.00 39.33 39.09 2x2t h ASP 41 CO 0.01 0.85 -0.80 -0.54 -1.72 0.00 0.00 179.24 177.03 2x2t s LYS 42 N -5.40 1.79 0.49 3.56 1.02 -1.26 -5.12 119.74 114.82 2x2t s LYS 42 Ca -0.11 -0.79 -0.23 0.00 0.02 0.00 0.00 55.97 54.86 2x2t s LYS 42 Cb 0.16 -2.35 -0.07 0.00 -0.52 0.00 0.00 37.83 35.05 2x2t s LYS 42 CO 0.82 -0.46 1.31 -1.25 -0.92 0.00 0.00 175.35 174.84 2x2t s PRO 43 N 1.46 3.52 0.43 -1.68 0.04 -1.26 -4.99 135.00 132.51 2x2t s PRO 43 Ca -0.02 2.12 -0.05 0.00 0.04 0.00 0.00 61.00 63.10 2x2t s PRO 43 Cb -0.16 -2.44 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 2x2t s PRO 43 CO -0.08 -0.85 0.72 -1.54 0.04 0.00 0.00 177.00 175.29 2x2t s SER 44 N -0.96 6.32 0.48 6.66 1.04 -1.26 -4.97 113.70 121.01 2x2t s SER 44 Ca 0.65 0.85 0.16 0.00 0.48 0.00 0.00 55.95 58.09 2x2t s SER 44 Cb -0.37 -2.21 1.13 0.00 0.10 0.00 0.00 66.02 64.67 2x2t s SER 44 CO 0.46 -0.46 2.06 0.44 0.98 0.00 0.00 173.24 176.71 2x2t h ASP 45 N 0.62 0.00 0.45 7.02 3.32 -1.94 0.66 116.42 126.55 2x2t h ASP 45 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2x2t h ASP 45 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2x2t h ASP 45 CO 0.62 0.11 0.00 -0.46 -1.72 0.00 0.00 179.24 177.79 2x2t n ASN 46 N -4.38 0.00 -0.48 6.45 6.94 -1.26 -2.51 115.26 120.02 2x2t n ASN 46 Ca -0.03 0.33 0.07 0.00 -0.02 0.00 0.00 54.58 54.93 2x2t n ASN 46 Cb 0.18 -0.42 0.18 0.00 -2.36 0.00 0.00 39.78 37.37 2x2t n ASN 46 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2x2t n ALA 47 N -1.42 3.10 -2.43 -2.53 0.00 0.21 -1.93 120.51 115.51 2x2t n ALA 47 Ca 0.05 -2.91 -0.28 0.00 0.00 0.00 0.00 53.44 50.31 2x2t n ALA 47 Cb 0.16 -0.45 -0.13 0.00 0.00 0.00 0.00 19.45 19.03 2x2t n ALA 47 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2x2t s LYS 48 N -3.05 1.34 -0.03 0.00 1.02 -1.04 -4.63 119.74 113.35 2x2t s LYS 48 Ca 0.37 -1.27 0.00 0.00 0.02 0.00 0.00 55.97 55.09 2x2t s LYS 48 Cb 0.33 -1.75 0.03 0.00 -0.52 0.00 0.00 37.83 35.93 2x2t s LYS 48 CO -0.00 0.42 0.01 -1.58 -0.92 0.00 0.00 175.35 173.27 2x2t s TRP 49 N -1.07 0.21 -0.31 3.18 0.52 -0.33 -1.17 118.94 119.97 2x2t s TRP 49 Ca 0.11 0.05 -0.20 0.00 0.02 0.00 0.00 56.10 56.08 2x2t s TRP 49 Cb -0.10 -0.35 -0.01 0.00 -1.15 0.00 0.00 33.47 31.86 2x2t s TRP 49 CO 0.05 -0.12 0.62 -1.14 0.02 0.00 0.00 176.95 176.39 2x2t s GLN 50 N 1.06 3.89 -0.28 4.98 2.00 0.68 -0.92 119.66 131.07 2x2t s GLN 50 Ca -0.09 0.28 -0.24 0.00 -2.00 0.00 0.00 55.36 53.31 2x2t s GLN 50 Cb -0.13 -3.73 -0.00 0.00 0.80 0.00 0.00 33.01 29.95 2x2t s GLN 50 CO -0.02 -0.57 0.79 0.08 -0.50 0.00 0.00 175.29 175.07 2x2t s VAL 51 N 2.59 4.82 -0.12 1.34 1.01 -0.18 -0.60 120.40 129.27 2x2t s VAL 51 Ca 0.25 1.29 0.02 0.00 0.00 0.00 0.00 61.98 63.54 2x2t s VAL 51 Cb -0.15 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 32.12 2x2t s VAL 51 CO 0.12 -0.18 -0.16 0.00 0.00 0.00 0.00 175.10 174.87 2x2t s ALA 52 N 2.90 1.80 0.05 5.51 0.00 -0.49 -2.56 121.76 128.97 2x2t s ALA 52 Ca 0.33 -0.81 -0.30 0.00 0.00 0.00 0.00 51.96 51.18 2x2t s ALA 52 Cb -0.14 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 2x2t s ALA 52 CO 0.11 -0.09 1.11 -1.17 0.00 0.00 0.00 175.76 175.72 2x2t s LEU 53 N 0.99 4.38 0.00 0.00 2.96 -1.26 -0.95 118.68 124.80 2x2t s LEU 53 Ca -0.06 1.91 0.00 0.00 -0.22 0.00 0.00 54.13 55.76 2x2t s LEU 53 Cb -0.15 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.96 2x2t s LEU 53 CO -0.02 -0.37 0.00 1.33 -1.32 0.00 0.00 176.35 175.97 2x2t n VAL 54 N 3.74 0.00 -3.52 1.68 0.24 0.01 -4.92 118.33 115.57 2x2t n VAL 54 Ca 0.07 -0.17 -0.16 0.00 -2.04 0.00 0.00 64.34 62.05 2x2t n VAL 54 Cb 0.48 0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 33.47 2x2t n VAL 54 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x2t s ALA 55 N -1.62 -1.78 0.00 2.33 0.00 -1.16 -5.00 121.76 114.53 2x2t s ALA 55 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.21 2x2t s ALA 55 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2x2t s ALA 55 CO 0.00 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.75 2x2t n GLY 56 N 0.66 -1.15 3.40 0.00 0.00 -1.26 -0.86 105.19 105.98 2x2t n GLY 56 Ca -0.17 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 2x2t n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x2t s SER 57 N -4.00 -0.48 0.00 1.61 0.01 -1.25 -4.68 113.70 104.90 2x2t s SER 57 Ca 0.00 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.32 2x2t s SER 57 Cb 0.00 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.77 2x2t s SER 57 CO 0.00 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.41 2x2t n GLY 58 N -0.01 0.83 0.18 3.44 0.00 -1.26 0.30 105.19 108.67 2x2t n GLY 58 Ca -0.17 0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2x2t n GLY 58 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2x2t h ASP 59 N 0.00 0.00 -0.09 1.61 3.32 -1.99 -2.45 116.42 116.83 2x2t h ASP 59 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2x2t h ASP 59 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2x2t h ASP 59 CO 0.00 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 2x2t n SER 60 N -2.35 2.42 -4.72 6.45 3.41 0.87 -5.06 113.62 114.65 2x2t n SER 60 Ca -0.01 -2.36 -0.41 0.00 -0.26 0.00 0.00 58.87 55.83 2x2t n SER 60 Cb 0.06 -0.20 -0.04 0.00 -0.26 0.00 0.00 64.21 63.77 2x2t n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x2t s ALA 61 N -1.63 3.24 -0.11 7.33 0.00 -0.93 -3.90 121.76 125.76 2x2t s ALA 61 Ca 0.16 0.37 -0.01 0.00 0.00 0.00 0.00 51.96 52.48 2x2t s ALA 61 Cb 0.12 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 2x2t s ALA 61 CO 0.04 -0.15 -0.07 -1.21 0.00 0.00 0.00 175.76 174.37 2x2t s GLU 62 N 0.80 3.24 0.04 0.00 2.02 -0.04 -4.47 118.70 120.29 2x2t s GLU 62 Ca 0.45 -0.57 0.07 0.00 0.02 0.00 0.00 54.97 54.95 2x2t s GLU 62 Cb -0.20 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 2x2t s GLU 62 CO 0.24 0.40 -0.21 0.71 0.02 0.00 0.00 175.26 176.43 2x2t s TYR 63 N -0.11 1.82 0.25 1.61 2.02 0.37 -0.81 117.35 122.50 2x2t s TYR 63 Ca 0.01 -0.37 -0.22 0.00 -0.37 0.00 0.00 57.07 56.11 2x2t s TYR 63 Cb -0.13 -1.09 -0.09 0.00 -0.40 0.00 0.00 41.96 40.25 2x2t s TYR 63 CO 0.03 0.08 0.80 -0.51 -1.57 0.00 0.00 175.55 174.38 2x2t s LEU 64 N -1.14 4.35 -0.40 -1.29 1.43 -0.13 -1.32 118.68 120.19 2x2t s LEU 64 Ca 0.07 1.57 0.02 0.00 -1.03 0.00 0.00 54.13 54.77 2x2t s LEU 64 Cb -0.09 -3.72 0.11 0.00 0.03 0.00 0.00 46.19 42.52 2x2t s LEU 64 CO 0.02 0.01 0.14 -0.63 0.23 0.00 0.00 176.35 176.11 2x2t s ILE 65 N -1.54 2.62 -0.24 -0.59 1.01 -1.26 -1.40 121.20 119.81 2x2t s ILE 65 Ca 0.45 -2.50 -0.10 0.00 0.00 0.00 0.00 60.65 58.50 2x2t s ILE 65 Cb -0.18 -2.87 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 2x2t s ILE 65 CO 0.22 -0.67 0.16 -0.63 0.00 0.00 0.00 174.94 174.02 2x2t s ILE 66 N 0.68 5.34 0.12 2.92 1.01 0.24 -0.93 121.20 130.59 2x2t s ILE 66 Ca 0.12 0.17 -0.31 0.00 0.00 0.00 0.00 60.65 60.63 2x2t s ILE 66 Cb -0.21 -3.49 -0.10 0.00 0.01 0.00 0.00 42.46 38.67 2x2t s ILE 66 CO -0.06 0.35 1.66 0.21 0.00 0.00 0.00 174.94 177.10 2x2t s ASN 67 N 1.05 6.55 0.30 3.58 3.84 -0.15 -0.23 114.94 129.88 2x2t s ASN 67 Ca 0.07 2.61 -0.01 0.00 0.21 0.00 0.00 52.86 55.74 2x2t s ASN 67 Cb -0.13 -2.58 0.46 0.00 -0.55 0.00 0.00 41.25 38.45 2x2t s ASN 67 CO 0.04 -0.89 1.92 0.58 -2.79 0.00 0.00 177.10 175.97 2x2t h VAL 68 N 4.42 1.21 -0.00 -5.21 2.07 -1.22 -0.59 116.25 116.92 2x2t h VAL 68 Ca -0.43 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 66.53 2x2t h VAL 68 Cb 1.20 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2x2t h VAL 68 CO 0.93 0.23 -0.12 -0.74 0.02 0.00 0.00 177.57 177.89 2x2t h HIS 69 N 0.95 0.13 0.00 1.57 -0.00 -1.75 -3.38 115.15 112.67 2x2t h HIS 69 Ca 0.24 -0.07 -0.10 0.00 -0.00 0.00 0.00 60.37 60.44 2x2t h HIS 69 Cb 0.04 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 2x2t h HIS 69 CO 0.01 0.84 -1.94 -1.13 -0.00 0.00 0.00 177.93 175.71 2x2t n SER 70 N -4.62 0.17 0.00 3.26 3.41 -1.23 -4.99 113.62 109.63 2x2t n SER 70 Ca -0.09 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 2x2t n SER 70 Cb 0.43 1.42 0.00 0.00 -0.26 0.00 0.00 64.21 65.81 2x2t n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x2t n GLY 71 N 1.38 0.66 3.89 5.00 0.00 -0.23 -5.01 105.19 110.87 2x2t n GLY 71 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 2x2t n GLY 71 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x2t s TYR 72 N -2.80 3.50 -0.15 1.61 2.02 -1.26 -4.68 117.35 115.59 2x2t s TYR 72 Ca 0.00 0.96 -0.10 0.00 -0.37 0.00 0.00 57.07 57.56 2x2t s TYR 72 Cb 0.00 -2.39 -0.05 0.00 -0.40 0.00 0.00 41.96 39.13 2x2t s TYR 72 CO 0.00 -0.16 0.19 -0.06 -1.57 0.00 0.00 175.55 173.95 2x2t s PHE 73 N -2.49 3.51 0.06 2.71 0.08 -1.26 -0.98 117.98 119.62 2x2t s PHE 73 Ca 0.50 0.51 -0.31 0.00 0.12 0.00 0.00 56.93 57.74 2x2t s PHE 73 Cb -0.10 -2.12 -0.10 0.00 -0.57 0.00 0.00 43.02 40.12 2x2t s PHE 73 CO 0.36 0.47 1.89 -0.11 -0.10 0.00 0.00 175.22 177.74 2x2t n LEU 74 N 2.83 3.97 -3.92 -0.37 7.94 -0.10 -4.12 117.00 123.23 2x2t n LEU 74 Ca -0.17 0.95 -0.16 0.00 -1.11 0.00 0.00 56.01 55.53 2x2t n LEU 74 Cb 0.53 -1.51 -0.15 0.00 0.53 0.00 0.00 43.42 42.83 2x2t n LEU 74 CO 0.35 0.13 -0.39 -0.89 -1.11 0.00 0.00 177.39 175.48 2x2t s THR 75 N 3.56 0.33 -0.12 1.96 2.01 0.37 -4.52 115.64 119.23 2x2t s THR 75 Ca 0.86 -0.13 -0.16 0.00 0.31 0.00 0.00 61.69 62.57 2x2t s THR 75 Cb -0.50 -0.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 2x2t s THR 75 CO 0.41 0.12 0.38 0.00 -0.69 0.00 0.00 174.62 174.84 2x2t s ALA 76 N 0.19 3.56 -0.05 7.40 0.00 -0.77 -1.93 121.76 130.16 2x2t s ALA 76 Ca -0.02 -0.32 0.10 0.00 0.00 0.00 0.00 51.96 51.72 2x2t s ALA 76 Cb -0.05 -2.49 -0.14 0.00 0.00 0.00 0.00 23.12 20.44 2x2t s ALA 76 CO -0.00 0.12 0.15 0.25 0.00 0.00 0.00 175.76 176.27 2x2t n THR 77 N 3.34 0.27 -3.52 0.00 -2.24 -1.26 -4.81 114.28 106.06 2x2t n THR 77 Ca -0.10 -0.31 -0.16 0.00 -2.27 0.00 0.00 64.05 61.21 2x2t n THR 77 Cb 0.52 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.54 2x2t n THR 77 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2x2t s LYS 78 N -2.51 1.00 0.33 -0.78 2.20 -1.26 -5.11 119.74 113.60 2x2t s LYS 78 Ca -0.04 0.14 -0.29 0.00 -0.36 0.00 0.00 55.97 55.42 2x2t s LYS 78 Cb 0.05 0.47 -0.10 0.00 -1.51 0.00 0.00 37.83 36.73 2x2t s LYS 78 CO 0.41 -0.33 1.37 -1.21 -0.36 0.00 0.00 175.35 175.24 2x2t s GLU 79 N -1.52 4.28 -1.49 4.03 2.02 -1.26 -2.54 118.70 122.22 2x2t s GLU 79 Ca -0.08 2.32 -0.12 0.00 0.02 0.00 0.00 54.97 57.11 2x2t s GLU 79 Cb -0.00 -3.05 0.07 0.00 0.10 0.00 0.00 34.13 31.24 2x2t s GLU 79 CO 0.05 -0.31 0.99 -1.71 0.02 0.00 0.00 175.26 174.30 2x2t n ASN 80 N 1.02 -4.72 -4.17 -0.19 5.15 0.21 -4.98 115.26 107.59 2x2t n ASN 80 Ca 0.02 -0.75 -0.16 0.00 -0.60 0.00 0.00 54.58 53.08 2x2t n ASN 80 Cb 0.41 -4.07 -0.11 0.00 -0.53 0.00 0.00 39.78 35.47 2x2t n ASN 80 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2x2t s HIS 81 N -3.34 1.12 0.35 1.20 2.46 -1.05 -4.92 115.29 111.11 2x2t s HIS 81 Ca 0.60 -0.54 -0.28 0.00 0.47 0.00 0.00 55.06 55.31 2x2t s HIS 81 Cb -0.29 -0.62 -0.12 0.00 -0.13 0.00 0.00 32.58 31.41 2x2t s HIS 81 CO 0.81 0.03 1.25 1.51 -2.47 0.00 0.00 174.74 175.88 2x2t n ILE 82 N 0.97 2.08 -2.66 0.89 3.06 -1.26 -1.11 119.36 121.34 2x2t n ILE 82 Ca -0.19 -0.50 -0.25 0.00 -2.50 0.00 0.00 62.75 59.31 2x2t n ILE 82 Cb 0.56 -1.50 0.02 0.00 0.54 0.00 0.00 39.64 39.25 2x2t n ILE 82 CO 0.00 0.00 0.00 0.68 -2.50 0.00 0.00 176.55 174.73 2x2t s VAL 83 N -1.11 4.01 0.30 9.51 -7.23 -0.20 -4.64 120.40 121.03 2x2t s VAL 83 Ca 0.57 -0.14 -0.07 0.00 -1.81 0.00 0.00 61.98 60.52 2x2t s VAL 83 Cb -0.57 -3.54 0.00 0.00 0.56 0.00 0.00 36.38 32.83 2x2t s VAL 83 CO 0.61 -0.49 0.47 -0.94 -0.31 0.00 0.00 175.10 174.45 2x2t s SER 84 N -4.24 0.39 -0.63 4.85 1.04 -0.81 -1.74 113.70 112.56 2x2t s SER 84 Ca 0.51 -1.23 0.06 0.00 0.48 0.00 0.00 55.95 55.76 2x2t s SER 84 Cb -0.10 0.62 0.24 0.00 0.10 0.00 0.00 66.02 66.88 2x2t s SER 84 CO 0.42 -1.23 0.71 0.35 0.98 0.00 0.00 173.24 174.47 2x2t n THR 85 N -0.47 2.12 -1.56 2.02 -2.24 0.03 -0.48 114.28 113.71 2x2t n THR 85 Ca -0.01 -5.11 -0.30 0.00 -2.27 0.00 0.00 64.05 56.36 2x2t n THR 85 Cb 0.62 -2.10 0.10 0.00 -2.10 0.00 0.00 70.33 66.85 2x2t n THR 85 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2x2t s PRO 86 N -2.29 1.86 0.06 -0.78 0.04 -1.26 -0.19 135.00 132.44 2x2t s PRO 86 Ca 0.38 0.55 -0.31 0.00 0.04 0.00 0.00 61.00 61.66 2x2t s PRO 86 Cb 0.13 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.69 2x2t s PRO 86 CO -0.04 -1.75 1.51 -1.14 0.04 0.00 0.00 177.00 175.62 2x2t s GLN 87 N -5.19 4.25 -0.05 4.56 0.74 -1.26 -4.05 119.66 118.66 2x2t s GLN 87 Ca 0.61 2.16 -0.30 0.00 0.05 0.00 0.00 55.36 57.88 2x2t s GLN 87 Cb -0.14 -3.50 0.07 0.00 1.10 0.00 0.00 33.01 30.53 2x2t s GLN 87 CO 0.54 -0.62 0.65 -1.50 -0.55 0.00 0.00 175.29 173.81 2x2t s ILE 88 N 2.21 0.00 0.34 -2.34 2.07 -1.26 -5.07 121.20 117.16 2x2t s ILE 88 Ca 0.68 -0.04 -0.29 0.00 -1.41 0.00 0.00 60.65 59.60 2x2t s ILE 88 Cb -0.36 -0.97 -0.11 0.00 0.13 0.00 0.00 42.46 41.15 2x2t s ILE 88 CO 0.30 -0.02 1.40 -0.55 -1.91 0.00 0.00 174.94 174.16 2x2t s SER 89 N -1.19 6.57 0.41 4.50 0.15 -1.26 -4.92 113.70 117.97 2x2t s SER 89 Ca -0.11 2.84 0.29 0.00 0.70 0.00 0.00 55.95 59.67 2x2t s SER 89 Cb -0.00 -2.65 1.43 0.00 -1.71 0.00 0.00 66.02 63.08 2x2t s SER 89 CO 0.10 -0.70 1.87 1.55 1.20 0.00 0.00 173.24 177.25 2x2t h PRO 90 N 3.45 0.00 -0.01 5.44 0.13 -2.01 -1.86 132.00 137.14 2x2t h PRO 90 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2x2t h PRO 90 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2x2t h PRO 90 CO 0.67 0.00 -0.28 0.25 -0.23 0.00 0.00 178.00 178.41 2x2t n THR 91 N -2.53 0.00 -2.25 1.56 -2.24 -1.26 -4.88 114.28 102.67 2x2t n THR 91 Ca -0.01 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2x2t n THR 91 Cb 0.12 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 2x2t n THR 91 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2x2t s ASP 92 N -2.61 6.85 0.55 3.42 -1.08 -0.70 -4.89 116.67 118.20 2x2t s ASP 92 Ca 0.22 1.99 0.31 0.00 -0.52 0.00 0.00 52.55 54.55 2x2t s ASP 92 Cb 0.19 -2.55 1.58 0.00 -1.46 0.00 0.00 42.92 40.68 2x2t s ASP 92 CO 0.55 -0.77 2.10 1.55 0.52 0.00 0.00 175.17 179.12 2x2t h PRO 93 N 8.30 0.00 0.00 4.34 0.13 -1.90 -1.42 132.00 141.46 2x2t h PRO 93 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2x2t h PRO 93 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2x2t h PRO 93 CO 0.93 0.08 0.00 0.66 -0.23 0.00 0.00 178.00 179.45 2x2t h SER 94 N 0.00 0.00 -0.51 1.44 4.64 -1.90 -1.93 113.55 115.29 2x2t h SER 94 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x2t h SER 94 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2x2t h SER 94 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2x2t n ALA 95 N -1.90 2.39 -2.50 5.18 0.00 -0.53 -1.85 120.51 121.29 2x2t n ALA 95 Ca -0.00 -1.11 -0.31 0.00 0.00 0.00 0.00 53.44 52.01 2x2t n ALA 95 Cb 0.16 -0.86 -0.12 0.00 0.00 0.00 0.00 19.45 18.63 2x2t n ALA 95 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2x2t s ARG 96 N -1.27 2.30 0.01 0.00 0.52 -0.72 -4.49 118.95 115.29 2x2t s ARG 96 Ca 0.42 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.78 2x2t s ARG 96 Cb 0.23 -2.32 -0.01 0.00 0.52 0.00 0.00 34.95 33.38 2x2t s ARG 96 CO 0.31 0.57 -0.01 -1.58 0.02 0.00 0.00 175.30 174.61 2x2t s TRP 97 N -0.92 0.12 -0.04 -0.53 0.52 -0.43 -0.68 118.94 116.98 2x2t s TRP 97 Ca 0.15 -0.14 -0.01 0.00 0.02 0.00 0.00 56.10 56.12 2x2t s TRP 97 Cb -0.11 -0.08 -0.04 0.00 -1.15 0.00 0.00 33.47 32.09 2x2t s TRP 97 CO 0.05 -0.04 0.04 0.95 0.02 0.00 0.00 176.95 177.97 2x2t s THR 98 N -0.38 4.51 -0.23 2.01 -4.23 -0.08 -0.48 115.64 116.77 2x2t s THR 98 Ca -0.04 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.12 2x2t s THR 98 Cb -0.03 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.85 2x2t s THR 98 CO -0.00 0.47 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.83 2x2t s ILE 99 N -1.04 2.75 -0.09 2.99 1.01 -1.26 -1.19 121.20 124.37 2x2t s ILE 99 Ca 0.18 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 59.91 2x2t s ILE 99 Cb -0.12 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 40.02 2x2t s ILE 99 CO 0.08 0.29 -0.21 -0.75 0.00 0.00 0.00 174.94 174.35 2x2t s LYS 100 N 1.33 2.68 0.26 2.79 2.20 -0.70 -4.97 119.74 123.33 2x2t s LYS 100 Ca 0.02 -0.78 -0.31 0.00 -0.36 0.00 0.00 55.97 54.54 2x2t s LYS 100 Cb -0.16 -2.08 -0.13 0.00 -1.51 0.00 0.00 37.83 33.95 2x2t s LYS 100 CO -0.06 0.17 1.39 -2.30 -0.36 0.00 0.00 175.35 174.19 2x2t n PRO 101 N 3.50 2.06 -2.76 4.03 -0.02 -1.26 -0.91 135.00 139.64 2x2t n PRO 101 Ca -0.20 0.73 -0.12 0.00 -2.02 0.00 0.00 63.50 61.90 2x2t n PRO 101 Cb 0.53 -2.38 0.02 0.00 -0.02 0.00 0.00 33.50 31.64 2x2t n PRO 101 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x2t n ALA 102 N 1.63 3.22 -1.64 3.55 0.00 0.60 -4.77 120.51 123.09 2x2t n ALA 102 Ca 0.10 -3.25 -0.47 0.00 0.00 0.00 0.00 53.44 49.82 2x2t n ALA 102 Cb 0.32 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 2x2t n ALA 102 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2x2t n THR 103 N -0.01 0.35 -3.82 0.00 -1.04 -1.22 -4.49 114.28 104.06 2x2t n THR 103 Ca 0.14 -0.09 -0.28 0.00 -2.04 0.00 0.00 64.05 61.78 2x2t n THR 103 Cb 0.78 -1.31 -0.16 0.00 -1.82 0.00 0.00 70.33 67.81 2x2t n THR 103 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2x2t s THR 104 N 0.45 0.85 -1.52 12.58 2.01 -0.82 -4.76 115.64 124.41 2x2t s THR 104 Ca 0.76 -0.62 -0.10 0.00 0.31 0.00 0.00 61.69 62.04 2x2t s THR 104 Cb -0.74 -1.18 0.07 0.00 0.01 0.00 0.00 72.50 70.66 2x2t s THR 104 CO 0.44 -0.05 0.75 1.57 -0.69 0.00 0.00 174.62 176.64 2x2t n HIS 105 N 4.95 -1.92 -0.83 4.92 -0.00 -1.26 -0.51 115.22 120.57 2x2t n HIS 105 Ca -0.10 0.83 0.00 0.00 -0.00 0.00 0.00 57.72 58.45 2x2t n HIS 105 Cb 0.47 -3.67 0.00 0.00 -0.00 0.00 0.00 29.99 26.79 2x2t n HIS 105 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2x2t n GLN 106 N -4.47 -0.56 -2.63 1.57 6.02 -1.26 -4.97 117.38 111.07 2x2t n GLN 106 Ca -0.08 0.14 -0.42 0.00 -0.01 0.00 0.00 57.00 56.62 2x2t n GLN 106 Cb 0.58 -3.98 -0.03 0.00 1.02 0.00 0.00 30.24 27.83 2x2t n GLN 106 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2x2t s TYR 107 N -1.79 3.45 -1.28 1.08 1.51 0.34 -4.96 117.35 115.70 2x2t s TYR 107 Ca 0.00 1.50 -0.18 0.00 -1.01 0.00 0.00 57.07 57.38 2x2t s TYR 107 Cb 0.00 -3.25 0.07 0.00 -0.11 0.00 0.00 41.96 38.67 2x2t s TYR 107 CO 0.00 -0.50 1.72 -2.00 -1.11 0.00 0.00 175.55 173.66 2x2t s GLU 108 N 1.93 3.96 0.30 -0.62 2.12 -1.26 -1.95 118.70 123.18 2x2t s GLU 108 Ca 0.51 -1.94 0.10 0.00 0.36 0.00 0.00 54.97 53.99 2x2t s GLU 108 Cb -0.20 -5.52 -0.05 0.00 0.26 0.00 0.00 34.13 28.61 2x2t s GLU 108 CO 0.20 -2.25 -0.03 0.14 -0.54 0.00 0.00 175.26 172.78 2x2t s VAL 109 N 4.26 2.94 0.06 3.70 -7.23 -1.26 -4.67 120.40 118.20 2x2t s VAL 109 Ca 0.53 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 58.69 2x2t s VAL 109 Cb 0.04 -2.72 -0.03 0.00 0.56 0.00 0.00 36.38 34.23 2x2t s VAL 109 CO 0.07 -0.31 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.12 2x2t s PHE 110 N -2.44 0.72 0.16 2.82 0.08 0.42 -0.29 117.98 119.45 2x2t s PHE 110 Ca 0.33 -0.71 -0.04 0.00 0.12 0.00 0.00 56.93 56.62 2x2t s PHE 110 Cb -0.04 -0.43 -0.05 0.00 -0.57 0.00 0.00 43.02 41.93 2x2t s PHE 110 CO 0.19 -0.14 0.39 0.95 -0.10 0.00 0.00 175.22 176.50 2x2t s THR 111 N -2.48 5.17 -0.29 0.64 -4.23 -0.09 -0.69 115.64 113.67 2x2t s THR 111 Ca -0.00 -0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.48 2x2t s THR 111 Cb -0.02 -3.65 0.07 0.00 1.34 0.00 0.00 72.50 70.23 2x2t s THR 111 CO -0.03 -0.03 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.34 2x2t s ILE 112 N -1.73 2.18 -0.19 2.99 1.01 -1.26 -1.73 121.20 122.47 2x2t s ILE 112 Ca 0.41 -1.86 -0.02 0.00 0.00 0.00 0.00 60.65 59.18 2x2t s ILE 112 Cb -0.12 -2.40 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 2x2t s ILE 112 CO 0.26 -0.22 -0.09 0.20 0.00 0.00 0.00 174.94 175.09 2x2t s ASN 113 N 1.05 4.00 0.47 3.58 0.01 -0.34 -1.11 114.94 122.59 2x2t s ASN 113 Ca -0.02 -0.43 -0.23 0.00 -0.71 0.00 0.00 52.86 51.46 2x2t s ASN 113 Cb -0.20 -1.66 -0.07 0.00 0.41 0.00 0.00 41.25 39.73 2x2t s ASN 113 CO -0.06 0.02 1.25 0.21 -1.51 0.00 0.00 177.10 177.01 2x2t s ASN 114 N 1.21 5.98 0.51 -1.22 3.84 0.12 -0.90 114.94 124.47 2x2t s ASN 114 Ca 0.02 2.51 0.29 0.00 0.21 0.00 0.00 52.86 55.89 2x2t s ASN 114 Cb -0.14 -2.62 1.30 0.00 -0.55 0.00 0.00 41.25 39.24 2x2t s ASN 114 CO -0.04 -1.07 1.98 0.11 -2.79 0.00 0.00 177.10 175.30 2x2t h LYS 115 N 2.06 0.00 -5.93 0.43 1.79 -1.00 -3.36 116.57 110.56 2x2t h LYS 115 Ca -0.50 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.37 2x2t h LYS 115 Cb 1.26 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.79 2x2t h LYS 115 CO 0.60 0.12 0.63 0.08 -1.08 0.00 0.00 179.45 179.80 2x2t s VAL 116 N -3.85 4.31 0.39 0.50 1.01 -1.25 -4.93 120.40 116.59 2x2t s VAL 116 Ca -0.01 0.31 0.11 0.00 0.00 0.00 0.00 61.98 62.39 2x2t s VAL 116 Cb 0.11 -4.59 0.15 0.00 0.00 0.00 0.00 36.38 32.05 2x2t s VAL 116 CO 0.58 -1.20 1.91 0.77 0.00 0.00 0.00 175.10 177.16 2x2t h SER 117 N 9.39 0.13 0.30 3.32 4.64 -1.95 -0.13 113.55 129.25 2x2t h SER 117 Ca -0.26 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.02 2x2t h SER 117 Cb 1.07 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2x2t h SER 117 CO 1.12 0.34 -0.05 -0.33 -0.87 0.00 0.00 176.83 177.04 2x2t h GLU 118 N 0.13 0.00 0.00 4.77 3.07 -1.91 -2.28 114.58 118.36 2x2t h GLU 118 Ca 0.02 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.87 2x2t h GLU 118 Cb 0.43 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2x2t h GLU 118 CO 0.03 0.05 -0.10 -0.07 -1.40 0.00 0.00 179.01 177.52 2x2t h LEU 119 N 0.00 0.00 0.00 1.33 3.38 -1.37 -3.45 115.31 115.20 2x2t h LEU 119 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x2t h LEU 119 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2x2t h LEU 119 CO 0.01 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.23 2x2t n GLY 120 N 1.12 0.21 3.58 0.83 0.00 -0.86 -3.10 105.19 106.96 2x2t n GLY 120 Ca 0.04 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 2x2t n GLY 120 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x2t s GLN 121 N 0.00 2.12 0.09 1.61 -0.21 0.08 -0.70 119.66 122.65 2x2t s GLN 121 Ca 0.00 -1.03 -0.31 0.00 0.02 0.00 0.00 55.36 54.04 2x2t s GLN 121 Cb 0.00 -2.30 -0.09 0.00 1.00 0.00 0.00 33.01 31.62 2x2t s GLN 121 CO 0.00 0.50 1.71 -1.17 -2.12 0.00 0.00 175.29 174.22 2x2t s LEU 122 N -2.24 4.38 -0.05 2.90 2.96 -0.27 -1.71 118.68 124.65 2x2t s LEU 122 Ca 0.22 2.58 -0.02 0.00 -0.22 0.00 0.00 54.13 56.69 2x2t s LEU 122 Cb -0.11 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 43.05 2x2t s LEU 122 CO 0.14 -0.93 0.09 -0.89 -1.32 0.00 0.00 176.35 173.44 2x2t s THR 123 N 2.66 -0.07 -0.32 3.68 2.01 -0.06 -4.42 115.64 119.12 2x2t s THR 123 Ca 0.76 0.22 -0.29 0.00 0.31 0.00 0.00 61.69 62.70 2x2t s THR 123 Cb -0.42 -0.17 0.02 0.00 0.01 0.00 0.00 72.50 71.93 2x2t s THR 123 CO 0.34 0.09 1.11 -0.69 -0.69 0.00 0.00 174.62 174.78 2x2t s VAL 124 N 1.27 4.44 0.12 3.82 1.01 -0.23 0.19 120.40 131.03 2x2t s VAL 124 Ca -0.07 1.65 -0.35 0.00 0.00 0.00 0.00 61.98 63.20 2x2t s VAL 124 Cb -0.12 -4.39 -0.15 0.00 0.00 0.00 0.00 36.38 31.72 2x2t s VAL 124 CO -0.05 -0.50 1.43 1.17 0.00 0.00 0.00 175.10 177.15 2x2t n LYS 125 N 6.98 1.58 -2.63 2.72 4.81 -0.44 -2.00 118.16 129.18 2x2t n LYS 125 Ca 0.12 0.57 -0.16 0.00 -0.87 0.00 0.00 58.31 57.98 2x2t n LYS 125 Cb 0.47 -2.26 -0.00 0.00 0.02 0.00 0.00 35.03 33.26 2x2t n LYS 125 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2x2t n ASP 126 N 2.85 -4.28 -2.92 3.14 8.00 -1.26 -2.14 116.55 119.94 2x2t n ASP 126 Ca 0.17 0.04 -0.21 0.00 0.71 0.00 0.00 54.79 55.51 2x2t n ASP 126 Cb 0.24 -3.59 0.01 0.00 -0.02 0.00 0.00 41.12 37.75 2x2t n ASP 126 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2x2t n TYR 127 N -3.64 -1.68 -1.86 1.24 4.01 -0.85 -4.92 117.16 109.47 2x2t n TYR 127 Ca -0.13 0.34 -0.41 0.00 -0.16 0.00 0.00 57.90 57.53 2x2t n TYR 127 Cb 0.61 -3.68 -0.01 0.00 -0.31 0.00 0.00 39.34 35.95 2x2t n TYR 127 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2x2t s SER 128 N -2.49 6.43 -0.02 7.72 0.15 -0.91 -4.92 113.70 119.66 2x2t s SER 128 Ca 0.23 2.97 0.12 0.00 0.70 0.00 0.00 55.95 59.97 2x2t s SER 128 Cb -0.11 -2.66 0.36 0.00 -1.71 0.00 0.00 66.02 61.90 2x2t s SER 128 CO 0.28 -0.82 1.30 0.35 1.20 0.00 0.00 173.24 175.56 2x2t n THR 129 N 0.76 1.15 -4.29 6.45 -2.24 -1.26 -4.83 114.28 110.01 2x2t n THR 129 Ca 0.02 -1.09 -0.29 0.00 -2.27 0.00 0.00 64.05 60.41 2x2t n THR 129 Cb 0.39 0.42 -0.11 0.00 -2.10 0.00 0.00 70.33 68.93 2x2t n THR 129 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2x2t s HIS 130 N -1.20 2.57 0.42 4.78 3.76 -1.26 -4.84 115.29 119.53 2x2t s HIS 130 Ca 0.27 -0.25 -0.23 0.00 -0.15 0.00 0.00 55.06 54.71 2x2t s HIS 130 Cb 0.16 -1.35 -0.11 0.00 1.11 0.00 0.00 32.58 32.38 2x2t s HIS 130 CO 0.16 0.40 0.75 0.45 -0.85 0.00 0.00 174.74 175.65 2x2t n SER 131 N 0.75 0.03 0.00 1.40 2.88 -1.26 -3.78 113.62 113.63 2x2t n SER 131 Ca -0.15 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.35 2x2t n SER 131 Cb 0.53 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 2x2t n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2x2t n GLY 132 N 1.53 0.75 3.77 0.46 0.00 0.73 -4.95 105.19 107.48 2x2t n GLY 132 Ca 0.11 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 2x2t n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x2t s ALA 133 N -2.00 3.42 0.30 4.61 0.00 -1.24 -4.83 121.76 122.02 2x2t s ALA 133 Ca 0.00 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.09 2x2t s ALA 133 Cb 0.00 -3.02 -0.11 0.00 0.00 0.00 0.00 23.12 19.99 2x2t s ALA 133 CO 0.00 0.25 1.52 -0.51 0.00 0.00 0.00 175.76 177.02 2x2t s ASP 134 N -1.07 6.46 -0.26 0.00 1.01 -1.26 -1.25 116.67 120.31 2x2t s ASP 134 Ca 0.37 2.88 -0.09 0.00 0.71 0.00 0.00 52.55 56.43 2x2t s ASP 134 Cb -0.24 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.02 2x2t s ASP 134 CO 0.27 -0.83 0.12 -0.69 0.21 0.00 0.00 175.17 174.26 2x2t s VAL 135 N -0.30 4.80 0.28 -1.27 1.01 -0.82 -1.33 120.40 122.77 2x2t s VAL 135 Ca 0.59 -0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.63 2x2t s VAL 135 Cb -0.46 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 2x2t s VAL 135 CO 0.50 0.31 0.28 -0.76 0.00 0.00 0.00 175.10 175.43 2x2t s LEU 136 N 1.55 3.83 -0.41 3.92 1.43 0.13 -1.03 118.68 128.10 2x2t s LEU 136 Ca 0.06 -0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.75 2x2t s LEU 136 Cb -0.15 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.68 2x2t s LEU 136 CO 0.06 -0.18 0.29 -0.94 0.23 0.00 0.00 176.35 175.81 2x2t s SER 137 N -3.94 6.03 0.11 2.29 1.04 -0.26 -0.88 113.70 118.09 2x2t s SER 137 Ca 0.37 -0.96 0.02 0.00 0.48 0.00 0.00 55.95 55.86 2x2t s SER 137 Cb -0.08 -2.13 -0.04 0.00 0.10 0.00 0.00 66.02 63.87 2x2t s SER 137 CO 0.27 -0.45 -0.07 0.00 0.98 0.00 0.00 173.24 173.97 2x2t s ALA 138 N 1.65 1.10 0.14 5.32 0.00 -0.70 0.68 121.76 129.95 2x2t s ALA 138 Ca 0.04 -1.40 -0.34 0.00 0.00 0.00 0.00 51.96 50.26 2x2t s ALA 138 Cb -0.19 0.17 -0.16 0.00 0.00 0.00 0.00 23.12 22.94 2x2t s ALA 138 CO 0.09 -0.21 1.27 0.45 0.00 0.00 0.00 175.76 177.35 2x2t n SER 139 N -0.09 1.60 -4.65 0.00 2.88 -1.26 -0.74 113.62 111.36 2x2t n SER 139 Ca -0.11 1.13 -0.43 0.00 -1.33 0.00 0.00 58.87 58.13 2x2t n SER 139 Cb 0.61 -1.22 -0.02 0.00 -0.75 0.00 0.00 64.21 62.83 2x2t n SER 139 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2x2t s ALA 140 N 0.15 3.52 0.00 -1.46 0.00 -1.26 -4.69 121.76 118.03 2x2t s ALA 140 Ca 0.78 0.30 0.00 0.00 0.00 0.00 0.00 51.96 53.04 2x2t s ALA 140 Cb -0.88 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 18.55 2x2t s ALA 140 CO 0.49 -1.45 0.11 1.63 0.00 0.00 0.00 175.76 176.54 2x2t n LYS 141 N 6.94 0.98 -4.08 0.00 5.02 -1.26 -5.02 118.16 120.74 2x2t n LYS 141 Ca 0.14 -0.11 -0.31 0.00 -2.02 0.00 0.00 58.31 56.02 2x2t n LYS 141 Cb 0.46 -0.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.98 2x2t n LYS 141 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2x2t n THR 142 N -0.17 -2.00 -1.24 -0.18 -1.04 -1.26 -4.99 114.28 103.40 2x2t n THR 142 Ca 0.00 -0.23 -0.30 0.00 -2.04 0.00 0.00 64.05 61.48 2x2t n THR 142 Cb 0.09 -2.21 0.12 0.00 -1.82 0.00 0.00 70.33 66.51 2x2t n THR 142 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2x2t s ALA 143 N -3.59 1.81 0.51 2.41 0.00 -1.26 -4.91 121.76 116.72 2x2t s ALA 143 Ca 0.41 0.02 0.19 0.00 0.00 0.00 0.00 51.96 52.58 2x2t s ALA 143 Cb -0.22 -3.21 1.31 0.00 0.00 0.00 0.00 23.12 21.01 2x2t s ALA 143 CO 0.90 -2.13 2.13 -0.44 0.00 0.00 0.00 175.76 176.22 2x2t h ASP 144 N -1.39 0.00 -0.01 0.00 3.32 -1.97 -0.14 116.42 116.23 2x2t h ASP 144 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2x2t h ASP 144 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2x2t h ASP 144 CO 0.54 0.05 0.00 -0.46 -1.72 0.00 0.00 179.24 177.65 2x2t n ASN 145 N -4.32 0.10 -0.55 6.45 6.94 -1.26 -2.84 115.26 119.79 2x2t n ASN 145 Ca -0.03 -1.47 0.06 0.00 -0.02 0.00 0.00 54.58 53.12 2x2t n ASN 145 Cb 0.13 -0.01 0.15 0.00 -2.36 0.00 0.00 39.78 37.70 2x2t n ASN 145 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2x2t n GLN 146 N -0.71 2.81 -4.45 -3.83 6.02 -0.07 -1.07 117.38 116.09 2x2t n GLN 146 Ca 0.13 -2.17 -0.32 0.00 -0.01 0.00 0.00 57.00 54.63 2x2t n GLN 146 Cb 0.08 -1.37 -0.10 0.00 1.02 0.00 0.00 30.24 29.86 2x2t n GLN 146 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2x2t s LYS 147 N -1.54 2.48 -0.04 -1.09 1.02 -1.13 -4.39 119.74 115.05 2x2t s LYS 147 Ca 0.24 -0.77 -0.05 0.00 0.02 0.00 0.00 55.97 55.41 2x2t s LYS 147 Cb 0.16 -2.46 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 2x2t s LYS 147 CO 0.11 0.59 0.12 -1.58 -0.92 0.00 0.00 175.35 173.67 2x2t s TRP 148 N -1.02 -0.08 0.22 3.18 0.52 0.13 -1.08 118.94 120.81 2x2t s TRP 148 Ca 0.17 0.21 -0.08 0.00 0.02 0.00 0.00 56.10 56.42 2x2t s TRP 148 Cb -0.11 0.02 -0.07 0.00 -1.15 0.00 0.00 33.47 32.16 2x2t s TRP 148 CO 0.08 -0.12 0.52 0.71 0.02 0.00 0.00 176.95 178.16 2x2t s TYR 149 N -0.31 3.44 -0.34 -1.98 2.02 0.01 -0.43 117.35 119.76 2x2t s TYR 149 Ca -0.04 0.78 -0.01 0.00 -0.37 0.00 0.00 57.07 57.44 2x2t s TYR 149 Cb -0.03 -2.19 0.08 0.00 -0.40 0.00 0.00 41.96 39.42 2x2t s TYR 149 CO 0.00 0.28 0.06 -0.06 -1.57 0.00 0.00 175.55 174.27 2x2t s PHE 150 N -1.83 3.46 -0.39 2.71 0.40 -1.26 -0.90 117.98 120.16 2x2t s PHE 150 Ca 0.46 -2.29 -0.15 0.00 -0.60 0.00 0.00 56.93 54.34 2x2t s PHE 150 Cb -0.11 -2.58 0.01 0.00 0.51 0.00 0.00 43.02 40.85 2x2t s PHE 150 CO 0.23 -0.89 0.33 -0.51 0.70 0.00 0.00 175.22 175.08 2x2t s ASP 151 N 1.35 6.13 0.27 1.36 1.11 -0.18 -1.82 116.67 124.89 2x2t s ASP 151 Ca 0.01 -0.68 -0.30 0.00 0.18 0.00 0.00 52.55 51.77 2x2t s ASP 151 Cb -0.21 -2.18 -0.10 0.00 1.07 0.00 0.00 42.92 41.51 2x2t s ASP 151 CO -0.04 -0.43 1.44 0.00 1.18 0.00 0.00 175.17 177.33 2x2t s ALA 152 N 1.84 3.62 0.00 5.23 0.00 -1.26 -1.47 121.76 129.72 2x2t s ALA 152 Ca 0.08 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2x2t s ALA 152 Cb -0.18 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2x2t s ALA 152 CO 0.11 -0.77 0.15 1.63 0.00 0.00 0.00 175.76 176.88