#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1upt h SER 12 N 0.00 0.17 0.11 1.61 0.02 -2.12 -3.37 113.55 109.98 1upt h SER 12 Ca 0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1upt h SER 12 Cb 0.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1upt h SER 12 CO 0.00 0.57 -0.11 1.41 -1.14 0.00 0.00 176.83 177.56 1upt n HIS 13 N -4.03 0.00 -3.87 3.45 -0.00 -1.26 -5.23 115.22 104.28 1upt n HIS 13 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.59 1upt n HIS 13 Cb 0.47 -0.06 -0.10 0.00 -0.00 0.00 0.00 29.99 30.30 1upt n HIS 13 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1upt s THR 15 N -2.23 0.09 0.41 1.59 2.01 -1.26 -5.29 115.64 110.96 1upt s THR 15 Ca 0.32 -0.72 -0.27 0.00 0.31 0.00 0.00 61.69 61.33 1upt s THR 15 Cb 0.20 -0.51 -0.10 0.00 0.01 0.00 0.00 72.50 72.10 1upt s THR 15 CO 0.42 -0.40 1.44 -1.14 -0.69 0.00 0.00 174.62 174.25 1upt n ARG 16 N 1.33 2.43 0.00 4.92 0.63 -1.26 -4.95 116.66 119.76 1upt n ARG 16 Ca -0.22 0.86 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 1upt n ARG 16 Cb 0.56 -2.61 0.00 0.00 0.45 0.00 0.00 32.46 30.86 1upt n ARG 16 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1upt n GLU 17 N 0.18 1.11 -3.67 -0.14 0.28 -1.26 -4.35 120.64 112.79 1upt n GLU 17 Ca 0.03 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.94 1upt n GLU 17 Cb 0.40 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.17 1upt n GLU 17 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1upt s ARG 19 N 1.16 0.33 -0.03 3.44 3.52 -1.26 -4.88 118.95 121.23 1upt s ARG 19 Ca 0.00 0.95 0.05 0.00 -0.13 0.00 0.00 55.73 56.61 1upt s ARG 19 Cb 0.00 0.21 -0.01 0.00 -1.56 0.00 0.00 34.95 33.59 1upt s ARG 19 CO 0.00 -0.23 -0.19 0.42 -0.81 0.00 0.00 175.30 174.49 1upt s ILE 20 N 2.27 1.54 -0.10 4.11 1.01 -0.38 -0.69 121.20 128.97 1upt s ILE 20 Ca -0.04 -0.81 -0.00 0.00 0.00 0.00 0.00 60.65 59.80 1upt s ILE 20 Cb -0.11 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1upt s ILE 20 CO -0.12 0.44 -0.08 -0.76 0.00 0.00 0.00 174.94 174.41 1upt s LEU 21 N -0.25 3.07 -0.28 2.97 1.43 -0.68 -1.11 118.68 123.82 1upt s LEU 21 Ca 0.02 -0.12 -0.07 0.00 -1.03 0.00 0.00 54.13 52.93 1upt s LEU 21 Cb -0.10 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.43 1upt s LEU 21 CO 0.01 0.27 0.08 -0.63 0.23 0.00 0.00 176.35 176.31 1upt s ILE 22 N -0.27 4.13 0.34 -0.59 1.01 0.12 -0.48 121.20 125.46 1upt s ILE 22 Ca 0.03 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.21 1upt s ILE 22 Cb -0.13 -3.07 -0.06 0.00 0.01 0.00 0.00 42.46 39.22 1upt s ILE 22 CO 0.03 0.16 0.06 -0.76 0.00 0.00 0.00 174.94 174.42 1upt s LEU 23 N 1.55 2.18 0.00 2.97 1.43 -0.34 -2.45 118.68 124.02 1upt s LEU 23 Ca 0.04 -1.41 0.00 0.00 -1.03 0.00 0.00 54.13 51.73 1upt s LEU 23 Cb -0.16 -0.38 0.00 0.00 0.03 0.00 0.00 46.19 45.68 1upt s LEU 23 CO 0.03 -0.64 0.00 0.61 0.23 0.00 0.00 176.35 176.58 1upt n GLY 24 N -0.73 3.80 3.76 -3.19 0.00 -1.26 -1.05 105.19 106.52 1upt n GLY 24 Ca -0.03 -1.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 1upt n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1upt s LEU 25 N 0.00 2.98 0.47 0.99 1.43 -1.26 -4.21 118.68 119.08 1upt s LEU 25 Ca 0.00 1.80 -0.24 0.00 -1.03 0.00 0.00 54.13 54.67 1upt s LEU 25 Cb 0.00 -4.48 -0.08 0.00 0.03 0.00 0.00 46.19 41.66 1upt s LEU 25 CO 0.00 -2.08 1.21 -0.90 0.23 0.00 0.00 176.35 174.80 1upt n ASP 26 N -3.55 2.14 0.00 2.29 5.75 -0.86 -2.49 116.55 119.83 1upt n ASP 26 Ca 0.09 1.03 0.00 0.00 -0.01 0.00 0.00 54.79 55.90 1upt n ASP 26 Cb 0.53 -1.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.14 1upt n ASP 26 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1upt n GLY 27 N 0.92 1.90 0.19 6.12 0.00 -1.26 -4.92 105.19 108.14 1upt n GLY 27 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1upt n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upt h ALA 28 N 0.00 1.31 0.00 4.61 0.00 -1.83 -3.47 119.26 119.88 1upt h ALA 28 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1upt h ALA 28 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1upt h ALA 28 CO 0.00 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.11 1upt n GLY 29 N -0.36 1.68 0.12 0.00 0.00 -1.26 -4.43 105.19 100.94 1upt n GLY 29 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1upt n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1upt h LYS 30 N 0.22 -0.16 -0.45 1.61 1.57 -1.91 0.45 116.57 117.90 1upt h LYS 30 Ca 0.00 0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.67 1upt h LYS 30 Cb 0.00 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1upt h LYS 30 CO 0.00 -0.10 -0.21 1.15 -0.57 0.00 0.00 179.45 179.71 1upt h THR 31 N -0.16 1.27 -0.93 -0.16 2.02 -1.96 -0.84 112.91 112.15 1upt h THR 31 Ca 0.01 -1.36 0.01 0.00 0.77 0.00 0.00 66.41 65.85 1upt h THR 31 Cb 0.17 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 1upt h THR 31 CO -0.04 0.46 0.61 0.74 0.37 0.00 0.00 175.52 177.66 1upt h THR 32 N 0.78 1.24 -0.40 3.16 2.02 -1.87 -2.13 112.91 115.71 1upt h THR 32 Ca 0.11 -0.44 -0.15 0.00 0.77 0.00 0.00 66.41 66.69 1upt h THR 32 Cb 0.76 -0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1upt h THR 32 CO 0.06 0.23 -0.34 0.40 0.37 0.00 0.00 175.52 176.25 1upt h ILE 33 N 1.27 1.27 -0.06 3.11 2.04 -0.29 -2.27 117.51 122.57 1upt h ILE 33 Ca 0.34 -1.51 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 1upt h ILE 33 Cb -0.14 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1upt h ILE 33 CO -0.07 0.51 0.03 0.25 0.00 0.00 0.00 178.15 178.87 1upt h LEU 34 N 0.76 0.07 -0.33 1.44 5.85 -0.85 -2.03 115.31 120.23 1upt h LEU 34 Ca 0.07 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1upt h LEU 34 Cb 0.92 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1upt h LEU 34 CO 0.09 0.12 0.00 1.88 -0.34 0.00 0.00 178.44 180.18 1upt h TYR 35 N 0.02 0.00 -0.27 1.25 0.05 -1.41 -2.12 116.97 114.50 1upt h TYR 35 Ca 0.02 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.63 1upt h TYR 35 Cb 0.06 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 1upt h TYR 35 CO -0.05 0.00 -0.51 0.00 -1.05 0.00 0.00 178.16 176.55 1upt h ARG 36 N 0.00 0.77 -0.04 4.88 2.47 -1.09 -1.53 114.38 119.83 1upt h ARG 36 Ca 0.00 -0.46 -0.13 0.00 -1.26 0.00 0.00 59.98 58.13 1upt h ARG 36 Cb 0.65 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.00 1upt h ARG 36 CO 0.00 1.09 -0.58 -0.07 0.56 0.00 0.00 179.97 180.97 1upt h LEU 37 N 0.60 0.14 0.00 3.04 3.38 -0.90 -2.76 115.31 118.81 1upt h LEU 37 Ca 0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1upt h LEU 37 Cb 1.09 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 1upt h LEU 37 CO 0.11 0.69 -0.32 -0.61 0.09 0.00 0.00 178.44 178.39 1upt h GLN 38 N 0.10 0.00 -0.01 1.13 4.15 -1.40 -3.42 115.11 115.66 1upt h GLN 38 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1upt h GLN 38 Cb 1.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.73 1upt h GLN 38 CO 0.08 0.18 -0.12 0.28 -1.93 0.00 0.00 178.83 177.32 1upt n VAL 39 N -4.67 0.00 -0.45 2.39 0.31 -0.58 -4.97 118.33 110.37 1upt n VAL 39 Ca -0.07 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 1upt n VAL 39 Cb 0.21 1.18 0.00 0.00 -0.91 0.00 0.00 33.84 34.32 1upt n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1upt n GLY 40 N 0.80 1.41 3.34 2.92 0.00 -1.04 -5.00 105.19 107.62 1upt n GLY 40 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1upt n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1upt s GLU 41 N -0.26 1.15 0.24 1.61 2.02 -1.25 -4.92 118.70 117.30 1upt s GLU 41 Ca 0.00 -1.18 -0.30 0.00 0.02 0.00 0.00 54.97 53.51 1upt s GLU 41 Cb 0.00 0.38 -0.09 0.00 0.10 0.00 0.00 34.13 34.51 1upt s GLU 41 CO 0.00 -0.42 1.35 0.08 0.02 0.00 0.00 175.26 176.29 1upt s VAL 42 N -3.97 2.94 0.18 2.63 1.01 -1.26 -3.94 120.40 117.99 1upt s VAL 42 Ca 0.17 0.81 0.06 0.00 0.00 0.00 0.00 61.98 63.02 1upt s VAL 42 Cb 0.03 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1upt s VAL 42 CO 0.00 0.14 -0.12 0.68 0.00 0.00 0.00 175.10 175.79 1upt s VAL 43 N -0.14 1.47 0.48 2.92 -7.23 -1.26 -5.08 120.40 111.55 1upt s VAL 43 Ca 0.56 -2.13 -0.21 0.00 -1.81 0.00 0.00 61.98 58.39 1upt s VAL 43 Cb -0.39 -1.94 -0.08 0.00 0.56 0.00 0.00 36.38 34.53 1upt s VAL 43 CO 0.42 -0.66 1.10 0.28 -0.31 0.00 0.00 175.10 175.93 1upt s THR 44 N -3.12 3.44 0.15 5.32 -1.32 -1.26 -4.93 115.64 113.93 1upt s THR 44 Ca 0.19 0.98 -0.00 0.00 -1.21 0.00 0.00 61.69 61.65 1upt s THR 44 Cb 0.01 -3.45 -0.04 0.00 -1.51 0.00 0.00 72.50 67.51 1upt s THR 44 CO 0.04 -0.11 0.04 0.42 -2.21 0.00 0.00 174.62 172.80 1upt s THR 45 N -1.75 0.30 0.12 5.08 -4.23 -1.26 -5.07 115.64 108.83 1upt s THR 45 Ca 0.66 -1.94 0.05 0.00 -1.18 0.00 0.00 61.69 59.28 1upt s THR 45 Cb -0.23 -2.12 -0.04 0.00 1.34 0.00 0.00 72.50 71.46 1upt s THR 45 CO 0.27 -0.43 -0.12 0.27 -0.54 0.00 0.00 174.62 174.07 1upt s ILE 46 N -3.91 1.15 -0.07 2.99 -4.36 -1.26 -5.10 121.20 110.65 1upt s ILE 46 Ca 0.25 -1.74 -0.38 0.00 -0.26 0.00 0.00 60.65 58.52 1upt s ILE 46 Cb 0.07 -1.51 -0.17 0.00 1.25 0.00 0.00 42.46 42.10 1upt s ILE 46 CO 0.03 -0.53 1.48 -2.65 0.24 0.00 0.00 174.94 173.52 1upt n PRO 47 N 0.42 1.07 -2.67 0.37 -0.02 -1.26 -4.83 135.00 128.08 1upt n PRO 47 Ca -0.15 0.39 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 1upt n PRO 47 Cb 0.58 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 1upt n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1upt s THR 48 N 1.64 3.98 -1.13 3.45 2.01 -1.26 -4.93 115.64 119.40 1upt s THR 48 Ca 0.90 0.22 -0.07 0.00 0.31 0.00 0.00 61.69 63.06 1upt s THR 48 Cb -1.03 -4.80 0.27 0.00 0.01 0.00 0.00 72.50 66.96 1upt s THR 48 CO 0.55 -1.63 1.43 -0.38 -0.69 0.00 0.00 174.62 173.90 1upt n ILE 49 N 6.26 4.91 0.00 1.82 2.08 -1.26 -4.17 119.36 128.99 1upt n ILE 49 Ca 0.01 -5.48 0.00 0.00 0.56 0.00 0.00 62.75 57.84 1upt n ILE 49 Cb 0.48 -2.29 0.00 0.00 -0.75 0.00 0.00 39.64 37.08 1upt n ILE 49 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1upt n GLY 50 N 2.12 0.16 3.52 7.39 0.00 -1.26 -5.07 105.19 112.05 1upt n GLY 50 Ca 0.28 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 1upt n GLY 50 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1upt s PHE 51 N -0.02 -0.33 0.04 1.61 -0.12 -1.26 -2.18 117.98 115.72 1upt s PHE 51 Ca 0.00 0.03 0.09 0.00 -0.05 0.00 0.00 56.93 57.00 1upt s PHE 51 Cb 0.00 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 42.88 1upt s PHE 51 CO 0.00 -0.93 -0.24 -0.80 -0.05 0.00 0.00 175.22 173.19 1upt s ASN 52 N -2.82 2.92 -0.03 1.98 -0.87 -0.11 -4.99 114.94 111.03 1upt s ASN 52 Ca 0.05 -0.56 0.01 0.00 -1.57 0.00 0.00 52.86 50.79 1upt s ASN 52 Cb -0.02 -0.26 0.02 0.00 -0.02 0.00 0.00 41.25 40.97 1upt s ASN 52 CO -0.06 0.23 -0.02 0.54 -2.57 0.00 0.00 177.10 175.21 1upt s VAL 53 N -0.80 0.34 0.04 1.60 0.11 -1.26 -0.06 120.40 120.37 1upt s VAL 53 Ca 0.10 -0.03 -0.02 0.00 -2.93 0.00 0.00 61.98 59.10 1upt s VAL 53 Cb -0.10 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1upt s VAL 53 CO 0.02 0.17 0.00 -1.61 -3.33 0.00 0.00 175.10 170.35 1upt s GLU 54 N 0.81 0.52 0.12 1.54 0.41 -0.71 -4.98 118.70 116.42 1upt s GLU 54 Ca -0.09 -0.92 -0.18 0.00 -0.41 0.00 0.00 54.97 53.37 1upt s GLU 54 Cb -0.12 0.19 -0.07 0.00 -1.78 0.00 0.00 34.13 32.34 1upt s GLU 54 CO -0.01 -0.10 0.59 0.99 -0.49 0.00 0.00 175.26 176.24 1upt s THR 55 N -2.88 4.75 -0.05 3.63 2.01 -1.26 -1.23 115.64 120.61 1upt s THR 55 Ca -0.03 1.10 -0.02 0.00 0.31 0.00 0.00 61.69 63.05 1upt s THR 55 Cb 0.00 -3.84 0.03 0.00 0.01 0.00 0.00 72.50 68.71 1upt s THR 55 CO -0.06 0.39 0.10 -0.69 -0.69 0.00 0.00 174.62 173.67 1upt s VAL 56 N -1.30 -0.04 -0.13 3.82 1.01 -0.18 -4.93 120.40 118.64 1upt s VAL 56 Ca 0.34 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.47 1upt s VAL 56 Cb -0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 1upt s VAL 56 CO 0.19 0.06 -0.11 -0.89 0.00 0.00 0.00 175.10 174.36 1upt s THR 57 N 0.93 3.25 -0.14 3.92 2.01 -1.26 -0.23 115.64 124.12 1upt s THR 57 Ca -0.07 -0.60 -0.03 0.00 0.31 0.00 0.00 61.69 61.31 1upt s THR 57 Cb -0.10 -2.37 0.05 0.00 0.01 0.00 0.00 72.50 70.09 1upt s THR 57 CO -0.04 0.52 0.03 -0.47 -0.69 0.00 0.00 174.62 173.98 1upt s TYR 58 N 0.28 0.70 -1.36 4.92 5.04 -0.74 -4.83 117.35 121.37 1upt s TYR 58 Ca -0.08 -0.46 -0.08 0.00 -2.44 0.00 0.00 57.07 54.01 1upt s TYR 58 Cb -0.15 -0.86 0.02 0.00 0.35 0.00 0.00 41.96 41.32 1upt s TYR 58 CO 0.05 -0.47 1.11 1.63 -1.34 0.00 0.00 175.55 176.52 1upt n LYS 59 N 5.14 -7.26 -1.14 4.97 4.76 -1.26 -2.35 118.16 121.01 1upt n LYS 59 Ca -0.08 0.79 -0.05 0.00 -2.87 0.00 0.00 58.31 56.10 1upt n LYS 59 Cb 0.49 -5.79 -0.02 0.00 -1.84 0.00 0.00 35.03 27.86 1upt n LYS 59 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1upt n ASN 60 N -3.01 -5.88 -4.63 4.39 4.13 -1.26 -4.97 115.26 104.04 1upt n ASN 60 Ca -0.05 0.12 -0.38 0.00 1.68 0.00 0.00 54.58 55.95 1upt n ASN 60 Cb 0.58 -3.80 -0.09 0.00 -1.54 0.00 0.00 39.78 34.92 1upt n ASN 60 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1upt s LEU 61 N -1.10 4.07 -0.02 3.41 0.20 -0.99 -5.08 118.68 119.16 1upt s LEU 61 Ca 0.00 0.27 -0.15 0.00 0.69 0.00 0.00 54.13 54.94 1upt s LEU 61 Cb 0.00 -2.36 -0.05 0.00 -0.43 0.00 0.00 46.19 43.35 1upt s LEU 61 CO 0.00 -0.10 0.41 -0.75 -0.29 0.00 0.00 176.35 175.62 1upt s LYS 62 N 1.71 4.00 -0.02 1.98 2.20 -1.26 -1.79 119.74 126.55 1upt s LYS 62 Ca 0.14 0.40 0.03 0.00 -0.36 0.00 0.00 55.97 56.18 1upt s LYS 62 Cb -0.15 -3.26 -0.00 0.00 -1.51 0.00 0.00 37.83 32.90 1upt s LYS 62 CO 0.09 0.60 -0.11 -0.06 -0.36 0.00 0.00 175.35 175.50 1upt s PHE 63 N -0.77 1.07 -0.30 4.03 0.08 0.68 -4.31 117.98 118.47 1upt s PHE 63 Ca 0.24 -0.25 -0.17 0.00 0.12 0.00 0.00 56.93 56.86 1upt s PHE 63 Cb -0.16 -0.73 -0.02 0.00 -0.57 0.00 0.00 43.02 41.54 1upt s PHE 63 CO 0.12 -0.08 0.48 -1.14 -0.10 0.00 0.00 175.22 174.51 1upt s GLN 64 N -0.00 3.87 -0.19 0.44 0.74 -1.26 -1.01 119.66 122.25 1upt s GLN 64 Ca -0.00 0.06 -0.01 0.00 0.05 0.00 0.00 55.36 55.46 1upt s GLN 64 Cb -0.07 -3.72 0.00 0.00 1.10 0.00 0.00 33.01 30.32 1upt s GLN 64 CO 0.00 -0.46 -0.12 0.08 -0.55 0.00 0.00 175.29 174.25 1upt s VAL 65 N 2.29 2.78 -0.14 1.34 1.01 -0.36 -1.24 120.40 126.08 1upt s VAL 65 Ca 0.19 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 1upt s VAL 65 Cb -0.16 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 1upt s VAL 65 CO 0.11 0.49 0.07 0.26 0.00 0.00 0.00 175.10 176.02 1upt s TRP 66 N 1.23 3.31 -0.29 5.22 0.52 -0.27 -1.73 118.94 126.93 1upt s TRP 66 Ca 0.02 0.22 0.03 0.00 0.02 0.00 0.00 56.10 56.40 1upt s TRP 66 Cb -0.14 -1.97 0.07 0.00 -1.15 0.00 0.00 33.47 30.28 1upt s TRP 66 CO -0.05 0.38 -0.05 0.34 0.02 0.00 0.00 176.95 177.59 1upt s ASP 67 N -0.29 4.57 -0.13 2.95 2.15 0.91 0.10 116.67 126.93 1upt s ASP 67 Ca 0.09 -1.68 -0.09 0.00 0.43 0.00 0.00 52.55 51.30 1upt s ASP 67 Cb -0.12 -1.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.87 1upt s ASP 67 CO 0.02 -0.26 0.18 -0.76 -0.17 0.00 0.00 175.17 174.17 1upt s LEU 68 N 1.03 4.35 0.44 -1.34 1.43 -1.03 -0.93 118.68 122.62 1upt s LEU 68 Ca -0.02 0.47 -0.25 0.00 -1.03 0.00 0.00 54.13 53.30 1upt s LEU 68 Cb -0.20 -2.16 -0.08 0.00 0.03 0.00 0.00 46.19 43.79 1upt s LEU 68 CO -0.06 0.32 1.39 -0.83 0.23 0.00 0.00 176.35 177.40 1upt s GLY 69 N -0.59 2.92 0.00 -3.19 0.00 -0.93 -4.76 107.32 100.77 1upt s GLY 69 Ca 0.14 1.39 0.17 0.00 0.00 0.00 0.00 44.72 46.43 1upt s GLY 69 CO 0.04 1.99 1.36 0.61 0.00 0.00 0.00 173.10 177.10 1upt n GLY 70 N 0.60 2.33 3.75 0.20 0.00 -1.26 -4.50 105.19 106.32 1upt n GLY 70 Ca 0.05 -0.58 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1upt n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1upt s LEU 71 N -1.06 3.88 0.22 0.99 1.43 -1.26 -2.02 118.68 120.86 1upt s LEU 71 Ca 0.34 2.70 -0.14 0.00 -1.03 0.00 0.00 54.13 56.01 1upt s LEU 71 Cb 0.18 -4.26 0.26 0.00 0.03 0.00 0.00 46.19 42.40 1upt s LEU 71 CO 0.24 -1.46 1.60 0.74 0.23 0.00 0.00 176.35 177.70 1upt h THR 72 N 1.53 0.23 0.00 5.49 2.02 -2.00 -1.76 112.91 118.42 1upt h THR 72 Ca -0.51 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1upt h THR 72 Cb 1.29 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1upt h THR 72 CO 0.58 0.00 0.00 0.77 0.37 0.00 0.00 175.52 177.24 1upt h SER 73 N -0.04 0.00 -0.01 4.18 4.64 -1.99 -3.04 113.55 117.29 1upt h SER 73 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1upt h SER 73 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1upt h SER 73 CO -0.75 0.00 -0.10 2.30 -0.87 0.00 0.00 176.83 177.41 1upt n ILE 74 N -2.72 0.00 0.01 0.95 -5.35 -0.72 -4.51 119.36 107.03 1upt n ILE 74 Ca 0.01 -0.45 0.04 0.00 -0.27 0.00 0.00 62.75 62.08 1upt n ILE 74 Cb 0.26 1.17 0.43 0.00 -1.74 0.00 0.00 39.64 39.77 1upt n ILE 74 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 1upt h ARG 75 N 1.65 0.53 0.00 6.28 3.08 -1.29 -2.42 114.38 122.20 1upt h ARG 75 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1upt h ARG 75 Cb 0.40 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1upt h ARG 75 CO 0.00 0.35 0.00 -1.35 -1.07 0.00 0.00 179.97 177.90 1upt h PRO 76 N 0.54 0.00 -0.01 0.04 0.11 -1.79 -2.39 132.00 128.50 1upt h PRO 76 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1upt h PRO 76 Cb -0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1upt h PRO 76 CO -0.03 0.00 -0.32 0.66 -0.21 0.00 0.00 178.00 178.10 1upt n TYR 77 N -2.48 0.00 -0.28 0.65 4.01 -0.91 -4.15 117.16 114.00 1upt n TYR 77 Ca -0.02 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.80 1upt n TYR 77 Cb 0.05 -0.08 0.23 0.00 -0.31 0.00 0.00 39.34 39.23 1upt n TYR 77 CO 0.00 0.00 0.00 -1.49 -0.46 0.00 0.00 176.86 174.91 1upt h TRP 78 N 1.62 0.53 0.00 -0.72 6.55 -1.55 -2.28 115.95 120.10 1upt h TRP 78 Ca 0.00 0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.87 1upt h TRP 78 Cb 0.58 -0.11 -0.00 0.00 -0.86 0.00 0.00 29.16 28.77 1upt h TRP 78 CO 0.00 0.00 -0.04 0.07 -1.05 0.00 0.00 178.44 177.43 1upt h ARG 79 N 0.41 0.00 0.00 0.49 0.11 -1.80 -1.15 114.38 112.43 1upt h ARG 79 Ca 0.47 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.55 1upt h ARG 79 Cb 0.80 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.88 1upt h ARG 79 CO -0.47 0.04 -0.03 0.00 0.10 0.00 0.00 179.97 179.61 1upt n TYR 81 N -3.61 0.45 0.21 0.00 4.01 -0.44 -4.63 117.16 113.15 1upt n TYR 81 Ca -0.03 -0.23 0.10 0.00 -0.16 0.00 0.00 57.90 57.59 1upt n TYR 81 Cb 0.12 0.00 0.23 0.00 -0.31 0.00 0.00 39.34 39.38 1upt n TYR 81 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1upt h TYR 82 N 4.21 0.00 -1.84 -0.72 0.05 -1.59 -3.45 116.97 113.63 1upt h TYR 82 Ca 0.00 0.00 -0.66 0.00 0.05 0.00 0.00 58.73 58.12 1upt h TYR 82 Cb 0.93 0.00 0.04 0.00 1.01 0.00 0.00 36.73 38.70 1upt h TYR 82 CO 0.23 0.14 0.75 0.43 -1.05 0.00 0.00 178.16 178.65 1upt n SER 83 N -3.16 2.46 -1.96 3.88 7.64 -1.26 -2.45 113.62 118.77 1upt n SER 83 Ca 0.03 1.08 -0.16 0.00 1.01 0.00 0.00 58.87 60.82 1upt n SER 83 Cb 0.54 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 1upt n SER 83 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1upt n ASN 84 N 4.12 -4.79 -4.69 6.43 3.02 -1.26 -4.97 115.26 113.12 1upt n ASN 84 Ca 0.21 -0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 1upt n ASN 84 Cb 0.21 -3.83 -0.03 0.00 -0.61 0.00 0.00 39.78 35.52 1upt n ASN 84 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1upt s THR 85 N -2.86 4.87 0.04 3.41 2.01 -1.02 -4.55 115.64 117.53 1upt s THR 85 Ca 0.08 1.80 0.00 0.00 0.31 0.00 0.00 61.69 63.88 1upt s THR 85 Cb -0.03 -4.21 -0.26 0.00 0.01 0.00 0.00 72.50 68.01 1upt s THR 85 CO 0.10 0.06 0.98 0.44 -0.69 0.00 0.00 174.62 175.51 1upt h ASP 86 N 7.12 0.27 -5.01 3.53 3.32 -1.27 -3.41 116.42 120.98 1upt h ASP 86 Ca -0.32 -0.35 -0.10 0.00 0.02 0.00 0.00 57.03 56.28 1upt h ASP 86 Cb 1.15 -0.09 -0.19 0.00 0.22 0.00 0.00 39.33 40.43 1upt h ASP 86 CO 0.83 1.29 -0.16 0.00 -1.72 0.00 0.00 179.24 179.47 1upt s ALA 87 N -2.64 -0.97 -0.12 3.45 0.00 -1.18 -1.86 121.76 118.43 1upt s ALA 87 Ca -0.05 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.35 1upt s ALA 87 Cb 0.08 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.33 1upt s ALA 87 CO 0.85 -0.34 -0.14 0.08 0.00 0.00 0.00 175.76 176.21 1upt s VAL 88 N -1.70 2.99 -0.45 0.00 1.01 0.10 -1.69 120.40 120.66 1upt s VAL 88 Ca -0.10 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 61.02 1upt s VAL 88 Cb -0.03 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.15 1upt s VAL 88 CO 0.03 0.53 0.44 -0.63 0.00 0.00 0.00 175.10 175.46 1upt s ILE 89 N 0.31 5.12 -0.41 2.22 1.01 0.37 -1.25 121.20 128.56 1upt s ILE 89 Ca -0.11 -0.61 -0.15 0.00 0.00 0.00 0.00 60.65 59.78 1upt s ILE 89 Cb -0.16 -4.09 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1upt s ILE 89 CO 0.06 -0.51 0.31 -0.47 0.00 0.00 0.00 174.94 174.32 1upt s TYR 90 N 2.02 3.24 -0.14 3.97 5.04 0.29 -1.20 117.35 130.56 1upt s TYR 90 Ca 0.09 -0.61 -0.17 0.00 -2.44 0.00 0.00 57.07 53.94 1upt s TYR 90 Cb -0.20 -2.62 -0.04 0.00 0.35 0.00 0.00 41.96 39.45 1upt s TYR 90 CO 0.11 -0.60 0.42 0.08 -1.34 0.00 0.00 175.55 174.21 1upt s VAL 91 N 1.68 5.22 -0.07 3.14 1.01 -0.22 -0.84 120.40 130.33 1upt s VAL 91 Ca 0.05 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.86 1upt s VAL 91 Cb -0.19 -3.76 0.02 0.00 0.00 0.00 0.00 36.38 32.45 1upt s VAL 91 CO 0.10 0.34 -0.11 -0.69 0.00 0.00 0.00 175.10 174.74 1upt s VAL 92 N 0.63 1.07 -0.22 2.92 1.01 -0.23 -4.20 120.40 121.38 1upt s VAL 92 Ca 0.23 -0.42 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 1upt s VAL 92 Cb -0.14 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 1upt s VAL 92 CO 0.08 0.35 1.57 -0.62 0.00 0.00 0.00 175.10 176.48 1upt s ASP 93 N 0.84 6.45 0.31 3.32 -1.08 -1.26 -0.50 116.67 124.74 1upt s ASP 93 Ca -0.11 1.62 0.25 0.00 -0.52 0.00 0.00 52.55 53.78 1upt s ASP 93 Cb -0.15 -2.53 1.09 0.00 -1.46 0.00 0.00 42.92 39.87 1upt s ASP 93 CO 0.02 -1.20 1.74 0.28 0.52 0.00 0.00 175.17 176.53 1upt h SER 94 N 10.41 0.00 0.04 -0.34 0.02 -1.52 -2.74 113.55 119.44 1upt h SER 94 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1upt h SER 94 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1upt h SER 94 CO 1.00 0.00 -0.75 0.00 -1.14 0.00 0.00 176.83 175.95 1upt n ASP 96 N -0.95 5.38 0.09 0.00 -0.08 -1.03 -4.79 116.55 115.16 1upt n ASP 96 Ca 0.06 -3.08 0.02 0.00 -1.51 0.00 0.00 54.79 50.29 1upt n ASP 96 Cb 0.38 -1.48 0.39 0.00 2.34 0.00 0.00 41.12 42.75 1upt n ASP 96 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1upt h ARG 97 N 6.44 0.32 0.00 -0.67 3.08 -1.86 -2.98 114.38 118.71 1upt h ARG 97 Ca 0.31 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.26 1upt h ARG 97 Cb 0.77 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 1upt h ARG 97 CO 1.33 0.39 -0.14 -0.44 -1.07 0.00 0.00 179.97 180.04 1upt h ASP 98 N 0.32 0.00 -0.08 7.04 3.32 -1.99 -3.24 116.42 121.78 1upt h ASP 98 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1upt h ASP 98 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1upt h ASP 98 CO 0.01 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 178.22 1upt n ARG 99 N -3.37 1.40 0.12 3.56 1.74 -1.14 -4.61 116.66 114.36 1upt n ARG 99 Ca -0.00 -1.29 0.03 0.00 -0.77 0.00 0.00 57.85 55.81 1upt n ARG 99 Cb 0.34 -1.11 0.43 0.00 -1.02 0.00 0.00 32.46 31.10 1upt n ARG 99 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1upt h ILE 100 N 0.93 1.15 -0.40 0.55 2.10 -1.56 -0.68 117.51 119.61 1upt h ILE 100 Ca 0.00 -0.61 -0.02 0.00 1.08 0.00 0.00 64.86 65.31 1upt h ILE 100 Cb 0.41 1.10 -0.02 0.00 -1.09 0.00 0.00 36.82 37.23 1upt h ILE 100 CO 0.00 0.20 0.16 1.23 -1.08 0.00 0.00 178.15 178.66 1upt h GLY 101 N 0.63 0.60 0.93 8.18 0.00 -1.82 0.75 103.07 112.33 1upt h GLY 101 Ca 0.05 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 47.00 1upt h GLY 101 CO 0.01 0.26 -0.23 -2.22 0.00 0.00 0.00 176.54 174.37 1upt h ILE 102 N 0.56 1.30 -0.95 2.60 1.08 -1.48 -2.19 117.51 118.43 1upt h ILE 102 Ca 0.14 -1.37 0.09 0.00 -0.39 0.00 0.00 64.86 63.33 1upt h ILE 102 Cb 0.11 1.57 -0.07 0.00 -3.07 0.00 0.00 36.82 35.36 1upt h ILE 102 CO -0.02 0.44 0.60 0.28 -0.69 0.00 0.00 178.15 178.76 1upt h SER 103 N 0.38 0.90 -0.22 1.72 0.02 -0.65 -1.65 113.55 114.05 1upt h SER 103 Ca 0.05 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1upt h SER 103 Cb 0.78 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1upt h SER 103 CO 0.06 0.53 0.09 0.50 -1.14 0.00 0.00 176.83 176.86 1upt h LYS 104 N 1.01 0.32 -0.28 3.45 3.64 -0.76 -2.23 116.57 121.73 1upt h LYS 104 Ca 0.44 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.66 1upt h LYS 104 Cb 0.33 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1upt h LYS 104 CO -0.22 0.38 -0.26 0.66 -2.27 0.00 0.00 179.45 177.74 1upt h SER 105 N 0.20 0.56 -0.26 4.20 4.64 -0.97 -0.26 113.55 121.66 1upt h SER 105 Ca 0.07 -0.20 -0.12 0.00 -0.47 0.00 0.00 61.79 61.08 1upt h SER 105 Cb 0.18 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1upt h SER 105 CO -0.01 0.81 -0.25 -0.33 -0.87 0.00 0.00 176.83 176.19 1upt h GLU 106 N 0.48 0.75 -0.37 4.77 4.39 -1.30 -1.99 114.58 121.31 1upt h GLU 106 Ca 0.07 -0.31 -0.11 0.00 0.34 0.00 0.00 59.36 59.35 1upt h GLU 106 Cb 0.71 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1upt h GLU 106 CO 0.05 0.92 -0.20 1.25 -1.16 0.00 0.00 179.01 179.88 1upt h LEU 107 N 0.65 0.81 -0.40 1.33 5.85 -0.90 -3.13 115.31 119.52 1upt h LEU 107 Ca 0.09 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1upt h LEU 107 Cb 0.76 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1upt h LEU 107 CO 0.06 1.05 0.22 0.58 -0.34 0.00 0.00 178.44 180.01 1upt h VAL 108 N 0.58 1.15 0.00 1.05 2.07 -0.99 -1.94 116.25 118.17 1upt h VAL 108 Ca 0.08 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1upt h VAL 108 Cb 0.75 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1upt h VAL 108 CO 0.06 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.80 1upt n ALA 109 N -2.25 1.63 0.00 1.67 0.00 -0.76 -3.12 120.51 117.68 1upt n ALA 109 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1upt n ALA 109 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1upt n ALA 109 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1upt n LEU 111 N 0.70 0.00 -0.10 0.00 4.77 -0.73 -3.94 117.00 117.69 1upt n LEU 111 Ca 0.00 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.12 1upt n LEU 111 Cb 0.11 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 41.77 1upt n LEU 111 CO 0.00 0.00 0.84 -0.62 -1.33 0.00 0.00 177.39 176.28 1upt n GLU 112 N 0.00 0.58 -2.60 3.23 1.02 -1.18 -4.88 120.64 116.80 1upt n GLU 112 Ca 0.00 -0.20 -0.42 0.00 -0.02 0.00 0.00 57.16 56.51 1upt n GLU 112 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 1upt n GLU 112 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1upt s GLU 113 N -2.56 4.43 0.48 3.49 0.41 -1.25 -4.94 118.70 118.76 1upt s GLU 113 Ca 0.26 1.51 0.18 0.00 -0.41 0.00 0.00 54.97 56.51 1upt s GLU 113 Cb 0.20 -3.51 1.19 0.00 -1.78 0.00 0.00 34.13 30.23 1upt s GLU 113 CO 0.50 -0.29 2.05 1.49 -0.49 0.00 0.00 175.26 178.52 1upt h GLU 114 N 7.10 0.00 0.00 1.61 4.81 -1.98 -1.93 114.58 124.19 1upt h GLU 114 Ca -0.35 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.85 1upt h GLU 114 Cb 1.17 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.55 1upt h GLU 114 CO 0.83 0.13 -0.13 0.93 -0.73 0.00 0.00 179.01 180.05 1upt h GLU 115 N 0.00 0.00 -0.63 1.92 5.08 -1.92 -2.36 114.58 116.68 1upt h GLU 115 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1upt h GLU 115 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1upt h GLU 115 CO 0.02 0.13 0.00 1.28 -1.00 0.00 0.00 179.01 179.44 1upt n LEU 116 N -3.79 3.66 -0.32 1.33 4.77 -0.73 -4.61 117.00 117.32 1upt n LEU 116 Ca -0.02 -1.84 0.10 0.00 -0.03 0.00 0.00 56.01 54.22 1upt n LEU 116 Cb 0.24 -0.47 0.26 0.00 -2.33 0.00 0.00 43.42 41.13 1upt n LEU 116 CO 0.31 0.77 1.12 -0.09 -1.33 0.00 0.00 177.39 178.18 1upt h ARG 117 N 3.56 0.62 -0.38 3.23 2.43 -1.41 -1.65 114.38 120.79 1upt h ARG 117 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1upt h ARG 117 Cb 1.02 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1upt h ARG 117 CO 0.09 0.41 0.00 1.63 -1.51 0.00 0.00 179.97 180.59 1upt n LYS 118 N -4.86 2.38 -2.19 0.20 5.02 -1.26 -4.97 118.16 112.48 1upt n LYS 118 Ca 0.20 -2.08 -0.39 0.00 -2.02 0.00 0.00 58.31 54.02 1upt n LYS 118 Cb 0.50 -1.38 -0.01 0.00 -0.02 0.00 0.00 35.03 34.12 1upt n LYS 118 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1upt s ALA 119 N -1.11 3.18 0.26 7.82 0.00 -0.62 -4.96 121.76 126.33 1upt s ALA 119 Ca 0.30 1.07 -0.28 0.00 0.00 0.00 0.00 51.96 53.05 1upt s ALA 119 Cb 0.17 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.77 1upt s ALA 119 CO 0.23 -0.66 0.92 0.42 0.00 0.00 0.00 175.76 176.67 1upt s ILE 120 N -1.35 4.16 -0.21 0.00 1.01 -0.78 -4.68 121.20 119.35 1upt s ILE 120 Ca 0.57 1.94 -0.04 0.00 0.00 0.00 0.00 60.65 63.12 1upt s ILE 120 Cb -0.34 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 37.92 1upt s ILE 120 CO 0.42 0.39 -0.03 -0.22 0.00 0.00 0.00 174.94 175.50 1upt s LEU 121 N -1.46 3.01 -0.13 2.97 2.96 -0.45 -0.72 118.68 124.84 1upt s LEU 121 Ca 0.43 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 54.04 1upt s LEU 121 Cb -0.23 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.70 1upt s LEU 121 CO 0.29 0.01 -0.21 0.54 -1.32 0.00 0.00 176.35 175.65 1upt s VAL 122 N 1.30 2.15 -0.27 1.68 0.11 -0.38 -2.37 120.40 122.61 1upt s VAL 122 Ca 0.04 -0.96 -0.10 0.00 -2.93 0.00 0.00 61.98 58.02 1upt s VAL 122 Cb -0.14 -1.86 -0.05 0.00 -1.53 0.00 0.00 36.38 32.80 1upt s VAL 122 CO -0.01 0.55 0.17 -0.69 -3.33 0.00 0.00 175.10 171.79 1upt s VAL 123 N 0.69 5.17 -0.52 2.04 1.01 -0.11 -0.55 120.40 128.13 1upt s VAL 123 Ca -0.10 0.12 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 1upt s VAL 123 Cb -0.16 -3.45 0.08 0.00 0.00 0.00 0.00 36.38 32.84 1upt s VAL 123 CO 0.01 0.27 0.59 -0.36 0.00 0.00 0.00 175.10 175.61 1upt s PHE 124 N 1.71 3.09 -1.01 5.22 0.40 -0.02 -0.93 117.98 126.43 1upt s PHE 124 Ca 0.07 -0.76 -0.23 0.00 -0.60 0.00 0.00 56.93 55.41 1upt s PHE 124 Cb -0.16 -3.59 0.01 0.00 0.51 0.00 0.00 43.02 39.79 1upt s PHE 124 CO 0.10 -1.04 1.69 0.00 0.70 0.00 0.00 175.22 176.66 1upt s ALA 125 N 2.38 2.32 0.55 5.36 0.00 0.01 -1.07 121.76 131.31 1upt s ALA 125 Ca 0.11 -2.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.01 1upt s ALA 125 Cb -0.22 -4.56 0.02 0.00 0.00 0.00 0.00 23.12 18.36 1upt s ALA 125 CO 0.09 -4.13 0.82 1.21 0.00 0.00 0.00 175.76 173.74 1upt s ASN 126 N 6.13 5.49 -0.78 0.00 2.47 0.34 -1.47 114.94 127.12 1upt s ASN 126 Ca 0.57 0.40 -0.02 0.00 0.42 0.00 0.00 52.86 54.22 1upt s ASN 126 Cb -0.02 -1.40 0.00 0.00 -1.45 0.00 0.00 41.25 38.38 1upt s ASN 126 CO -0.04 -1.04 0.28 0.29 -3.72 0.00 0.00 177.10 172.87 1upt n LYS 127 N -2.43 -2.30 0.00 0.43 5.02 -0.90 -1.35 118.16 116.63 1upt n LYS 127 Ca 0.05 0.46 0.13 0.00 -2.02 0.00 0.00 58.31 56.92 1upt n LYS 127 Cb 0.58 -4.39 0.59 0.00 -0.02 0.00 0.00 35.03 31.80 1upt n LYS 127 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1upt n GLN 128 N -2.34 0.14 -0.31 1.97 1.13 -0.68 -4.72 117.38 112.56 1upt n GLN 128 Ca -0.06 0.05 -0.03 0.00 -1.94 0.00 0.00 57.00 55.02 1upt n GLN 128 Cb 0.56 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.38 1upt n GLN 128 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1upt n ASP 129 N -1.42 2.09 -0.05 1.08 5.75 -1.26 -4.94 116.55 117.80 1upt n ASP 129 Ca 0.08 -1.74 -0.06 0.00 -0.01 0.00 0.00 54.79 53.07 1upt n ASP 129 Cb 0.27 -0.51 -0.06 0.00 -1.03 0.00 0.00 41.12 39.79 1upt n ASP 129 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1upt n GLU 131 N 2.36 1.59 0.00 0.11 1.02 -1.26 -5.07 120.64 119.39 1upt n GLU 131 Ca 0.10 0.03 0.13 0.00 -0.02 0.00 0.00 57.16 57.39 1upt n GLU 131 Cb 0.29 -1.22 0.42 0.00 -0.02 0.00 0.00 31.44 30.91 1upt n GLU 131 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1upt n GLN 132 N -2.54 0.56 0.00 3.49 0.00 -1.26 -5.15 117.38 112.47 1upt n GLN 132 Ca -0.16 -0.28 0.00 0.00 0.00 0.00 0.00 57.00 56.55 1upt n GLN 132 Cb 0.75 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.50 1upt n GLN 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1upt n ALA 133 N -0.97 0.00 -2.59 2.61 0.00 -1.26 -4.79 120.51 113.50 1upt n ALA 133 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.29 1upt n ALA 133 Cb 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.69 1upt n ALA 133 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1upt s THR 135 N 0.00 3.28 0.27 0.00 -4.23 -1.26 -4.98 115.64 108.72 1upt s THR 135 Ca 0.00 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1upt s THR 135 Cb 0.00 -2.66 0.26 0.00 1.34 0.00 0.00 72.50 71.43 1upt s THR 135 CO 0.00 -0.19 1.74 -1.28 -0.54 0.00 0.00 174.62 174.35 1upt h SER 136 N 2.59 0.45 0.33 3.99 0.87 -1.98 -2.56 113.55 117.24 1upt h SER 136 Ca -0.46 0.11 -0.22 0.00 -1.23 0.00 0.00 61.79 60.00 1upt h SER 136 Cb 1.22 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1upt h SER 136 CO 0.56 0.14 -0.91 0.77 -0.53 0.00 0.00 176.83 176.86 1upt h SER 137 N 0.54 0.52 0.00 6.23 4.64 -2.04 -0.16 113.55 123.28 1upt h SER 137 Ca 0.49 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1upt h SER 137 Cb 0.79 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1upt h SER 137 CO -0.42 1.20 0.00 1.21 -0.87 0.00 0.00 176.83 177.95 1upt n GLU 138 N -3.75 0.00 0.00 4.77 2.13 -0.97 -2.22 120.64 120.60 1upt n GLU 138 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 1upt n GLU 138 Cb 0.82 -0.98 0.00 0.00 0.27 0.00 0.00 31.44 31.55 1upt n GLU 138 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1upt n ALA 140 N 0.34 0.00 -0.10 4.31 0.00 -0.07 -0.86 120.51 124.12 1upt n ALA 140 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1upt n ALA 140 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1upt n ALA 140 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1upt h ASN 141 N 0.00 0.83 0.56 0.00 2.35 -1.71 -1.37 115.58 116.24 1upt h ASN 141 Ca 0.00 -0.47 -0.04 0.00 -0.55 0.00 0.00 56.30 55.24 1upt h ASN 141 Cb 0.00 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1upt h ASN 141 CO 0.00 1.12 -0.20 0.28 -1.65 0.00 0.00 177.43 176.99 1upt h SER 142 N 0.55 0.00 0.39 5.81 0.02 -1.27 -2.11 113.55 116.95 1upt h SER 142 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1upt h SER 142 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1upt h SER 142 CO 0.08 0.20 -0.27 0.18 -1.14 0.00 0.00 176.83 175.88 1upt n LEU 143 N -3.62 0.68 -1.26 5.07 4.77 -1.17 -4.73 117.00 116.75 1upt n LEU 143 Ca -0.01 -0.07 -0.11 0.00 -0.03 0.00 0.00 56.01 55.78 1upt n LEU 143 Cb 0.33 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1upt n LEU 143 CO 0.32 0.14 -0.14 0.61 -1.33 0.00 0.00 177.39 176.99 1upt n GLY 144 N 1.38 0.05 0.17 -0.72 0.00 -0.79 -4.77 105.19 100.51 1upt n GLY 144 Ca 0.10 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 1upt n GLY 144 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1upt h LEU 145 N 0.00 0.48 -1.97 0.99 3.38 -1.50 -2.05 115.31 114.64 1upt h LEU 145 Ca -0.27 -0.29 0.09 0.00 0.09 0.00 0.00 57.88 57.50 1upt h LEU 145 Cb 1.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1upt h LEU 145 CO 0.32 0.65 0.42 -0.65 0.09 0.00 0.00 178.44 179.27 1upt h PRO 146 N 0.29 0.00 0.00 1.13 0.11 -1.93 -1.78 132.00 129.82 1upt h PRO 146 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1upt h PRO 146 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1upt h PRO 146 CO 0.01 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 177.64 1upt n ALA 147 N -2.21 2.65 -2.08 -0.75 0.00 -0.77 -4.91 120.51 112.44 1upt n ALA 147 Ca 0.05 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 1upt n ALA 147 Cb 0.56 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 1upt n ALA 147 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1upt s LEU 148 N -3.33 4.38 -0.02 0.00 1.43 -0.67 -5.01 118.68 115.46 1upt s LEU 148 Ca 0.12 2.41 -0.06 0.00 -1.03 0.00 0.00 54.13 55.57 1upt s LEU 148 Cb 0.17 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 1upt s LEU 148 CO 0.59 -0.66 0.23 -0.54 0.23 0.00 0.00 176.35 176.20 1upt s LYS 149 N 0.76 3.53 -1.41 1.70 -0.14 -1.26 -4.58 119.74 118.33 1upt s LYS 149 Ca 0.63 -0.13 -0.05 0.00 -1.36 0.00 0.00 55.97 55.06 1upt s LYS 149 Cb -0.38 -3.11 0.03 0.00 -1.68 0.00 0.00 37.83 32.69 1upt s LYS 149 CO 0.33 0.68 0.72 -0.25 -0.76 0.00 0.00 175.35 176.07 1upt n ASP 150 N 1.27 -2.05 -3.78 2.83 8.00 -1.26 -4.95 116.55 116.61 1upt n ASP 150 Ca -0.13 -0.86 -0.19 0.00 0.71 0.00 0.00 54.79 54.32 1upt n ASP 150 Cb 0.53 -3.70 -0.17 0.00 -0.02 0.00 0.00 41.12 37.76 1upt n ASP 150 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1upt s ARG 151 N -6.34 0.29 -0.30 -1.24 6.06 -1.26 -4.98 118.95 111.19 1upt s ARG 151 Ca 0.22 0.14 -0.27 0.00 -2.50 0.00 0.00 55.73 53.32 1upt s ARG 151 Cb -0.11 -0.59 0.01 0.00 0.06 0.00 0.00 34.95 34.32 1upt s ARG 151 CO 0.84 -0.20 0.98 0.21 -2.50 0.00 0.00 175.30 174.62 1upt s LYS 152 N 1.43 4.06 0.05 5.12 2.47 -1.26 -5.04 119.74 126.57 1upt s LYS 152 Ca -0.04 0.96 -0.12 0.00 -1.56 0.00 0.00 55.97 55.21 1upt s LYS 152 Cb -0.13 -3.72 0.01 0.00 -1.46 0.00 0.00 37.83 32.54 1upt s LYS 152 CO -0.03 -0.78 0.26 1.67 0.16 0.00 0.00 175.35 176.63 1upt s TRP 153 N 3.35 -0.04 0.04 4.03 1.48 -1.26 -1.35 118.94 125.21 1upt s TRP 153 Ca 0.41 -0.16 -0.13 0.00 -1.06 0.00 0.00 56.10 55.16 1upt s TRP 153 Cb -0.13 0.05 0.02 0.00 -1.16 0.00 0.00 33.47 32.25 1upt s TRP 153 CO 0.13 -0.49 0.29 -1.14 -4.06 0.00 0.00 176.95 171.68 1upt s GLN 154 N -2.71 0.80 -0.05 3.25 2.00 -1.00 -5.02 119.66 116.93 1upt s GLN 154 Ca -0.04 -0.52 0.03 0.00 -2.00 0.00 0.00 55.36 52.84 1upt s GLN 154 Cb -0.00 0.34 -0.03 0.00 0.80 0.00 0.00 33.01 34.12 1upt s GLN 154 CO -0.04 -0.25 -0.13 -1.50 -0.50 0.00 0.00 175.29 172.87 1upt s ILE 155 N -2.54 3.20 -0.03 -2.34 2.07 -1.26 -0.93 121.20 119.36 1upt s ILE 155 Ca -0.05 -0.70 0.02 0.00 -1.41 0.00 0.00 60.65 58.52 1upt s ILE 155 Cb -0.01 -2.27 0.01 0.00 0.13 0.00 0.00 42.46 40.31 1upt s ILE 155 CO -0.03 0.57 -0.09 -0.36 -1.91 0.00 0.00 174.94 173.12 1upt s PHE 156 N -0.77 1.00 0.06 3.50 0.08 -0.11 -4.97 117.98 116.77 1upt s PHE 156 Ca 0.12 -0.27 -0.31 0.00 0.12 0.00 0.00 56.93 56.60 1upt s PHE 156 Cb -0.11 -0.72 -0.07 0.00 -0.57 0.00 0.00 43.02 41.55 1upt s PHE 156 CO 0.01 -0.12 1.51 0.15 -0.10 0.00 0.00 175.22 176.67 1upt s LYS 157 N 0.29 4.25 0.09 0.44 1.02 -1.26 -0.81 119.74 123.75 1upt s LYS 157 Ca -0.05 2.16 0.01 0.00 0.02 0.00 0.00 55.97 58.11 1upt s LYS 157 Cb -0.10 -3.50 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 1upt s LYS 157 CO 0.01 -0.62 -0.06 0.95 -0.92 0.00 0.00 175.35 174.71 1upt s THR 158 N 2.21 0.60 -0.20 2.17 -4.23 -0.54 -4.27 115.64 111.38 1upt s THR 158 Ca 0.68 -1.88 -0.02 0.00 -1.18 0.00 0.00 61.69 59.29 1upt s THR 158 Cb -0.37 -1.62 0.06 0.00 1.34 0.00 0.00 72.50 71.92 1upt s THR 158 CO 0.30 -0.88 0.01 -0.55 -0.54 0.00 0.00 174.62 172.96 1upt s SER 159 N -2.97 3.13 0.28 3.99 0.15 -0.54 -1.69 113.70 116.04 1upt s SER 159 Ca 0.10 -0.90 -0.00 0.00 0.70 0.00 0.00 55.95 55.85 1upt s SER 159 Cb 0.05 -0.74 0.39 0.00 -1.71 0.00 0.00 66.02 64.02 1upt s SER 159 CO -0.06 -0.29 1.77 0.00 1.20 0.00 0.00 173.24 175.87 1upt h ALA 160 N 8.17 1.15 0.00 5.45 0.00 -1.93 0.22 119.26 132.32 1upt h ALA 160 Ca -0.17 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.32 1upt h ALA 160 Cb 1.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1upt h ALA 160 CO 0.35 0.54 -0.76 1.79 0.00 0.00 0.00 179.25 181.18 1upt h THR 161 N 0.65 1.47 0.00 0.00 1.35 -1.95 -3.33 112.91 111.10 1upt h THR 161 Ca 0.12 -2.65 -0.30 0.00 -0.55 0.00 0.00 66.41 63.04 1upt h THR 161 Cb 0.46 2.46 -0.06 0.00 -1.73 0.00 0.00 68.15 69.28 1upt h THR 161 CO 0.02 0.74 -2.26 0.29 -0.25 0.00 0.00 175.52 174.07 1upt n LYS 162 N -3.54 0.84 0.00 4.72 4.76 -1.19 -4.81 118.16 118.94 1upt n LYS 162 Ca -0.00 -0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1upt n LYS 162 Cb 0.76 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 1upt n LYS 162 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1upt n GLY 163 N 1.75 1.28 3.78 0.72 0.00 0.75 -5.06 105.19 108.41 1upt n GLY 163 Ca -0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 1upt n GLY 163 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1upt s THR 164 N -2.20 3.47 0.00 2.61 -4.23 -1.16 -3.58 115.64 110.56 1upt s THR 164 Ca 0.00 1.11 0.00 0.00 -1.18 0.00 0.00 61.69 61.62 1upt s THR 164 Cb 0.00 -3.56 0.00 0.00 1.34 0.00 0.00 72.50 70.28 1upt s THR 164 CO 0.00 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1upt n GLY 165 N 0.35 2.97 0.24 3.99 0.00 -1.26 -1.47 105.19 110.02 1upt n GLY 165 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 1upt n GLY 165 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1upt h LEU 166 N 0.00 0.96 -0.35 0.99 5.85 -1.82 -2.82 115.31 118.13 1upt h LEU 166 Ca 0.00 -0.55 -0.11 0.00 0.84 0.00 0.00 57.88 58.06 1upt h LEU 166 Cb 0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1upt h LEU 166 CO 0.00 1.35 -0.21 0.44 -0.34 0.00 0.00 178.44 179.68 1upt h ASP 167 N 0.63 0.78 -0.07 1.25 3.32 -1.89 -2.87 116.42 117.57 1upt h ASP 167 Ca -0.01 -0.42 -0.03 0.00 0.02 0.00 0.00 57.03 56.59 1upt h ASP 167 Cb 1.23 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1upt h ASP 167 CO 0.13 1.04 -0.02 -0.33 -1.72 0.00 0.00 179.24 178.34 1upt h GLU 168 N 0.53 0.26 -0.91 3.56 3.07 -1.97 -0.14 114.58 118.98 1upt h GLU 168 Ca 0.07 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1upt h GLU 168 Cb 0.76 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1upt h GLU 168 CO 0.06 0.31 0.00 0.00 -1.40 0.00 0.00 179.01 177.97 1upt n ALA 169 N -2.50 2.27 0.00 3.43 0.00 -1.06 -2.39 120.51 120.25 1upt n ALA 169 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1upt n ALA 169 Cb 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1upt n ALA 169 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1upt n GLU 171 N 0.20 0.00 -0.17 0.00 2.13 -0.06 -1.58 120.64 121.15 1upt n GLU 171 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 1upt n GLU 171 Cb 0.25 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.01 1upt n GLU 171 CO 0.00 0.00 0.00 2.35 -0.41 0.00 0.00 177.13 179.07 1upt h TRP 172 N 0.00 1.10 -0.29 4.31 7.01 -1.72 -2.46 115.95 123.89 1upt h TRP 172 Ca 0.00 -0.22 -0.05 0.00 2.11 0.00 0.00 58.89 60.74 1upt h TRP 172 Cb 0.00 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.77 1upt h TRP 172 CO 0.00 1.01 0.00 1.25 -2.79 0.00 0.00 178.44 177.92 1upt h LEU 173 N 0.88 0.50 -0.25 0.65 5.85 -1.58 -1.88 115.31 119.48 1upt h LEU 173 Ca 0.14 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 1upt h LEU 173 Cb 0.64 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1upt h LEU 173 CO 0.04 0.68 0.03 0.58 -0.34 0.00 0.00 178.44 179.43 1upt h VAL 174 N 0.30 1.24 -0.30 1.05 2.07 -1.83 -0.25 116.25 118.53 1upt h VAL 174 Ca 0.08 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.71 1upt h VAL 174 Cb 0.43 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1upt h VAL 174 CO 0.01 0.26 -0.12 -0.33 0.02 0.00 0.00 177.57 177.41 1upt h GLU 175 N 0.23 0.50 -0.15 1.57 4.39 -1.46 -0.30 114.58 119.36 1upt h GLU 175 Ca 0.08 -0.15 -0.17 0.00 0.34 0.00 0.00 59.36 59.46 1upt h GLU 175 Cb 0.36 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1upt h GLU 175 CO 0.01 0.62 -0.62 1.15 -1.16 0.00 0.00 179.01 179.01 1upt h THR 176 N 0.46 1.34 -0.48 1.13 2.02 -1.18 -1.76 112.91 114.45 1upt h THR 176 Ca 0.09 -1.91 -0.06 0.00 0.77 0.00 0.00 66.41 65.29 1upt h THR 176 Cb 0.50 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.78 1upt h THR 176 CO 0.03 0.59 0.05 -0.07 0.37 0.00 0.00 175.52 176.49 1upt h LEU 177 N 0.38 0.78 -1.08 2.58 3.38 -0.47 -2.96 115.31 117.93 1upt h LEU 177 Ca -0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1upt h LEU 177 Cb 1.18 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 1upt h LEU 177 CO 0.11 0.86 0.18 0.11 0.09 0.00 0.00 178.44 179.79 1upt h LYS 178 N 0.67 0.83 -0.07 1.13 1.57 -0.87 -2.97 116.57 116.87 1upt h LYS 178 Ca 0.14 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1upt h LYS 178 Cb 0.43 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1upt h LYS 178 CO 0.01 0.72 0.00 -1.13 -0.57 0.00 0.00 179.45 178.48 1upt n SER 179 N -4.30 1.29 0.00 0.86 3.41 -0.68 -5.10 113.62 109.10 1upt n SER 179 Ca 0.04 -1.52 0.07 0.00 -0.26 0.00 0.00 58.87 57.21 1upt n SER 179 Cb 0.20 -0.04 0.44 0.00 -0.26 0.00 0.00 64.21 64.55 1upt n SER 179 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74