#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x50 n SER 2 N 0.00 -2.68 -4.33 1.61 2.88 -1.26 -4.95 113.62 104.90 1x50 n SER 2 Ca 0.00 -0.98 -0.32 0.00 -1.33 0.00 0.00 58.87 56.24 1x50 n SER 2 Cb 0.00 -2.97 -0.15 0.00 -0.75 0.00 0.00 64.21 60.33 1x50 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x50 s SER 3 N -3.59 3.42 0.23 -3.46 1.04 -1.26 -5.13 113.70 104.95 1x50 s SER 3 Ca 0.53 -0.42 -0.08 0.00 0.48 0.00 0.00 55.95 56.46 1x50 s SER 3 Cb -0.29 -0.98 -0.02 0.00 0.10 0.00 0.00 66.02 64.84 1x50 s SER 3 CO 0.91 0.25 0.34 -0.83 0.98 0.00 0.00 173.24 174.88 1x50 s GLY 4 N -0.18 0.87 -0.22 7.32 0.00 -1.26 -5.15 107.32 108.70 1x50 s GLY 4 Ca -0.02 -1.19 -0.07 0.00 0.00 0.00 0.00 44.72 43.44 1x50 s GLY 4 CO 0.03 -0.93 0.05 -0.56 0.00 0.00 0.00 173.10 171.70 1x50 s SER 5 N -3.07 5.18 -0.68 1.64 0.01 -1.26 -5.06 113.70 110.46 1x50 s SER 5 Ca 0.28 -0.14 -0.21 0.00 1.31 0.00 0.00 55.95 57.19 1x50 s SER 5 Cb 0.02 -1.91 0.09 0.00 0.21 0.00 0.00 66.02 64.43 1x50 s SER 5 CO 0.10 0.03 0.93 -0.55 0.41 0.00 0.00 173.24 174.16 1x50 s SER 6 N 1.23 6.23 0.00 2.44 0.15 -1.26 -4.91 113.70 117.57 1x50 s SER 6 Ca 0.04 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.48 1x50 s SER 6 Cb -0.14 -2.39 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1x50 s SER 6 CO 0.03 -1.33 0.00 0.61 1.20 0.00 0.00 173.24 173.75 1x50 n GLY 7 N 5.34 3.51 3.56 9.45 0.00 -1.26 -5.19 105.19 120.59 1x50 n GLY 7 Ca -0.01 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1x50 n GLY 7 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1x50 s HIS 8 N -0.79 -0.42 -0.14 1.61 -0.00 -1.26 -5.15 115.29 109.14 1x50 s HIS 8 Ca 0.00 0.14 -0.02 0.00 -0.00 0.00 0.00 55.06 55.18 1x50 s HIS 8 Cb 0.00 0.60 -0.02 0.00 -0.00 0.00 0.00 32.58 33.16 1x50 s HIS 8 CO 0.00 -0.95 -0.07 -0.65 -0.00 0.00 0.00 174.74 173.08 1x50 s GLN 9 N -3.76 3.56 -0.04 -0.38 -1.52 -1.26 -4.98 119.66 111.28 1x50 s GLN 9 Ca 0.04 -0.57 0.05 0.00 -1.95 0.00 0.00 55.36 52.94 1x50 s GLN 9 Cb -0.02 -2.82 0.22 0.00 -0.22 0.00 0.00 33.01 30.16 1x50 s GLN 9 CO -0.07 0.25 1.00 0.00 -0.25 0.00 0.00 175.29 176.22 1x50 n GLN 10 N 3.47 1.85 -2.68 2.91 0.00 -1.26 -4.88 117.38 116.79 1x50 n GLN 10 Ca -0.18 -0.85 -0.26 0.00 0.00 0.00 0.00 57.00 55.71 1x50 n GLN 10 Cb 0.53 -1.47 0.01 0.00 0.00 0.00 0.00 30.24 29.30 1x50 n GLN 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1x50 s LEU 11 N -0.89 3.53 0.30 2.61 1.02 -1.26 -4.96 118.68 119.02 1x50 s LEU 11 Ca 0.15 0.70 -0.01 0.00 0.02 0.00 0.00 54.13 55.00 1x50 s LEU 11 Cb 0.10 -3.60 0.67 0.00 0.02 0.00 0.00 46.19 43.38 1x50 s LEU 11 CO 0.07 -0.74 1.57 0.78 0.02 0.00 0.00 176.35 178.05 1x50 h ASN 12 N 0.17 -0.57 -1.27 2.29 2.35 -2.07 -3.42 115.58 113.06 1x50 h ASN 12 Ca -0.46 0.28 -0.45 0.00 -0.55 0.00 0.00 56.30 55.12 1x50 h ASN 12 Cb 1.23 0.51 0.12 0.00 0.05 0.00 0.00 38.32 40.23 1x50 h ASN 12 CO 0.60 -0.34 -0.72 -1.20 -1.65 0.00 0.00 177.43 174.13 1x50 n SER 13 N -5.51 -2.20 -4.94 5.81 7.64 -1.26 -4.93 113.62 108.22 1x50 n SER 13 Ca 0.21 0.56 -0.27 0.00 1.01 0.00 0.00 58.87 60.38 1x50 n SER 13 Cb 0.68 -0.63 -0.03 0.00 -1.01 0.00 0.00 64.21 63.22 1x50 n SER 13 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1x50 s LEU 14 N 3.25 4.34 0.00 -3.43 0.05 -1.26 -4.97 118.68 116.67 1x50 s LEU 14 Ca 0.43 0.19 0.00 0.00 0.05 0.00 0.00 54.13 54.80 1x50 s LEU 14 Cb -0.44 -2.92 0.00 0.00 -2.05 0.00 0.00 46.19 40.78 1x50 s LEU 14 CO 0.46 0.08 0.00 -0.81 -0.55 0.00 0.00 176.35 175.53 1x50 n PRO 15 N -0.36 -0.14 -2.76 1.48 -0.04 -1.26 -5.02 135.00 126.90 1x50 n PRO 15 Ca -0.07 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.08 1x50 n PRO 15 Cb 0.53 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.95 1x50 n PRO 15 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1x50 s THR 16 N -0.56 4.60 -0.96 0.52 2.01 -1.26 -4.95 115.64 115.04 1x50 s THR 16 Ca 0.00 1.05 -0.02 0.00 0.31 0.00 0.00 61.69 63.03 1x50 s THR 16 Cb 0.00 -3.67 0.27 0.00 0.01 0.00 0.00 72.50 69.10 1x50 s THR 16 CO 0.00 -0.46 1.08 0.23 -0.69 0.00 0.00 174.62 174.78 1x50 n MET 17 N -1.05 3.42 -3.09 4.92 2.81 -1.26 -5.03 117.12 117.84 1x50 n MET 17 Ca 0.05 -4.54 -0.18 0.00 -1.81 0.00 0.00 57.70 51.22 1x50 n MET 17 Cb 0.54 -2.44 0.00 0.00 -0.71 0.00 0.00 33.22 30.61 1x50 n MET 17 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1x50 n GLU 18 N 1.76 0.91 0.00 0.03 -0.58 -1.26 -4.97 120.64 116.53 1x50 n GLU 18 Ca 0.25 -2.41 0.00 0.00 -0.42 0.00 0.00 57.16 54.58 1x50 n GLU 18 Cb 0.37 0.23 0.00 0.00 -0.57 0.00 0.00 31.44 31.47 1x50 n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x50 n GLY 19 N 0.31 0.23 3.71 0.62 0.00 -1.26 -4.94 105.19 103.87 1x50 n GLY 19 Ca -0.01 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 1x50 n GLY 19 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x50 s PRO 20 N 0.00 1.18 1.13 1.61 0.04 -1.26 -5.04 135.00 132.66 1x50 s PRO 20 Ca 0.00 0.79 -0.17 0.00 0.04 0.00 0.00 61.00 61.66 1x50 s PRO 20 Cb 0.00 -1.80 0.25 0.00 0.04 0.00 0.00 34.50 32.99 1x50 s PRO 20 CO 0.00 -2.28 1.10 -1.25 0.04 0.00 0.00 177.00 174.61 1x50 s PRO 21 N -4.94 -0.66 0.28 0.56 0.04 -1.26 -5.03 135.00 123.99 1x50 s PRO 21 Ca 0.64 0.13 -0.18 0.00 0.04 0.00 0.00 61.00 61.63 1x50 s PRO 21 Cb -0.18 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 32.63 1x50 s PRO 21 CO 0.57 -3.38 0.76 0.99 0.04 0.00 0.00 177.00 175.98 1x50 s THR 22 N -2.99 4.57 -0.13 1.26 2.01 -1.19 -5.01 115.64 114.17 1x50 s THR 22 Ca 0.69 1.20 -0.05 0.00 0.31 0.00 0.00 61.69 63.84 1x50 s THR 22 Cb -0.13 -3.75 0.06 0.00 0.01 0.00 0.00 72.50 68.68 1x50 s THR 22 CO 0.57 0.01 0.28 -0.36 -0.69 0.00 0.00 174.62 174.42 1x50 s PHE 23 N -1.75 -0.42 -1.28 4.92 0.40 -1.26 -3.69 117.98 114.90 1x50 s PHE 23 Ca 0.49 0.95 -0.04 0.00 -0.60 0.00 0.00 56.93 57.74 1x50 s PHE 23 Cb -0.14 0.04 0.01 0.00 0.51 0.00 0.00 43.02 43.44 1x50 s PHE 23 CO 0.19 -0.31 1.03 -1.71 0.70 0.00 0.00 175.22 175.11 1x50 n ASN 24 N 4.84 -3.49 -4.74 1.36 2.85 -0.39 -4.94 115.26 110.76 1x50 n ASN 24 Ca -0.15 -0.63 -0.41 0.00 -0.11 0.00 0.00 54.58 53.28 1x50 n ASN 24 Cb 0.51 -4.91 -0.03 0.00 1.24 0.00 0.00 39.78 36.60 1x50 n ASN 24 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1x50 s PRO 25 N -5.81 4.39 0.98 1.20 0.04 -1.25 -5.01 135.00 129.54 1x50 s PRO 25 Ca 0.23 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.15 1x50 s PRO 25 Cb -0.10 -3.20 0.24 0.00 0.04 0.00 0.00 34.50 31.48 1x50 s PRO 25 CO 0.75 -0.24 0.87 -0.35 0.04 0.00 0.00 177.00 178.06 1x50 n PRO 26 N 2.61 -2.71 -3.83 0.56 -0.04 -1.26 -4.41 135.00 125.91 1x50 n PRO 26 Ca 0.06 -1.38 -0.12 0.00 -0.04 0.00 0.00 63.50 62.01 1x50 n PRO 26 Cb 0.43 -1.30 -0.13 0.00 -0.04 0.00 0.00 33.50 32.46 1x50 n PRO 26 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1x50 s VAL 27 N -2.57 -0.01 0.41 0.52 1.01 -1.26 -3.12 120.40 115.39 1x50 s VAL 27 Ca 0.56 0.02 -0.25 0.00 0.00 0.00 0.00 61.98 62.32 1x50 s VAL 27 Cb -0.06 -0.13 -0.08 0.00 0.00 0.00 0.00 36.38 36.11 1x50 s VAL 27 CO 0.43 0.01 1.18 -2.16 0.00 0.00 0.00 175.10 174.57 1x50 s PRO 28 N 0.18 3.98 -0.34 2.72 0.04 -1.26 -5.05 135.00 135.27 1x50 s PRO 28 Ca -0.01 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 62.75 1x50 s PRO 28 Cb -0.02 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.88 1x50 s PRO 28 CO -0.01 -0.39 0.31 -0.47 0.04 0.00 0.00 177.00 176.48 1x50 s TYR 29 N -1.42 3.22 -0.48 0.56 6.14 0.15 -4.93 117.35 120.60 1x50 s TYR 29 Ca 0.58 -0.08 -0.13 0.00 0.64 0.00 0.00 57.07 58.09 1x50 s TYR 29 Cb -0.31 -2.58 0.10 0.00 0.42 0.00 0.00 41.96 39.59 1x50 s TYR 29 CO 0.39 -0.38 0.38 -0.06 0.64 0.00 0.00 175.55 176.51 1x50 s PHE 30 N 1.89 3.31 -0.35 4.97 0.40 -1.26 -0.82 117.98 126.12 1x50 s PHE 30 Ca 0.09 -1.39 -0.00 0.00 -0.60 0.00 0.00 56.93 55.03 1x50 s PHE 30 Cb -0.17 -3.35 0.08 0.00 0.51 0.00 0.00 43.02 40.10 1x50 s PHE 30 CO 0.11 -0.91 0.08 0.20 0.70 0.00 0.00 175.22 175.40 1x50 s GLY 31 N 2.74 1.88 0.12 4.36 0.00 0.26 -4.99 107.32 111.69 1x50 s GLY 31 Ca 0.04 -2.23 -0.30 0.00 0.00 0.00 0.00 44.72 42.22 1x50 s GLY 31 CO 0.03 0.87 1.24 1.09 0.00 0.00 0.00 173.10 176.33 1x50 s ARG 32 N 1.12 4.43 0.31 2.90 1.04 -1.26 -1.22 118.95 126.27 1x50 s ARG 32 Ca 0.03 1.89 -0.27 0.00 -1.04 0.00 0.00 55.73 56.34 1x50 s ARG 32 Cb -0.21 -3.28 -0.09 0.00 -2.04 0.00 0.00 34.95 29.33 1x50 s ARG 32 CO -0.04 -0.23 1.02 -0.51 -0.04 0.00 0.00 175.30 175.50 1x50 s LEU 33 N 0.54 4.41 -0.78 -1.89 1.43 0.68 -4.64 118.68 118.44 1x50 s LEU 33 Ca 0.58 2.05 -0.14 0.00 -1.03 0.00 0.00 54.13 55.59 1x50 s LEU 33 Cb -0.32 -3.86 0.20 0.00 0.03 0.00 0.00 46.19 42.24 1x50 s LEU 33 CO 0.33 -0.16 0.72 -1.10 0.23 0.00 0.00 176.35 176.36 1x50 s GLN 34 N -1.81 3.49 0.00 1.70 -1.52 -1.26 -4.45 119.66 115.80 1x50 s GLN 34 Ca 0.49 -2.36 0.00 0.00 -1.95 0.00 0.00 55.36 51.54 1x50 s GLN 34 Cb -0.25 -4.39 0.00 0.00 -0.22 0.00 0.00 33.01 28.15 1x50 s GLN 34 CO 0.32 -1.29 0.00 0.41 -0.25 0.00 0.00 175.29 174.48 1x50 n GLY 35 N 4.14 3.77 0.00 3.09 0.00 -1.26 -4.99 105.19 109.93 1x50 n GLY 35 Ca 0.10 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1x50 n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x50 n GLY 36 N 0.00 2.55 3.48 -0.02 0.00 -1.26 -4.92 105.19 105.00 1x50 n GLY 36 Ca 0.00 -1.95 -0.45 0.00 0.00 0.00 0.00 46.02 43.61 1x50 n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x50 n LEU 37 N 0.00 1.71 -4.29 0.99 4.77 -0.14 -4.92 117.00 115.12 1x50 n LEU 37 Ca 0.00 0.14 -0.27 0.00 -0.03 0.00 0.00 56.01 55.86 1x50 n LEU 37 Cb 0.00 -1.25 -0.14 0.00 -2.33 0.00 0.00 43.42 39.70 1x50 n LEU 37 CO 0.00 -0.94 -0.54 0.42 -1.33 0.00 0.00 177.39 175.01 1x50 s THR 38 N 8.86 1.85 0.51 -5.08 -4.23 -1.26 -4.09 115.64 112.20 1x50 s THR 38 Ca 1.13 -1.37 0.37 0.00 -1.18 0.00 0.00 61.69 60.65 1x50 s THR 38 Cb -0.80 -1.62 0.58 0.00 1.34 0.00 0.00 72.50 71.99 1x50 s THR 38 CO 0.44 0.18 1.69 0.00 -0.54 0.00 0.00 174.62 176.40 1x50 h ALA 39 N 4.59 3.17 -0.97 3.99 0.00 -1.74 0.78 119.26 129.08 1x50 h ALA 39 Ca -0.45 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.79 1x50 h ALA 39 Cb 1.16 0.12 -0.31 0.00 0.00 0.00 0.00 17.79 18.76 1x50 h ALA 39 CO 0.42 -1.64 0.60 0.54 0.00 0.00 0.00 179.25 179.18 1x50 n ARG 40 N -4.27 2.85 -4.96 0.00 5.12 -1.26 -4.54 116.66 109.60 1x50 n ARG 40 Ca 0.34 -3.47 -0.27 0.00 -1.93 0.00 0.00 57.85 52.51 1x50 n ARG 40 Cb 1.47 -2.29 -0.16 0.00 -1.16 0.00 0.00 32.46 30.33 1x50 n ARG 40 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1x50 s ARG 41 N -3.81 1.94 -0.05 5.56 3.52 0.27 -4.34 118.95 122.04 1x50 s ARG 41 Ca 0.61 -0.70 0.00 0.00 -0.13 0.00 0.00 55.73 55.52 1x50 s ARG 41 Cb 0.49 -1.70 0.03 0.00 -1.56 0.00 0.00 34.95 32.20 1x50 s ARG 41 CO -0.04 0.31 -0.01 0.99 -0.81 0.00 0.00 175.30 175.73 1x50 s THR 42 N -0.09 0.36 -0.17 4.11 2.01 -1.26 -1.19 115.64 119.41 1x50 s THR 42 Ca -0.02 0.03 -0.10 0.00 0.31 0.00 0.00 61.69 61.91 1x50 s THR 42 Cb -0.11 -0.45 -0.05 0.00 0.01 0.00 0.00 72.50 71.89 1x50 s THR 42 CO 0.02 0.21 0.18 -0.63 -0.69 0.00 0.00 174.62 173.71 1x50 s ILE 43 N 1.32 5.39 -0.05 1.82 1.09 0.13 -2.83 121.20 128.07 1x50 s ILE 43 Ca -0.05 0.29 0.05 0.00 -1.10 0.00 0.00 60.65 59.84 1x50 s ILE 43 Cb -0.13 -3.50 -0.00 0.00 -1.06 0.00 0.00 42.46 37.76 1x50 s ILE 43 CO -0.02 0.47 -0.20 -0.63 -0.10 0.00 0.00 174.94 174.46 1x50 s ILE 44 N 0.04 1.68 -0.21 2.92 1.01 -1.19 0.10 121.20 125.56 1x50 s ILE 44 Ca 0.12 -0.85 -0.03 0.00 0.00 0.00 0.00 60.65 59.89 1x50 s ILE 44 Cb -0.12 -1.44 0.07 0.00 0.01 0.00 0.00 42.46 40.98 1x50 s ILE 44 CO 0.01 0.48 0.06 -0.63 0.00 0.00 0.00 174.94 174.86 1x50 s ILE 45 N 0.02 0.38 -0.32 2.92 1.01 0.88 -3.58 121.20 122.50 1x50 s ILE 45 Ca -0.05 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 59.95 1x50 s ILE 45 Cb -0.13 -1.00 0.03 0.00 0.01 0.00 0.00 42.46 41.37 1x50 s ILE 45 CO 0.03 -0.33 0.08 -0.54 0.00 0.00 0.00 174.94 174.18 1x50 s LYS 46 N 1.91 2.68 0.00 2.79 1.02 0.19 -1.65 119.74 126.69 1x50 s LYS 46 Ca 0.02 -1.13 0.00 0.00 0.02 0.00 0.00 55.97 54.88 1x50 s LYS 46 Cb -0.17 -3.38 0.00 0.00 -0.52 0.00 0.00 37.83 33.76 1x50 s LYS 46 CO -0.13 -0.61 0.00 0.41 -0.92 0.00 0.00 175.35 174.10 1x50 n GLY 47 N 4.79 5.55 3.56 -3.33 0.00 -1.23 -0.79 105.19 113.75 1x50 n GLY 47 Ca -0.13 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 44.93 1x50 n GLY 47 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1x50 s TYR 48 N 1.59 -0.57 -0.29 1.61 6.14 0.27 -3.45 117.35 122.65 1x50 s TYR 48 Ca 0.00 1.08 -0.29 0.00 0.64 0.00 0.00 57.07 58.50 1x50 s TYR 48 Cb 0.00 0.34 0.01 0.00 0.42 0.00 0.00 41.96 42.73 1x50 s TYR 48 CO 0.00 -0.28 1.21 0.08 0.64 0.00 0.00 175.55 177.20 1x50 s VAL 49 N 1.68 4.30 0.74 3.14 1.01 -1.17 -0.53 120.40 129.57 1x50 s VAL 49 Ca -0.07 1.49 -0.12 0.00 0.00 0.00 0.00 61.98 63.28 1x50 s VAL 49 Cb -0.04 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 32.14 1x50 s VAL 49 CO -0.15 -0.44 1.10 -2.16 0.00 0.00 0.00 175.10 173.44 1x50 s PRO 50 N 3.89 2.39 0.52 2.72 0.04 -1.26 -0.88 135.00 142.43 1x50 s PRO 50 Ca 0.52 1.23 0.33 0.00 0.04 0.00 0.00 61.00 63.12 1x50 s PRO 50 Cb -0.15 -1.91 1.37 0.00 0.04 0.00 0.00 34.50 33.85 1x50 s PRO 50 CO 0.19 -1.55 1.97 -1.00 0.04 0.00 0.00 177.00 176.66 1x50 h PRO 51 N -0.83 0.00 -0.33 0.56 0.13 -1.95 -2.69 132.00 126.90 1x50 h PRO 51 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1x50 h PRO 51 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 1x50 h PRO 51 CO 0.52 0.00 0.01 0.25 -0.23 0.00 0.00 178.00 178.55 1x50 n THR 52 N -2.99 2.40 -3.99 1.56 -2.24 -1.26 -4.94 114.28 102.82 1x50 n THR 52 Ca 0.01 -1.92 -0.34 0.00 -2.27 0.00 0.00 64.05 59.52 1x50 n THR 52 Cb 0.29 -0.27 -0.15 0.00 -2.10 0.00 0.00 70.33 68.09 1x50 n THR 52 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1x50 s GLY 53 N -1.85 1.52 0.05 3.38 0.00 -1.02 -5.02 107.32 104.38 1x50 s GLY 53 Ca 0.44 -1.19 -0.35 0.00 0.00 0.00 0.00 44.72 43.63 1x50 s GLY 53 CO 0.09 0.37 1.46 0.50 0.00 0.00 0.00 173.10 175.52 1x50 h LYS 54 N 8.04 -1.21 -1.41 2.90 1.57 -1.87 -3.44 116.57 121.14 1x50 h LYS 54 Ca -0.43 0.08 0.24 0.00 -1.87 0.00 0.00 60.65 58.67 1x50 h LYS 54 Cb 1.15 0.28 -0.21 0.00 0.08 0.00 0.00 32.23 33.53 1x50 h LYS 54 CO 0.62 -0.81 0.81 -1.54 -0.57 0.00 0.00 179.45 177.96 1x50 s SER 55 N -4.05 -0.14 0.14 0.86 1.04 -1.26 -4.18 113.70 106.11 1x50 s SER 55 Ca -0.18 0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.30 1x50 s SER 55 Cb 0.02 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.29 1x50 s SER 55 CO 0.55 -0.21 0.12 2.22 0.98 0.00 0.00 173.24 176.90 1x50 n PHE 56 N 0.08 -1.49 -3.68 5.02 -1.74 -1.25 -1.69 117.46 112.70 1x50 n PHE 56 Ca -0.00 -0.59 -0.14 0.00 -0.56 0.00 0.00 57.45 56.16 1x50 n PHE 56 Cb 0.58 -0.12 -0.09 0.00 1.52 0.00 0.00 39.48 41.38 1x50 n PHE 56 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1x50 s ALA 57 N -2.20 -1.31 -0.35 1.98 0.00 0.26 -3.76 121.76 116.38 1x50 s ALA 57 Ca 0.09 1.41 0.03 0.00 0.00 0.00 0.00 51.96 53.49 1x50 s ALA 57 Cb -0.01 -0.75 0.10 0.00 0.00 0.00 0.00 23.12 22.47 1x50 s ALA 57 CO 0.06 -0.26 0.09 0.42 0.00 0.00 0.00 175.76 176.06 1x50 s ILE 58 N 0.06 1.97 -0.03 0.00 1.09 0.61 -2.14 121.20 122.76 1x50 s ILE 58 Ca -0.02 -2.24 -0.03 0.00 -1.10 0.00 0.00 60.65 57.27 1x50 s ILE 58 Cb -0.04 -2.45 -0.04 0.00 -1.06 0.00 0.00 42.46 38.88 1x50 s ILE 58 CO 0.02 -0.65 0.15 0.20 -0.10 0.00 0.00 174.94 174.56 1x50 s ASN 59 N 0.93 6.21 -0.35 3.58 0.01 -0.96 -1.94 114.94 122.41 1x50 s ASN 59 Ca 0.12 0.32 0.01 0.00 -0.71 0.00 0.00 52.86 52.60 1x50 s ASN 59 Cb -0.19 -1.92 0.10 0.00 0.41 0.00 0.00 41.25 39.64 1x50 s ASN 59 CO -0.11 0.29 0.09 -0.36 -1.51 0.00 0.00 177.10 175.50 1x50 s PHE 60 N -1.24 3.64 0.47 2.20 0.40 0.34 -1.88 117.98 121.91 1x50 s PHE 60 Ca 0.24 -2.67 0.03 0.00 -0.60 0.00 0.00 56.93 53.93 1x50 s PHE 60 Cb -0.12 -2.90 0.02 0.00 0.51 0.00 0.00 43.02 40.52 1x50 s PHE 60 CO 0.15 -0.94 0.67 0.21 0.70 0.00 0.00 175.22 176.00 1x50 s LYS 61 N 1.02 2.78 -0.26 0.44 2.20 -1.02 -1.31 119.74 123.60 1x50 s LYS 61 Ca 0.07 -0.88 -0.11 0.00 -0.36 0.00 0.00 55.97 54.70 1x50 s LYS 61 Cb -0.20 -2.61 -0.05 0.00 -1.51 0.00 0.00 37.83 33.45 1x50 s LYS 61 CO -0.06 -0.42 0.17 0.08 -0.36 0.00 0.00 175.35 174.76 1x50 s VAL 62 N -2.55 5.27 0.25 4.02 1.01 -0.81 -1.40 120.40 126.19 1x50 s VAL 62 Ca 0.54 0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.63 1x50 s VAL 62 Cb -0.10 -3.48 0.24 0.00 0.00 0.00 0.00 36.38 33.03 1x50 s VAL 62 CO 0.36 0.30 1.86 1.23 0.00 0.00 0.00 175.10 178.85 1x50 h GLY 63 N 7.98 1.38 0.00 4.51 0.00 -1.81 -0.47 103.07 114.66 1x50 h GLY 63 Ca -0.36 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.55 1x50 h GLY 63 CO 0.60 0.28 0.00 -1.26 0.00 0.00 0.00 176.54 176.16 1x50 n SER 64 N -4.58 0.00 0.00 0.19 2.88 -1.26 -4.65 113.62 106.19 1x50 n SER 64 Ca 0.14 0.72 0.00 0.00 -1.33 0.00 0.00 58.87 58.40 1x50 n SER 64 Cb 0.19 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 1x50 n SER 64 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x50 n SER 65 N -1.54 0.00 0.00 -3.46 2.88 -1.23 -5.05 113.62 105.22 1x50 n SER 65 Ca 0.00 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1x50 n SER 65 Cb 0.00 -0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1x50 n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x50 n GLY 66 N 2.00 0.38 3.55 0.46 0.00 -0.18 -4.94 105.19 106.45 1x50 n GLY 66 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1x50 n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x50 s ASP 67 N -0.74 4.44 -0.24 1.61 1.01 -1.26 -4.66 116.67 116.82 1x50 s ASP 67 Ca 0.00 -0.14 -0.23 0.00 0.71 0.00 0.00 52.55 52.89 1x50 s ASP 67 Cb 0.00 -1.02 -0.01 0.00 1.01 0.00 0.00 42.92 42.90 1x50 s ASP 67 CO 0.00 0.32 0.77 -0.63 0.21 0.00 0.00 175.17 175.84 1x50 s ILE 68 N -0.87 4.88 -0.10 0.77 1.01 0.13 -1.93 121.20 125.09 1x50 s ILE 68 Ca 0.14 1.43 0.07 0.00 0.00 0.00 0.00 60.65 62.30 1x50 s ILE 68 Cb -0.11 -4.06 -0.24 0.00 0.01 0.00 0.00 42.46 38.06 1x50 s ILE 68 CO 0.04 -0.04 0.44 0.00 0.00 0.00 0.00 174.94 175.37 1x50 n ALA 69 N 5.89 1.32 -3.68 9.38 0.00 -0.43 -1.81 120.51 131.18 1x50 n ALA 69 Ca 0.04 -0.82 -0.16 0.00 0.00 0.00 0.00 53.44 52.50 1x50 n ALA 69 Cb 0.48 -0.66 -0.16 0.00 0.00 0.00 0.00 19.45 19.11 1x50 n ALA 69 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1x50 s LEU 70 N -6.31 1.18 -0.37 0.00 2.96 -1.25 -4.54 118.68 110.35 1x50 s LEU 70 Ca -0.13 0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.79 1x50 s LEU 70 Cb 0.07 -0.14 0.13 0.00 0.50 0.00 0.00 46.19 46.75 1x50 s LEU 70 CO 0.79 -0.11 0.19 -2.28 -1.32 0.00 0.00 176.35 173.63 1x50 s HIS 71 N 0.97 1.29 -0.17 5.38 5.65 0.66 -0.50 115.29 128.57 1x50 s HIS 71 Ca -0.09 -1.85 -0.15 0.00 0.25 0.00 0.00 55.06 53.22 1x50 s HIS 71 Cb -0.13 -1.39 -0.04 0.00 -1.18 0.00 0.00 32.58 29.84 1x50 s HIS 71 CO -0.02 -0.82 0.35 0.42 -0.65 0.00 0.00 174.74 174.02 1x50 s ILE 72 N 1.01 5.25 -0.24 0.89 1.01 -0.82 -0.27 121.20 128.03 1x50 s ILE 72 Ca 0.16 0.65 -0.02 0.00 0.00 0.00 0.00 60.65 61.44 1x50 s ILE 72 Cb -0.22 -3.69 0.08 0.00 0.01 0.00 0.00 42.46 38.64 1x50 s ILE 72 CO -0.07 0.33 0.07 0.21 0.00 0.00 0.00 174.94 175.48 1x50 s ASN 73 N 0.70 3.35 0.65 3.58 3.04 0.09 -0.29 114.94 126.06 1x50 s ASN 73 Ca 0.19 -1.15 -0.15 0.00 0.04 0.00 0.00 52.86 51.78 1x50 s ASN 73 Cb -0.14 -0.64 -0.01 0.00 -1.54 0.00 0.00 41.25 38.92 1x50 s ASN 73 CO 0.06 -0.36 1.11 -2.16 -3.04 0.00 0.00 177.10 172.71 1x50 s PRO 74 N 1.82 2.85 -0.35 0.43 0.04 -1.25 -1.71 135.00 136.84 1x50 s PRO 74 Ca 0.04 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.50 1x50 s PRO 74 Cb -0.17 -1.96 0.11 0.00 0.04 0.00 0.00 34.50 32.53 1x50 s PRO 74 CO -0.18 -1.21 0.14 1.03 0.04 0.00 0.00 177.00 176.82 1x50 s ARG 75 N -4.01 0.94 0.18 4.56 0.52 -1.20 -4.47 118.95 115.47 1x50 s ARG 75 Ca 0.68 -1.42 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 1x50 s ARG 75 Cb -0.21 -2.19 0.10 0.00 0.52 0.00 0.00 34.95 33.17 1x50 s ARG 75 CO 0.40 -1.04 1.80 0.52 0.02 0.00 0.00 175.30 177.01 1x50 h MET 76 N 7.64 0.87 0.00 3.54 2.86 -1.83 -0.59 114.93 127.42 1x50 h MET 76 Ca -0.09 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1x50 h MET 76 Cb 0.99 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.48 1x50 h MET 76 CO 0.48 0.65 0.00 0.41 1.06 0.00 0.00 176.91 179.51 1x50 n GLY 77 N -1.08 -2.35 0.51 8.32 0.00 -1.26 -4.13 105.19 105.20 1x50 n GLY 77 Ca 0.05 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1x50 n GLY 77 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1x50 h ASN 78 N 0.00 -1.39 0.00 1.61 -1.24 -2.01 -3.48 115.58 109.07 1x50 h ASN 78 Ca 0.00 0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.12 1x50 h ASN 78 Cb 0.00 0.46 0.00 0.00 0.73 0.00 0.00 38.32 39.51 1x50 h ASN 78 CO 0.00 -0.68 0.00 0.61 -1.29 0.00 0.00 177.43 176.07 1x50 n GLY 79 N -1.57 0.89 3.23 1.57 0.00 -0.24 -5.11 105.19 103.96 1x50 n GLY 79 Ca -0.12 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1x50 n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x50 s THR 80 N -0.19 -0.44 -0.47 2.61 -4.23 -1.20 -4.94 115.64 106.78 1x50 s THR 80 Ca 0.00 0.16 -0.22 0.00 -1.18 0.00 0.00 61.69 60.45 1x50 s THR 80 Cb 0.00 -0.62 0.03 0.00 1.34 0.00 0.00 72.50 73.25 1x50 s THR 80 CO 0.00 0.07 0.77 -0.69 -0.54 0.00 0.00 174.62 174.23 1x50 s VAL 81 N 2.23 4.66 0.34 2.29 1.01 -1.26 -3.25 120.40 126.41 1x50 s VAL 81 Ca -0.04 0.24 -0.24 0.00 0.00 0.00 0.00 61.98 61.95 1x50 s VAL 81 Cb -0.11 -4.34 -0.10 0.00 0.00 0.00 0.00 36.38 31.83 1x50 s VAL 81 CO -0.12 -0.78 0.91 -0.69 0.00 0.00 0.00 175.10 174.42 1x50 s VAL 82 N 3.26 4.32 -0.10 2.92 1.01 -0.69 -4.41 120.40 126.70 1x50 s VAL 82 Ca 0.27 1.64 0.01 0.00 0.00 0.00 0.00 61.98 63.91 1x50 s VAL 82 Cb -0.13 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.39 1x50 s VAL 82 CO 0.20 0.03 -0.12 -0.13 0.00 0.00 0.00 175.10 175.08 1x50 s ARG 83 N -2.35 1.89 0.38 2.72 3.00 -1.16 -0.73 118.95 122.69 1x50 s ARG 83 Ca 0.52 -0.43 0.06 0.00 0.00 0.00 0.00 55.73 55.88 1x50 s ARG 83 Cb -0.16 -1.69 -0.02 0.00 0.00 0.00 0.00 34.95 33.08 1x50 s ARG 83 CO 0.21 -0.11 0.21 -0.80 0.00 0.00 0.00 175.30 174.81 1x50 s ASN 84 N 1.13 2.28 -0.30 0.23 -0.87 0.62 -1.97 114.94 116.06 1x50 s ASN 84 Ca -0.05 -1.74 0.01 0.00 -1.57 0.00 0.00 52.86 49.51 1x50 s ASN 84 Cb -0.14 0.57 0.19 0.00 -0.02 0.00 0.00 41.25 41.85 1x50 s ASN 84 CO -0.03 -1.02 0.62 -0.55 -2.57 0.00 0.00 177.10 173.55 1x50 s SER 85 N -3.50 -1.44 -0.22 -1.22 0.15 -1.26 0.24 113.70 106.45 1x50 s SER 85 Ca 0.32 0.56 -0.29 0.00 0.70 0.00 0.00 55.95 57.23 1x50 s SER 85 Cb 0.02 2.07 0.00 0.00 -1.71 0.00 0.00 66.02 66.40 1x50 s SER 85 CO 0.21 -0.27 1.14 -0.22 1.20 0.00 0.00 173.24 175.31 1x50 s LEU 86 N 2.85 4.10 0.32 3.45 2.96 -0.75 -0.50 118.68 131.11 1x50 s LEU 86 Ca 0.16 1.45 0.03 0.00 -0.22 0.00 0.00 54.13 55.55 1x50 s LEU 86 Cb -0.12 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 1x50 s LEU 86 CO -0.23 -0.75 0.49 -0.76 -1.32 0.00 0.00 176.35 173.78 1x50 s LEU 87 N 3.43 4.07 -0.84 -0.68 1.43 0.65 0.22 118.68 126.96 1x50 s LEU 87 Ca 0.49 0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 53.49 1x50 s LEU 87 Cb -0.17 -3.05 -0.20 0.00 0.03 0.00 0.00 46.19 42.80 1x50 s LEU 87 CO 0.11 -0.29 2.38 -0.46 0.23 0.00 0.00 176.35 178.32 1x50 n ASN 88 N -1.67 0.33 0.00 2.29 2.04 -1.26 0.24 115.26 117.23 1x50 n ASN 88 Ca -0.05 0.24 0.00 0.00 -0.44 0.00 0.00 54.58 54.33 1x50 n ASN 88 Cb 0.57 -0.84 0.00 0.00 -2.53 0.00 0.00 39.78 36.98 1x50 n ASN 88 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1x50 n GLY 89 N 6.07 0.51 3.67 4.83 0.00 -1.26 -4.90 105.19 114.11 1x50 n GLY 89 Ca 0.59 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.32 1x50 n GLY 89 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x50 s SER 90 N -2.36 4.02 0.19 1.61 0.15 0.65 -5.16 113.70 112.79 1x50 s SER 90 Ca 0.00 -1.39 0.06 0.00 0.70 0.00 0.00 55.95 55.31 1x50 s SER 90 Cb 0.00 -0.19 -0.05 0.00 -1.71 0.00 0.00 66.02 64.08 1x50 s SER 90 CO 0.00 -0.57 -0.10 0.26 1.20 0.00 0.00 173.24 174.03 1x50 s TRP 91 N -2.73 1.50 0.00 3.44 0.52 -1.26 0.24 118.94 120.64 1x50 s TRP 91 Ca 0.29 -0.71 0.00 0.00 0.02 0.00 0.00 56.10 55.70 1x50 s TRP 91 Cb 0.07 -0.76 0.00 0.00 -1.15 0.00 0.00 33.47 31.63 1x50 s TRP 91 CO 0.15 0.17 0.00 0.41 0.02 0.00 0.00 176.95 177.71 1x50 n GLY 92 N -0.31 0.81 3.82 0.98 0.00 0.34 -4.72 105.19 106.11 1x50 n GLY 92 Ca -0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 1x50 n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x50 s SER 93 N -1.00 -0.08 -0.28 1.61 0.01 -1.26 -4.97 113.70 107.73 1x50 s SER 93 Ca 0.00 -0.65 -0.09 0.00 1.31 0.00 0.00 55.95 56.52 1x50 s SER 93 Cb 0.00 0.57 -0.02 0.00 0.21 0.00 0.00 66.02 66.78 1x50 s SER 93 CO 0.00 -1.10 0.12 -1.61 0.41 0.00 0.00 173.24 171.07 1x50 s GLU 94 N -2.73 3.51 -0.26 12.44 2.02 -1.26 -3.94 118.70 128.49 1x50 s GLU 94 Ca 0.16 -0.60 0.02 0.00 0.02 0.00 0.00 54.97 54.58 1x50 s GLU 94 Cb -0.03 -3.48 0.06 0.00 0.10 0.00 0.00 34.13 30.79 1x50 s GLU 94 CO 0.05 -0.31 -0.06 -1.83 0.02 0.00 0.00 175.26 173.13 1x50 s GLU 95 N 1.63 1.83 -0.16 1.61 -1.05 -0.83 -4.93 118.70 116.79 1x50 s GLU 95 Ca 0.05 -1.22 -0.06 0.00 -0.15 0.00 0.00 54.97 53.60 1x50 s GLU 95 Cb -0.16 -2.75 -0.04 0.00 -0.44 0.00 0.00 34.13 30.74 1x50 s GLU 95 CO 0.06 -0.63 0.03 0.15 0.95 0.00 0.00 175.26 175.81 1x50 s LYS 96 N 1.24 3.77 -0.30 -4.83 1.02 -1.26 -3.00 119.74 116.37 1x50 s LYS 96 Ca -0.05 -0.40 -0.12 0.00 0.02 0.00 0.00 55.97 55.42 1x50 s LYS 96 Cb -0.19 -3.08 0.18 0.00 -0.52 0.00 0.00 37.83 34.22 1x50 s LYS 96 CO -0.06 0.33 1.05 0.21 -0.92 0.00 0.00 175.35 175.96 1x50 s LYS 97 N 0.19 0.16 0.04 1.68 2.36 -1.26 -5.10 119.74 117.81 1x50 s LYS 97 Ca 0.02 0.22 -0.11 0.00 -2.55 0.00 0.00 55.97 53.55 1x50 s LYS 97 Cb -0.13 0.12 0.01 0.00 -1.05 0.00 0.00 37.83 36.78 1x50 s LYS 97 CO 0.01 -0.23 0.24 -1.50 1.55 0.00 0.00 175.35 175.42 1x50 s ILE 98 N 2.96 0.09 -0.22 5.43 2.07 -1.26 -4.73 121.20 125.54 1x50 s ILE 98 Ca 0.12 -0.77 -0.09 0.00 -1.41 0.00 0.00 60.65 58.49 1x50 s ILE 98 Cb -0.06 -0.88 -0.19 0.00 0.13 0.00 0.00 42.46 41.46 1x50 s ILE 98 CO -0.16 -0.42 -0.01 1.07 -1.91 0.00 0.00 174.94 173.50 1x50 n THR 99 N 0.72 1.59 -3.87 4.00 5.66 -1.25 -4.97 114.28 116.16 1x50 n THR 99 Ca -0.19 -0.43 -0.15 0.00 -3.05 0.00 0.00 64.05 60.23 1x50 n THR 99 Cb 0.59 -1.75 -0.15 0.00 -1.55 0.00 0.00 70.33 67.46 1x50 n THR 99 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1x50 s HIS 100 N -2.49 0.13 -0.52 1.09 -3.43 -1.26 -5.11 115.29 103.69 1x50 s HIS 100 Ca -0.31 0.05 -0.05 0.00 -0.80 0.00 0.00 55.06 53.94 1x50 s HIS 100 Cb 0.09 -0.23 0.14 0.00 -1.43 0.00 0.00 32.58 31.15 1x50 s HIS 100 CO 0.62 -0.07 0.35 1.21 -2.00 0.00 0.00 174.74 174.84 1x50 s ASN 101 N 0.69 5.42 0.10 7.38 3.84 -1.26 -4.92 114.94 126.19 1x50 s ASN 101 Ca -0.06 -2.35 -0.15 0.00 0.21 0.00 0.00 52.86 50.51 1x50 s ASN 101 Cb -0.09 -1.90 -0.08 0.00 -0.55 0.00 0.00 41.25 38.63 1x50 s ASN 101 CO -0.02 -0.51 1.42 1.55 -2.79 0.00 0.00 177.10 176.75 1x50 h PRO 102 N 7.74 0.70 -4.35 0.43 0.13 -1.99 -3.44 132.00 131.22 1x50 h PRO 102 Ca -0.09 -0.37 -0.50 0.00 -0.87 0.00 0.00 66.00 64.17 1x50 h PRO 102 Cb 1.02 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.11 1x50 h PRO 102 CO 0.74 0.98 1.23 1.19 -0.23 0.00 0.00 178.00 181.91 1x50 n PHE 103 N -4.26 0.68 -4.15 1.56 3.72 -1.26 -4.88 117.46 108.86 1x50 n PHE 103 Ca -0.04 0.45 -0.16 0.00 -0.05 0.00 0.00 57.45 57.65 1x50 n PHE 103 Cb 0.47 -1.85 -0.15 0.00 -0.94 0.00 0.00 39.48 37.01 1x50 n PHE 103 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1x50 s GLY 104 N 5.99 0.28 -0.61 1.37 0.00 -1.26 -4.64 107.32 108.44 1x50 s GLY 104 Ca 1.02 -0.19 -0.26 0.00 0.00 0.00 0.00 44.72 45.29 1x50 s GLY 104 CO 0.45 -0.09 1.87 2.56 0.00 0.00 0.00 173.10 177.89 1x50 s PRO 105 N 0.04 2.62 0.00 2.90 0.04 -1.26 -2.37 135.00 136.96 1x50 s PRO 105 Ca 0.00 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.65 1x50 s PRO 105 Cb -0.04 -4.39 0.00 0.00 0.04 0.00 0.00 34.50 30.11 1x50 s PRO 105 CO -0.00 -2.74 0.00 0.41 0.04 0.00 0.00 177.00 174.70 1x50 n GLY 106 N 5.71 0.94 3.24 0.56 0.00 -0.06 -4.65 105.19 110.93 1x50 n GLY 106 Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 1x50 n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1x50 s GLN 107 N 0.00 1.04 0.97 1.61 -2.07 -1.00 -5.00 119.66 115.21 1x50 s GLN 107 Ca 0.00 -1.41 -0.15 0.00 -1.82 0.00 0.00 55.36 51.98 1x50 s GLN 107 Cb 0.00 -0.64 0.18 0.00 -1.09 0.00 0.00 33.01 31.46 1x50 s GLN 107 CO 0.00 0.08 1.20 -0.06 -1.32 0.00 0.00 175.29 175.19 1x50 s PHE 108 N -3.16 1.90 -0.30 9.60 0.40 -1.26 -3.03 117.98 122.13 1x50 s PHE 108 Ca 0.15 0.59 -0.09 0.00 -0.60 0.00 0.00 56.93 56.99 1x50 s PHE 108 Cb 0.01 -3.66 0.15 0.00 0.51 0.00 0.00 43.02 40.03 1x50 s PHE 108 CO 0.01 -2.65 0.69 -0.59 0.70 0.00 0.00 175.22 173.38 1x50 s PHE 109 N -3.48 -1.30 -0.56 0.36 -0.71 -1.22 -4.79 117.98 106.28 1x50 s PHE 109 Ca 0.68 2.04 -0.19 0.00 -1.04 0.00 0.00 56.93 58.42 1x50 s PHE 109 Cb -0.10 0.70 0.09 0.00 -1.21 0.00 0.00 43.02 42.50 1x50 s PHE 109 CO 0.53 -0.66 0.67 0.34 -1.34 0.00 0.00 175.22 174.76 1x50 s ASP 110 N 2.84 6.20 -0.14 1.98 -1.08 -1.26 -3.47 116.67 121.74 1x50 s ASP 110 Ca -0.00 -1.25 -0.07 0.00 -0.52 0.00 0.00 52.55 50.71 1x50 s ASP 110 Cb -0.12 -2.29 -0.04 0.00 -1.46 0.00 0.00 42.92 39.01 1x50 s ASP 110 CO -0.19 -1.02 0.11 -0.22 0.52 0.00 0.00 175.17 174.37 1x50 s LEU 111 N 2.63 4.20 -0.15 -1.34 1.98 -0.66 -2.00 118.68 123.34 1x50 s LEU 111 Ca 0.12 0.35 -0.04 0.00 -2.89 0.00 0.00 54.13 51.68 1x50 s LEU 111 Cb -0.22 -2.03 0.07 0.00 0.66 0.00 0.00 46.19 44.67 1x50 s LEU 111 CO 0.08 0.34 0.19 -0.44 -1.89 0.00 0.00 176.35 174.64 1x50 s SER 112 N -0.64 1.18 -0.04 3.68 0.01 -0.43 -0.09 113.70 117.38 1x50 s SER 112 Ca 0.12 -0.01 -0.11 0.00 1.31 0.00 0.00 55.95 57.27 1x50 s SER 112 Cb -0.12 0.31 -0.05 0.00 0.21 0.00 0.00 66.02 66.37 1x50 s SER 112 CO 0.02 -0.29 0.29 -0.63 0.41 0.00 0.00 173.24 173.03 1x50 s ILE 113 N 2.30 5.25 -0.16 1.44 1.09 0.29 -0.31 121.20 131.10 1x50 s ILE 113 Ca 0.05 0.50 -0.00 0.00 -1.10 0.00 0.00 60.65 60.09 1x50 s ILE 113 Cb -0.14 -3.57 -0.00 0.00 -1.06 0.00 0.00 42.46 37.69 1x50 s ILE 113 CO -0.09 0.56 -0.14 -0.13 -0.10 0.00 0.00 174.94 175.04 1x50 s ARG 114 N -1.17 3.25 -0.29 2.79 0.52 -0.52 0.20 118.95 123.73 1x50 s ARG 114 Ca 0.21 -0.73 -0.18 0.00 -0.52 0.00 0.00 55.73 54.52 1x50 s ARG 114 Cb -0.14 -2.68 -0.02 0.00 0.52 0.00 0.00 34.95 32.62 1x50 s ARG 114 CO 0.10 -0.00 0.51 0.00 0.02 0.00 0.00 175.30 175.93 1x50 n GLY 116 N 4.54 4.32 0.02 0.00 0.00 -1.20 -4.11 105.19 108.76 1x50 n GLY 116 Ca -0.04 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.22 1x50 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x50 n LEU 117 N 0.00 2.08 -0.03 0.99 4.77 -1.26 -4.21 117.00 119.34 1x50 n LEU 117 Ca 0.00 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.82 1x50 n LEU 117 Cb 0.00 -0.08 -0.14 0.00 -2.33 0.00 0.00 43.42 40.87 1x50 n LEU 117 CO 0.00 0.42 -0.78 -0.90 -1.33 0.00 0.00 177.39 174.80 1x50 n ASP 118 N -2.47 1.35 -3.64 -1.43 5.75 -1.26 -5.02 116.55 109.84 1x50 n ASP 118 Ca -0.07 0.24 -0.01 0.00 -0.01 0.00 0.00 54.79 54.95 1x50 n ASP 118 Cb 0.59 -0.28 -0.00 0.00 -1.03 0.00 0.00 41.12 40.39 1x50 n ASP 118 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1x50 s ARG 119 N -2.56 0.80 0.28 0.11 1.70 -1.26 -4.16 118.95 113.85 1x50 s ARG 119 Ca -0.15 -0.47 0.01 0.00 -0.47 0.00 0.00 55.73 54.66 1x50 s ARG 119 Cb 0.07 0.25 -0.04 0.00 -0.57 0.00 0.00 34.95 34.67 1x50 s ARG 119 CO 0.78 -0.37 0.46 -0.06 -1.08 0.00 0.00 175.30 175.04 1x50 s PHE 120 N -2.58 3.48 -0.31 5.89 0.40 -1.01 -3.26 117.98 120.59 1x50 s PHE 120 Ca 0.17 0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.77 1x50 s PHE 120 Cb 0.01 -1.82 0.10 0.00 0.51 0.00 0.00 43.02 41.82 1x50 s PHE 120 CO 0.00 0.27 0.09 0.15 0.70 0.00 0.00 175.22 176.43 1x50 s LYS 121 N -3.92 0.86 0.07 0.44 1.02 -0.42 -3.05 119.74 114.75 1x50 s LYS 121 Ca 0.38 -1.20 -0.23 0.00 0.02 0.00 0.00 55.97 54.94 1x50 s LYS 121 Cb -0.10 -2.21 -0.06 0.00 -0.52 0.00 0.00 37.83 34.94 1x50 s LYS 121 CO 0.32 -0.97 0.70 0.08 -0.92 0.00 0.00 175.35 174.56 1x50 s VAL 122 N 1.49 4.67 0.12 3.17 1.01 -0.83 -1.44 120.40 128.59 1x50 s VAL 122 Ca 0.10 1.50 0.07 0.00 0.00 0.00 0.00 61.98 63.65 1x50 s VAL 122 Cb -0.18 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1x50 s VAL 122 CO -0.22 0.45 -0.18 -0.31 0.00 0.00 0.00 175.10 174.85 1x50 s TYR 123 N -0.57 1.66 -0.16 5.22 1.51 0.58 -1.27 117.35 124.32 1x50 s TYR 123 Ca 0.35 -0.47 -0.05 0.00 -1.01 0.00 0.00 57.07 55.89 1x50 s TYR 123 Cb -0.21 -0.87 0.06 0.00 -0.11 0.00 0.00 41.96 40.83 1x50 s TYR 123 CO 0.22 0.22 0.11 0.00 -1.11 0.00 0.00 175.55 174.99 1x50 s ALA 124 N -1.68 0.29 -1.52 3.71 0.00 0.12 -1.31 121.76 121.37 1x50 s ALA 124 Ca 0.09 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.90 1x50 s ALA 124 Cb -0.07 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 22.02 1x50 s ALA 124 CO 0.05 -1.10 0.00 0.09 0.00 0.00 0.00 175.76 174.80 1x50 n ASN 125 N 5.29 -5.15 -0.09 0.00 3.02 -0.85 -1.39 115.26 116.10 1x50 n ASN 125 Ca -0.06 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 1x50 n ASN 125 Cb 0.49 -4.32 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 1x50 n ASN 125 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x50 n GLY 126 N -0.92 0.71 2.75 7.41 0.00 -1.26 -5.07 105.19 108.82 1x50 n GLY 126 Ca -0.21 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 1x50 n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x50 s GLN 127 N -3.63 0.10 -0.29 1.61 -1.52 -0.49 -5.10 119.66 110.33 1x50 s GLN 127 Ca 0.00 0.21 -0.30 0.00 -1.95 0.00 0.00 55.36 53.32 1x50 s GLN 127 Cb 0.00 -0.46 -0.08 0.00 -0.22 0.00 0.00 33.01 32.25 1x50 s GLN 127 CO 0.00 -0.23 2.23 1.58 -0.25 0.00 0.00 175.29 178.63 1x50 n HIS 128 N 4.63 1.78 0.00 0.91 -0.00 -1.26 -0.70 115.22 120.57 1x50 n HIS 128 Ca -0.18 0.03 -0.00 0.00 -0.00 0.00 0.00 57.72 57.57 1x50 n HIS 128 Cb 0.50 -2.65 -0.00 0.00 -0.00 0.00 0.00 29.99 27.84 1x50 n HIS 128 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1x50 h LEU 129 N 14.46 -0.02 -7.78 0.27 5.85 -1.51 -3.46 115.31 123.12 1x50 h LEU 129 Ca -0.35 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.52 1x50 h LEU 129 Cb 1.27 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 42.24 1x50 h LEU 129 CO 1.00 0.06 0.44 0.72 -0.34 0.00 0.00 178.44 180.31 1x50 s PHE 130 N -1.35 -0.10 0.13 1.25 -0.12 -1.24 -3.93 117.98 112.63 1x50 s PHE 130 Ca -0.00 -0.27 0.08 0.00 -0.05 0.00 0.00 56.93 56.69 1x50 s PHE 130 Cb 0.00 0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 1x50 s PHE 130 CO 0.01 -0.96 -0.11 -0.51 -0.05 0.00 0.00 175.22 173.60 1x50 s ASP 131 N -3.00 4.27 -0.30 1.98 1.11 -1.26 -1.97 116.67 117.50 1x50 s ASP 131 Ca 0.13 -0.48 0.00 0.00 0.18 0.00 0.00 52.55 52.38 1x50 s ASP 131 Cb -0.03 -0.75 0.06 0.00 1.07 0.00 0.00 42.92 43.28 1x50 s ASP 131 CO 0.04 0.15 -0.02 0.12 1.18 0.00 0.00 175.17 176.64 1x50 s PHE 132 N -1.38 3.32 0.25 4.23 5.36 -1.17 -4.95 117.98 123.64 1x50 s PHE 132 Ca 0.22 -2.15 -0.30 0.00 -0.96 0.00 0.00 56.93 53.74 1x50 s PHE 132 Cb -0.10 -2.18 -0.11 0.00 -0.34 0.00 0.00 43.02 40.29 1x50 s PHE 132 CO 0.14 -0.85 1.51 0.00 -1.46 0.00 0.00 175.22 174.56 1x50 s ALA 133 N 1.17 3.69 -0.44 11.12 0.00 -1.26 -2.42 121.76 133.62 1x50 s ALA 133 Ca -0.04 1.42 -0.27 0.00 0.00 0.00 0.00 51.96 53.07 1x50 s ALA 133 Cb -0.20 -3.60 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 1x50 s ALA 133 CO -0.03 -0.83 2.20 -1.01 0.00 0.00 0.00 175.76 176.09 1x50 s HIS 134 N 0.14 1.28 -0.17 0.00 0.09 -1.26 -4.81 115.29 110.56 1x50 s HIS 134 Ca 0.62 1.12 -0.19 0.00 -0.00 0.00 0.00 55.06 56.62 1x50 s HIS 134 Cb -0.44 -3.80 -0.16 0.00 -0.00 0.00 0.00 32.58 28.18 1x50 s HIS 134 CO 0.43 -2.83 0.23 0.00 -0.00 0.00 0.00 174.74 172.57 1x50 h ARG 135 N 17.14 0.00 -5.37 1.40 3.08 -1.90 -3.44 114.38 125.29 1x50 h ARG 135 Ca -0.29 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.11 1x50 h ARG 135 Cb 1.23 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.13 1x50 h ARG 135 CO 1.12 0.72 0.17 -1.17 -1.07 0.00 0.00 179.97 179.74 1x50 s LEU 136 N -8.07 4.55 0.48 3.04 2.96 -1.26 -4.92 118.68 115.47 1x50 s LEU 136 Ca -0.22 -0.47 0.26 0.00 -0.22 0.00 0.00 54.13 53.48 1x50 s LEU 136 Cb 0.03 -2.68 1.32 0.00 0.50 0.00 0.00 46.19 45.35 1x50 s LEU 136 CO 0.49 -0.87 1.85 0.77 -1.32 0.00 0.00 176.35 177.26 1x50 h SER 137 N 8.97 0.19 -0.12 3.68 4.64 -2.01 0.50 113.55 129.40 1x50 h SER 137 Ca -0.26 0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 1x50 h SER 137 Cb 1.09 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.15 1x50 h SER 137 CO 0.94 0.06 0.05 0.00 -0.87 0.00 0.00 176.83 177.01 1x50 n ALA 138 N -2.63 2.84 -0.31 5.18 0.00 -1.26 -4.41 120.51 119.93 1x50 n ALA 138 Ca 0.21 -0.36 0.17 0.00 0.00 0.00 0.00 53.44 53.45 1x50 n ALA 138 Cb 0.92 -1.05 0.35 0.00 0.00 0.00 0.00 19.45 19.68 1x50 n ALA 138 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1x50 h PHE 139 N 0.35 0.57 -1.00 0.00 -0.00 -0.39 0.43 116.94 116.90 1x50 h PHE 139 Ca 0.05 0.05 0.24 0.00 -0.00 0.00 0.00 57.97 58.30 1x50 h PHE 139 Cb 1.03 -0.10 -0.12 0.00 -0.00 0.00 0.00 35.95 36.75 1x50 h PHE 139 CO 0.20 -0.18 0.59 -0.56 -0.00 0.00 0.00 178.31 178.36 1x50 h GLN 140 N 0.27 0.59 -0.99 6.09 3.07 -1.77 0.24 115.11 122.61 1x50 h GLN 140 Ca 0.62 -0.04 0.09 0.00 0.09 0.00 0.00 58.65 59.41 1x50 h GLN 140 Cb 1.30 -0.13 -0.07 0.00 0.08 0.00 0.00 27.48 28.65 1x50 h GLN 140 CO -0.63 0.39 0.63 0.00 0.09 0.00 0.00 178.83 179.31 1x50 h ARG 141 N 0.61 1.03 -5.56 0.06 3.08 -0.44 -2.80 114.38 110.35 1x50 h ARG 141 Ca 0.63 -0.06 -0.54 0.00 0.07 0.00 0.00 59.98 60.08 1x50 h ARG 141 Cb 1.17 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.96 1x50 h ARG 141 CO -0.46 0.68 1.60 0.28 -1.07 0.00 0.00 179.97 181.00 1x50 n VAL 142 N -4.56 0.03 -1.63 2.04 0.31 0.85 -4.31 118.33 111.07 1x50 n VAL 142 Ca 0.17 -0.41 0.06 0.00 -0.01 0.00 0.00 64.34 64.15 1x50 n VAL 142 Cb 0.28 -1.81 0.14 0.00 -0.91 0.00 0.00 33.84 31.53 1x50 n VAL 142 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1x50 n ASP 143 N 12.52 1.59 -4.03 4.52 5.68 -1.21 -0.97 116.55 134.66 1x50 n ASP 143 Ca 0.46 -3.15 -0.19 0.00 -0.50 0.00 0.00 54.79 51.42 1x50 n ASP 143 Cb 0.31 -0.43 -0.15 0.00 -1.14 0.00 0.00 41.12 39.71 1x50 n ASP 143 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1x50 s THR 144 N -2.25 0.72 -0.21 2.12 2.01 -0.49 0.25 115.64 117.79 1x50 s THR 144 Ca 0.31 -0.40 -0.03 0.00 0.31 0.00 0.00 61.69 61.88 1x50 s THR 144 Cb 0.31 -0.61 0.07 0.00 0.01 0.00 0.00 72.50 72.27 1x50 s THR 144 CO -0.05 0.19 0.05 -0.22 -0.69 0.00 0.00 174.62 173.90 1x50 s LEU 145 N -0.24 1.26 0.08 4.42 2.96 -0.35 -2.43 118.68 124.38 1x50 s LEU 145 Ca 0.03 -0.94 0.06 0.00 -0.22 0.00 0.00 54.13 53.06 1x50 s LEU 145 Cb -0.04 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 46.01 1x50 s LEU 145 CO -0.00 -0.33 -0.07 -1.83 -1.32 0.00 0.00 176.35 172.80 1x50 s GLU 146 N 1.85 2.31 -0.17 1.98 -1.05 -0.79 -0.58 118.70 122.26 1x50 s GLU 146 Ca 0.01 -0.92 -0.03 0.00 -0.15 0.00 0.00 54.97 53.87 1x50 s GLU 146 Cb -0.17 -2.40 0.06 0.00 -0.44 0.00 0.00 34.13 31.17 1x50 s GLU 146 CO -0.12 0.53 0.05 0.42 0.95 0.00 0.00 175.26 177.10 1x50 s ILE 147 N -1.20 0.28 0.45 1.83 1.01 -0.00 -2.27 121.20 121.31 1x50 s ILE 147 Ca 0.22 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.58 1x50 s ILE 147 Cb -0.11 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 1x50 s ILE 147 CO 0.14 -0.17 0.05 0.00 0.00 0.00 0.00 174.94 174.96 1x50 s GLN 148 N 1.97 2.03 0.00 2.79 0.00 -0.91 -0.67 119.66 124.87 1x50 s GLN 148 Ca 0.01 -2.25 0.00 0.00 -0.00 0.00 0.00 55.36 53.12 1x50 s GLN 148 Cb -0.16 -1.16 0.00 0.00 0.00 0.00 0.00 33.01 31.69 1x50 s GLN 148 CO -0.08 -0.36 0.00 0.41 0.00 0.00 0.00 175.29 175.27 1x50 n GLY 149 N -1.06 0.56 2.94 2.60 0.00 -1.26 -0.57 105.19 108.40 1x50 n GLY 149 Ca -0.12 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 1x50 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x50 s ASP 150 N -4.00 4.32 0.05 1.61 1.11 -0.68 -4.92 116.67 114.16 1x50 s ASP 150 Ca 0.00 -2.93 -0.15 0.00 0.18 0.00 0.00 52.55 49.65 1x50 s ASP 150 Cb 0.00 -1.61 0.03 0.00 1.07 0.00 0.00 42.92 42.41 1x50 s ASP 150 CO 0.00 -0.24 0.34 0.54 1.18 0.00 0.00 175.17 176.99 1x50 s VAL 151 N -0.17 0.07 -0.54 -1.27 0.11 -1.26 -3.78 120.40 113.56 1x50 s VAL 151 Ca 0.17 -0.61 -0.02 0.00 -2.93 0.00 0.00 61.98 58.58 1x50 s VAL 151 Cb -0.25 -0.97 0.14 0.00 -1.53 0.00 0.00 36.38 33.77 1x50 s VAL 151 CO -0.01 -0.34 0.35 -0.89 -3.33 0.00 0.00 175.10 170.88 1x50 s THR 152 N -2.65 3.48 0.20 5.04 2.01 0.31 -4.92 115.64 119.11 1x50 s THR 152 Ca -0.04 -2.68 -0.30 0.00 0.31 0.00 0.00 61.69 58.98 1x50 s THR 152 Cb -0.00 -3.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.11 1x50 s THR 152 CO -0.04 -0.81 1.03 -0.76 -0.69 0.00 0.00 174.62 173.36 1x50 s LEU 153 N 0.33 4.54 0.00 4.42 1.43 -1.26 0.94 118.68 129.08 1x50 s LEU 153 Ca 0.14 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.27 1x50 s LEU 153 Cb -0.21 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.40 1x50 s LEU 153 CO -0.03 -0.08 0.00 -0.24 0.23 0.00 0.00 176.35 176.22 1x50 n SER 154 N 2.03 3.76 -3.74 2.29 2.88 0.03 -3.82 113.62 117.05 1x50 n SER 154 Ca 0.01 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.41 1x50 n SER 154 Cb 0.47 0.02 -0.15 0.00 -0.75 0.00 0.00 64.21 63.80 1x50 n SER 154 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1x50 s TYR 155 N -1.93 -0.16 -0.23 0.66 6.14 -0.30 -1.26 117.35 120.26 1x50 s TYR 155 Ca 0.00 0.49 -0.04 0.00 0.64 0.00 0.00 57.07 58.16 1x50 s TYR 155 Cb 0.00 -0.10 0.08 0.00 0.42 0.00 0.00 41.96 42.36 1x50 s TYR 155 CO 0.00 -0.18 0.13 0.08 0.64 0.00 0.00 175.55 176.23 1x50 s VAL 156 N 1.27 -0.13 -0.07 3.14 1.01 -1.24 -0.64 120.40 123.74 1x50 s VAL 156 Ca -0.08 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 61.53 1x50 s VAL 156 Cb -0.12 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 1x50 s VAL 156 CO -0.06 -0.46 -0.22 -1.58 0.00 0.00 0.00 175.10 172.78 1x50 s GLN 157 N 2.16 2.74 -0.74 2.72 0.74 -1.23 -3.16 119.66 122.89 1x50 s GLN 157 Ca 0.06 -0.84 -0.09 0.00 0.05 0.00 0.00 55.36 54.53 1x50 s GLN 157 Cb -0.16 -2.28 0.19 0.00 1.10 0.00 0.00 33.01 31.87 1x50 s GLN 157 CO -0.22 0.36 0.63 0.42 -0.55 0.00 0.00 175.29 175.93 1x50 s ILE 158 N -0.09 4.81 1.38 -2.34 1.01 -1.26 -3.15 121.20 121.56 1x50 s ILE 158 Ca -0.05 -2.66 -0.20 0.00 0.00 0.00 0.00 60.65 57.74 1x50 s ILE 158 Cb -0.14 -4.03 0.36 0.00 0.01 0.00 0.00 42.46 38.65 1x50 s ILE 158 CO 0.04 -0.96 0.94 -0.94 0.00 0.00 0.00 174.94 174.02 1x50 s SER 159 N 1.57 -0.76 0.00 3.58 1.04 -1.13 -4.99 113.70 113.02 1x50 s SER 159 Ca 0.17 1.07 0.00 0.00 0.48 0.00 0.00 55.95 57.67 1x50 s SER 159 Cb -0.15 -1.57 0.00 0.00 0.10 0.00 0.00 66.02 64.40 1x50 s SER 159 CO -0.06 -5.20 0.00 0.61 0.98 0.00 0.00 173.24 169.56 1x50 n GLY 160 N 1.48 0.11 3.58 7.32 0.00 -1.26 -4.19 105.19 112.23 1x50 n GLY 160 Ca 0.09 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1x50 n GLY 160 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x50 s PRO 161 N -2.00 -1.40 -0.30 1.61 0.04 -1.26 -5.03 135.00 126.66 1x50 s PRO 161 Ca 0.00 -0.13 -0.05 0.00 0.04 0.00 0.00 61.00 60.86 1x50 s PRO 161 Cb 0.00 -1.58 0.03 0.00 0.04 0.00 0.00 34.50 32.99 1x50 s PRO 161 CO 0.00 -3.82 0.05 0.45 0.04 0.00 0.00 177.00 173.72 1x50 s SER 162 N -3.94 4.97 -0.66 6.66 0.15 -1.26 -4.98 113.70 114.64 1x50 s SER 162 Ca 0.71 -0.93 -0.01 0.00 0.70 0.00 0.00 55.95 56.42 1x50 s SER 162 Cb -0.09 -1.81 0.44 0.00 -1.71 0.00 0.00 66.02 62.85 1x50 s SER 162 CO 0.56 -0.22 1.97 -1.54 1.20 0.00 0.00 173.24 175.20 1x50 n SER 163 N 4.78 7.46 0.00 5.45 3.41 -1.26 -5.31 113.62 128.15 1x50 n SER 163 Ca -0.14 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 54.68 1x50 n SER 163 Cb 0.46 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 1x50 n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49