#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x50 s SER 2 N 0.00 0.54 -0.06 1.61 0.01 -1.26 -5.15 113.70 109.39 1x50 s SER 2 Ca 0.00 0.07 -0.03 0.00 1.31 0.00 0.00 55.95 57.30 1x50 s SER 2 Cb 0.00 -0.08 -0.04 0.00 0.21 0.00 0.00 66.02 66.11 1x50 s SER 2 CO 0.00 -0.18 0.10 -0.44 0.41 0.00 0.00 173.24 173.12 1x50 s SER 3 N 1.58 5.92 0.21 2.44 0.01 -1.26 -5.11 113.70 117.49 1x50 s SER 3 Ca -0.03 0.28 0.01 0.00 1.31 0.00 0.00 55.95 57.52 1x50 s SER 3 Cb -0.13 -1.79 -0.00 0.00 0.21 0.00 0.00 66.02 64.31 1x50 s SER 3 CO -0.03 0.34 0.04 0.61 0.41 0.00 0.00 173.24 174.61 1x50 n GLY 4 N 1.59 3.78 2.90 3.44 0.00 -1.26 -5.16 105.19 110.47 1x50 n GLY 4 Ca -0.16 -2.13 -0.16 0.00 0.00 0.00 0.00 46.02 43.57 1x50 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x50 s SER 5 N -2.26 0.51 0.10 1.61 1.04 -1.26 -5.14 113.70 108.29 1x50 s SER 5 Ca 0.06 -0.07 -0.19 0.00 0.48 0.00 0.00 55.95 56.23 1x50 s SER 5 Cb 0.00 -0.14 -0.07 0.00 0.10 0.00 0.00 66.02 65.91 1x50 s SER 5 CO 0.04 -0.00 0.59 -0.44 0.98 0.00 0.00 173.24 174.41 1x50 s SER 6 N 0.31 7.05 -0.08 7.02 0.01 -1.26 -5.08 113.70 121.68 1x50 s SER 6 Ca -0.03 1.27 -0.00 0.00 1.31 0.00 0.00 55.95 58.50 1x50 s SER 6 Cb -0.06 -2.36 -0.03 0.00 0.21 0.00 0.00 66.02 63.78 1x50 s SER 6 CO -0.01 0.24 -0.05 -0.83 0.41 0.00 0.00 173.24 173.00 1x50 s GLY 7 N -1.22 1.72 -0.49 3.44 0.00 -1.26 -5.08 107.32 104.43 1x50 s GLY 7 Ca 0.31 -0.87 -0.14 0.00 0.00 0.00 0.00 44.72 44.02 1x50 s GLY 7 CO 0.19 -0.60 0.40 -1.58 0.00 0.00 0.00 173.10 171.52 1x50 s HIS 8 N -0.72 3.28 -1.06 1.90 5.65 -1.26 -5.01 115.29 118.06 1x50 s HIS 8 Ca 0.11 -1.21 -0.18 0.00 0.25 0.00 0.00 55.06 54.03 1x50 s HIS 8 Cb -0.11 -3.36 0.12 0.00 -1.18 0.00 0.00 32.58 28.04 1x50 s HIS 8 CO 0.02 -0.89 1.35 -0.65 -0.65 0.00 0.00 174.74 173.91 1x50 s GLN 9 N 1.57 3.77 -1.14 2.88 1.11 -1.26 -4.94 119.66 121.65 1x50 s GLN 9 Ca 0.04 -1.88 -0.21 0.00 0.01 0.00 0.00 55.36 53.32 1x50 s GLN 9 Cb -0.26 -5.12 0.01 0.00 -1.01 0.00 0.00 33.01 26.63 1x50 s GLN 9 CO 0.04 -1.92 1.74 -0.65 0.01 0.00 0.00 175.29 174.52 1x50 s GLN 10 N 3.04 3.33 -0.02 2.91 -1.52 -1.26 -4.89 119.66 121.24 1x50 s GLN 10 Ca 0.41 -1.33 -0.09 0.00 -1.95 0.00 0.00 55.36 52.39 1x50 s GLN 10 Cb -0.02 -5.35 0.01 0.00 -0.22 0.00 0.00 33.01 27.42 1x50 s GLN 10 CO -0.05 -2.81 0.20 -0.51 -0.25 0.00 0.00 175.29 171.87 1x50 s LEU 11 N 6.86 1.28 0.25 2.90 1.43 -1.26 -5.15 118.68 124.99 1x50 s LEU 11 Ca 0.58 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.39 1x50 s LEU 11 Cb 0.00 0.85 -0.09 0.00 0.03 0.00 0.00 46.19 46.99 1x50 s LEU 11 CO 0.03 -0.33 1.09 0.20 0.23 0.00 0.00 176.35 177.57 1x50 s ASN 12 N -1.05 7.30 -0.28 2.29 -0.87 -1.26 -5.04 114.94 116.03 1x50 s ASN 12 Ca -0.11 2.19 -0.17 0.00 -1.57 0.00 0.00 52.86 53.20 1x50 s ASN 12 Cb -0.06 -2.62 0.10 0.00 -0.02 0.00 0.00 41.25 38.65 1x50 s ASN 12 CO 0.02 -0.14 0.77 -0.44 -2.57 0.00 0.00 177.10 174.74 1x50 s SER 13 N -0.67 -0.82 0.72 -1.22 0.01 -1.26 -5.16 113.70 105.30 1x50 s SER 13 Ca 0.46 1.33 -0.16 0.00 1.31 0.00 0.00 55.95 58.89 1x50 s SER 13 Cb -0.31 1.34 0.02 0.00 0.21 0.00 0.00 66.02 67.28 1x50 s SER 13 CO 0.38 -0.21 1.15 0.00 0.41 0.00 0.00 173.24 174.97 1x50 n LEU 14 N 4.03 4.62 0.00 2.44 -0.00 -1.26 -5.01 117.00 121.82 1x50 n LEU 14 Ca -0.19 0.70 -0.08 0.00 -0.00 0.00 0.00 56.01 56.44 1x50 n LEU 14 Cb 0.58 -1.49 0.06 0.00 -0.00 0.00 0.00 43.42 42.58 1x50 n LEU 14 CO -0.01 -1.59 0.15 -0.81 -0.00 0.00 0.00 177.39 175.14 1x50 n PRO 15 N -2.29 -1.56 -2.73 1.47 -0.04 -1.26 -5.02 135.00 123.57 1x50 n PRO 15 Ca 0.14 -0.44 -0.33 0.00 -0.04 0.00 0.00 63.50 62.83 1x50 n PRO 15 Cb 0.49 -0.41 -0.06 0.00 -0.04 0.00 0.00 33.50 33.48 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 -1.50 4.30 -0.85 0.52 2.01 -1.26 -4.94 115.64 113.93 1x50 s THR 16 Ca 0.18 1.40 0.01 0.00 0.31 0.00 0.00 61.69 63.60 1x50 s THR 16 Cb -0.02 -3.58 0.28 0.00 0.01 0.00 0.00 72.50 69.19 1x50 s THR 16 CO 0.14 -0.34 1.11 1.15 -0.69 0.00 0.00 174.62 175.98 1x50 n MET 17 N -0.78 3.49 -2.24 4.92 0.00 -1.26 -5.06 117.12 116.19 1x50 n MET 17 Ca 0.07 -4.63 -0.29 0.00 0.00 0.00 0.00 57.70 52.85 1x50 n MET 17 Cb 0.54 -2.38 0.01 0.00 0.00 0.00 0.00 33.22 31.39 1x50 n MET 17 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1x50 s GLU 18 N -2.68 3.55 0.00 3.17 -1.05 -1.26 -4.91 118.70 115.52 1x50 s GLU 18 Ca 0.36 0.48 0.00 0.00 -0.15 0.00 0.00 54.97 55.66 1x50 s GLU 18 Cb 0.11 -2.22 0.00 0.00 -0.44 0.00 0.00 34.13 31.58 1x50 s GLU 18 CO 0.04 -0.41 0.00 0.41 0.95 0.00 0.00 175.26 176.26 1x50 n GLY 19 N -2.52 0.18 3.67 -3.83 0.00 -1.26 -5.06 105.19 96.37 1x50 n GLY 19 Ca 0.03 -1.87 -0.28 0.00 0.00 0.00 0.00 46.02 43.90 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 0.28 1.17 1.61 0.04 -1.26 -5.05 135.00 131.79 1x50 s PRO 20 Ca 0.00 0.48 -0.18 0.00 0.04 0.00 0.00 61.00 61.34 1x50 s PRO 20 Cb 0.00 -1.72 0.27 0.00 0.04 0.00 0.00 34.50 33.09 1x50 s PRO 20 CO 0.00 -2.83 1.11 -1.25 0.04 0.00 0.00 177.00 174.07 1x50 s PRO 21 N -4.96 -0.98 0.17 0.56 0.04 -1.26 -5.04 135.00 123.53 1x50 s PRO 21 Ca 0.66 0.02 -0.09 0.00 0.04 0.00 0.00 61.00 61.62 1x50 s PRO 21 Cb -0.19 -1.62 -0.07 0.00 0.04 0.00 0.00 34.50 32.67 1x50 s PRO 21 CO 0.58 -3.57 0.49 0.99 0.04 0.00 0.00 177.00 175.53 1x50 s THR 22 N -3.00 4.99 -0.04 1.26 2.01 -1.13 -5.01 115.64 114.71 1x50 s THR 22 Ca 0.70 0.44 -0.03 0.00 0.31 0.00 0.00 61.69 63.12 1x50 s THR 22 Cb -0.11 -3.64 0.02 0.00 0.01 0.00 0.00 72.50 68.78 1x50 s THR 22 CO 0.56 0.06 0.10 -0.36 -0.69 0.00 0.00 174.62 174.30 1x50 s PHE 23 N -1.66 -0.10 -1.51 4.92 0.40 -1.26 -3.19 117.98 115.58 1x50 s PHE 23 Ca 0.42 0.32 -0.00 0.00 -0.60 0.00 0.00 56.93 57.07 1x50 s PHE 23 Cb -0.12 -0.06 0.00 0.00 0.51 0.00 0.00 43.02 43.35 1x50 s PHE 23 CO 0.21 -0.10 0.14 -1.71 0.70 0.00 0.00 175.22 174.46 1x50 n ASN 24 N 3.68 0.53 -4.77 1.36 2.85 0.93 -4.87 115.26 114.97 1x50 n ASN 24 Ca -0.20 -1.19 -0.38 0.00 -0.11 0.00 0.00 54.58 52.69 1x50 n ASN 24 Cb 0.55 -2.06 -0.02 0.00 1.24 0.00 0.00 39.78 39.49 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 -7.12 4.04 1.10 1.20 0.04 -1.24 -4.98 135.00 128.04 1x50 s PRO 25 Ca 0.01 1.88 -0.18 0.00 0.04 0.00 0.00 61.00 62.75 1x50 s PRO 25 Cb -0.00 -2.69 0.27 0.00 0.04 0.00 0.00 34.50 32.12 1x50 s PRO 25 CO 0.96 -0.34 0.97 -0.35 0.04 0.00 0.00 177.00 178.28 1x50 n PRO 26 N 0.08 -2.92 -3.81 0.56 -0.04 -1.26 -4.47 135.00 123.14 1x50 n PRO 26 Ca 0.04 -1.56 -0.13 0.00 -0.04 0.00 0.00 63.50 61.82 1x50 n PRO 26 Cb 0.46 -1.46 -0.13 0.00 -0.04 0.00 0.00 33.50 32.33 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 -2.76 -0.01 0.42 0.52 1.01 -1.26 -3.15 120.40 115.16 1x50 s VAL 27 Ca 0.63 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.40 1x50 s VAL 27 Cb -0.06 -0.21 -0.08 0.00 0.00 0.00 0.00 36.38 36.03 1x50 s VAL 27 CO 0.49 0.02 1.18 -2.16 0.00 0.00 0.00 175.10 174.62 1x50 s PRO 28 N 0.30 3.95 -0.30 2.72 0.04 -1.26 -5.04 135.00 135.41 1x50 s PRO 28 Ca -0.02 1.85 -0.13 0.00 0.04 0.00 0.00 61.00 62.74 1x50 s PRO 28 Cb -0.03 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 1x50 s PRO 28 CO -0.01 -0.41 0.26 -0.47 0.04 0.00 0.00 177.00 176.41 1x50 s TYR 29 N -1.44 3.22 -0.46 0.56 6.14 -0.08 -4.92 117.35 120.38 1x50 s TYR 29 Ca 0.59 0.07 -0.11 0.00 0.64 0.00 0.00 57.07 58.26 1x50 s TYR 29 Cb -0.31 -2.48 0.09 0.00 0.42 0.00 0.00 41.96 39.68 1x50 s TYR 29 CO 0.38 -0.26 0.34 -0.06 0.64 0.00 0.00 175.55 176.59 1x50 s PHE 30 N 1.85 3.33 -0.36 4.97 0.08 -1.26 -0.93 117.98 125.66 1x50 s PHE 30 Ca 0.09 -1.49 -0.02 0.00 0.12 0.00 0.00 56.93 55.63 1x50 s PHE 30 Cb -0.16 -3.25 0.08 0.00 -0.57 0.00 0.00 43.02 39.12 1x50 s PHE 30 CO 0.11 -0.90 0.12 0.20 -0.10 0.00 0.00 175.22 174.64 1x50 s GLY 31 N 2.54 1.89 -0.10 4.36 0.00 0.16 -4.99 107.32 111.18 1x50 s GLY 31 Ca 0.04 -2.20 -0.30 0.00 0.00 0.00 0.00 44.72 42.26 1x50 s GLY 31 CO 0.02 0.89 1.33 1.09 0.00 0.00 0.00 173.10 176.42 1x50 s ARG 32 N 1.19 4.26 0.49 2.90 1.04 -1.26 -0.50 118.95 127.06 1x50 s ARG 32 Ca 0.03 1.78 -0.22 0.00 -1.04 0.00 0.00 55.73 56.28 1x50 s ARG 32 Cb -0.21 -3.72 -0.07 0.00 -2.04 0.00 0.00 34.95 28.91 1x50 s ARG 32 CO -0.03 -0.65 1.18 -0.51 -0.04 0.00 0.00 175.30 175.25 1x50 s LEU 33 N 3.14 3.94 -0.90 -1.89 1.43 0.27 -4.74 118.68 119.93 1x50 s LEU 33 Ca 0.59 2.33 -0.06 0.00 -1.03 0.00 0.00 54.13 55.95 1x50 s LEU 33 Cb -0.25 -4.31 0.23 0.00 0.03 0.00 0.00 46.19 41.88 1x50 s LEU 33 CO 0.20 -1.05 0.82 -1.10 0.23 0.00 0.00 176.35 175.45 1x50 s GLN 34 N -2.84 3.49 0.00 1.70 -0.21 -1.26 -4.56 119.66 115.98 1x50 s GLN 34 Ca 0.66 -3.00 0.00 0.00 0.02 0.00 0.00 55.36 53.04 1x50 s GLN 34 Cb -0.29 -4.18 0.00 0.00 1.00 0.00 0.00 33.01 29.55 1x50 s GLN 34 CO 0.34 -1.25 0.00 0.41 -2.12 0.00 0.00 175.29 172.68 1x50 n GLY 35 N 2.91 3.96 0.00 3.09 0.00 -1.26 -4.99 105.19 108.89 1x50 n GLY 35 Ca 0.19 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 2.15 3.52 -0.02 0.00 -1.26 -4.89 105.19 104.68 1x50 n GLY 36 Ca 0.00 -2.03 -0.47 0.00 0.00 0.00 0.00 46.02 43.52 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 2.65 -4.14 0.99 4.77 -0.56 -4.94 117.00 115.78 1x50 n LEU 37 Ca 0.00 0.33 -0.20 0.00 -0.03 0.00 0.00 56.01 56.11 1x50 n LEU 37 Cb 0.00 -1.39 -0.13 0.00 -2.33 0.00 0.00 43.42 39.56 1x50 n LEU 37 CO 0.00 -0.70 -0.47 0.42 -1.33 0.00 0.00 177.39 175.31 1x50 s THR 38 N 7.69 1.12 0.52 -5.08 -4.23 -1.26 -4.03 115.64 110.38 1x50 s THR 38 Ca 1.05 -0.98 0.35 0.00 -1.18 0.00 0.00 61.69 60.94 1x50 s THR 38 Cb -0.62 -1.01 0.54 0.00 1.34 0.00 0.00 72.50 72.75 1x50 s THR 38 CO 0.43 0.02 1.78 0.00 -0.54 0.00 0.00 174.62 176.31 1x50 h ALA 39 N 4.98 3.05 -0.87 3.99 0.00 -1.67 0.93 119.26 129.67 1x50 h ALA 39 Ca -0.38 -0.02 -0.47 0.00 0.00 0.00 0.00 54.91 54.03 1x50 h ALA 39 Cb 1.18 0.09 -0.27 0.00 0.00 0.00 0.00 17.79 18.79 1x50 h ALA 39 CO 0.44 -1.43 0.60 -2.13 0.00 0.00 0.00 179.25 176.74 1x50 n ARG 40 N -4.24 2.15 -4.90 0.00 3.00 -1.26 -4.65 116.66 106.75 1x50 n ARG 40 Ca 0.27 -2.65 -0.27 0.00 -0.00 0.00 0.00 57.85 55.21 1x50 n ARG 40 Cb 1.27 -2.04 -0.15 0.00 0.00 0.00 0.00 32.46 31.54 1x50 n ARG 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1x50 s ARG 41 N -2.93 1.60 -0.04 -0.14 3.52 0.32 -3.80 118.95 117.48 1x50 s ARG 41 Ca 0.51 -0.81 -0.01 0.00 -0.13 0.00 0.00 55.73 55.29 1x50 s ARG 41 Cb 0.42 -1.60 0.03 0.00 -1.56 0.00 0.00 34.95 32.24 1x50 s ARG 41 CO 0.08 0.43 0.02 0.99 -0.81 0.00 0.00 175.30 176.01 1x50 s THR 42 N -0.59 0.09 -0.17 4.11 2.01 -0.90 -2.12 115.64 118.08 1x50 s THR 42 Ca 0.08 0.22 -0.13 0.00 0.31 0.00 0.00 61.69 62.17 1x50 s THR 42 Cb -0.08 -0.26 -0.05 0.00 0.01 0.00 0.00 72.50 72.12 1x50 s THR 42 CO 0.00 0.17 0.26 -0.63 -0.69 0.00 0.00 174.62 173.74 1x50 s ILE 43 N 1.57 5.32 -0.06 1.82 1.09 0.16 -1.61 121.20 129.50 1x50 s ILE 43 Ca -0.02 0.49 0.05 0.00 -1.10 0.00 0.00 60.65 60.06 1x50 s ILE 43 Cb -0.13 -3.60 -0.00 0.00 -1.06 0.00 0.00 42.46 37.67 1x50 s ILE 43 CO -0.03 0.40 -0.20 -0.63 -0.10 0.00 0.00 174.94 174.38 1x50 s ILE 44 N 0.44 1.69 -0.23 2.92 1.01 -1.14 0.11 121.20 126.00 1x50 s ILE 44 Ca 0.15 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 1x50 s ILE 44 Cb -0.13 -1.45 0.07 0.00 0.01 0.00 0.00 42.46 40.96 1x50 s ILE 44 CO 0.03 0.48 0.04 -0.63 0.00 0.00 0.00 174.94 174.86 1x50 s ILE 45 N 0.08 0.68 -0.32 2.92 1.01 0.12 -3.48 121.20 122.20 1x50 s ILE 45 Ca -0.07 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.72 1x50 s ILE 45 Cb -0.14 -1.25 0.04 0.00 0.01 0.00 0.00 42.46 41.13 1x50 s ILE 45 CO 0.04 -0.32 0.06 -0.54 0.00 0.00 0.00 174.94 174.17 1x50 s LYS 46 N 1.77 2.53 0.00 2.79 1.02 -0.14 -1.44 119.74 126.26 1x50 s LYS 46 Ca 0.01 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.78 1x50 s LYS 46 Cb -0.17 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 1x50 s LYS 46 CO -0.13 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.07 1x50 n GLY 47 N 4.72 5.65 3.30 -3.33 0.00 -1.17 -0.46 105.19 113.90 1x50 n GLY 47 Ca -0.13 -0.95 0.03 0.00 0.00 0.00 0.00 46.02 44.96 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 2.21 -0.44 -0.27 1.61 6.14 0.31 -3.36 117.35 123.56 1x50 s TYR 48 Ca 0.00 0.73 -0.29 0.00 0.64 0.00 0.00 57.07 58.16 1x50 s TYR 48 Cb 0.00 0.25 -0.02 0.00 0.42 0.00 0.00 41.96 42.62 1x50 s TYR 48 CO 0.00 -0.22 1.58 0.08 0.64 0.00 0.00 175.55 177.64 1x50 s VAL 49 N 2.33 3.74 0.70 3.14 1.01 -1.18 -1.42 120.40 128.72 1x50 s VAL 49 Ca -0.01 0.81 -0.13 0.00 0.00 0.00 0.00 61.98 62.65 1x50 s VAL 49 Cb -0.04 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.55 1x50 s VAL 49 CO -0.17 -0.39 1.10 -2.16 0.00 0.00 0.00 175.10 173.49 1x50 s PRO 50 N 4.80 2.59 0.25 2.72 0.04 -1.26 -0.96 135.00 143.18 1x50 s PRO 50 Ca 0.70 1.31 0.23 0.00 0.04 0.00 0.00 61.00 63.28 1x50 s PRO 50 Cb -0.22 -1.93 0.97 0.00 0.04 0.00 0.00 34.50 33.36 1x50 s PRO 50 CO 0.30 -1.40 1.70 -0.35 0.04 0.00 0.00 177.00 177.28 1x50 n PRO 51 N -2.84 0.19 -0.38 0.56 -0.04 -1.26 -2.25 135.00 128.98 1x50 n PRO 51 Ca 0.10 0.42 0.08 0.00 -0.04 0.00 0.00 63.50 64.06 1x50 n PRO 51 Cb 0.52 -1.86 0.23 0.00 -0.04 0.00 0.00 33.50 32.36 1x50 n PRO 51 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1x50 n THR 52 N -2.21 2.07 -4.33 0.52 -2.24 -1.26 -4.95 114.28 101.88 1x50 n THR 52 Ca 0.02 -1.77 -0.33 0.00 -2.27 0.00 0.00 64.05 59.69 1x50 n THR 52 Cb 0.22 -0.14 -0.15 0.00 -2.10 0.00 0.00 70.33 68.16 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 1.49 0.02 3.38 0.00 -0.95 -5.03 107.32 104.37 1x50 s GLY 53 Ca 0.38 -1.10 -0.28 0.00 0.00 0.00 0.00 44.72 43.73 1x50 s GLY 53 CO 0.09 0.15 1.17 0.50 0.00 0.00 0.00 173.10 175.01 1x50 h LYS 54 N 7.57 -0.91 -1.60 2.90 1.57 -1.87 -3.44 116.57 120.79 1x50 h LYS 54 Ca -0.37 0.06 0.24 0.00 -1.87 0.00 0.00 60.65 58.71 1x50 h LYS 54 Cb 1.17 0.21 -0.18 0.00 0.08 0.00 0.00 32.23 33.51 1x50 h LYS 54 CO 0.59 -0.59 0.76 -1.54 -0.57 0.00 0.00 179.45 178.10 1x50 s SER 55 N -4.47 -0.16 0.24 0.86 1.04 -1.26 -4.17 113.70 105.78 1x50 s SER 55 Ca -0.15 -0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.28 1x50 s SER 55 Cb 0.02 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.33 1x50 s SER 55 CO 0.45 -0.30 0.11 2.22 0.98 0.00 0.00 173.24 176.70 1x50 n PHE 56 N -0.14 -0.40 -3.66 5.02 -1.74 -1.25 -1.57 117.46 113.72 1x50 n PHE 56 Ca -0.01 -1.09 -0.08 0.00 -0.56 0.00 0.00 57.45 55.71 1x50 n PHE 56 Cb 0.59 -0.18 -0.08 0.00 1.52 0.00 0.00 39.48 41.33 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 -2.37 -1.54 -0.40 1.98 0.00 0.06 -3.76 121.76 115.73 1x50 s ALA 57 Ca 0.08 2.03 -0.04 0.00 0.00 0.00 0.00 51.96 54.03 1x50 s ALA 57 Cb -0.01 -1.28 0.10 0.00 0.00 0.00 0.00 23.12 21.93 1x50 s ALA 57 CO 0.05 -0.42 0.18 0.42 0.00 0.00 0.00 175.76 175.99 1x50 s ILE 58 N 1.76 3.41 0.06 0.00 1.09 0.07 -1.80 121.20 125.79 1x50 s ILE 58 Ca -0.09 -1.85 0.00 0.00 -1.10 0.00 0.00 60.65 57.62 1x50 s ILE 58 Cb -0.07 -3.24 -0.04 0.00 -1.06 0.00 0.00 42.46 38.05 1x50 s ILE 58 CO -0.17 -0.58 0.19 0.20 -0.10 0.00 0.00 174.94 174.48 1x50 s ASN 59 N 1.81 6.23 -0.34 3.58 0.01 -0.86 -2.40 114.94 122.96 1x50 s ASN 59 Ca 0.05 0.23 0.03 0.00 -0.71 0.00 0.00 52.86 52.46 1x50 s ASN 59 Cb -0.22 -1.89 0.10 0.00 0.41 0.00 0.00 41.25 39.64 1x50 s ASN 59 CO -0.03 0.18 0.06 -0.36 -1.51 0.00 0.00 177.10 175.44 1x50 s PHE 60 N -1.48 3.68 0.48 2.20 0.40 0.26 -1.84 117.98 121.70 1x50 s PHE 60 Ca 0.34 -2.82 0.03 0.00 -0.60 0.00 0.00 56.93 53.88 1x50 s PHE 60 Cb -0.13 -2.88 0.02 0.00 0.51 0.00 0.00 43.02 40.54 1x50 s PHE 60 CO 0.26 -0.94 0.68 0.21 0.70 0.00 0.00 175.22 176.13 1x50 s LYS 61 N 0.97 2.73 -0.24 0.44 2.20 -0.70 -1.32 119.74 123.82 1x50 s LYS 61 Ca 0.08 -0.89 -0.10 0.00 -0.36 0.00 0.00 55.97 54.70 1x50 s LYS 61 Cb -0.20 -2.60 -0.05 0.00 -1.51 0.00 0.00 37.83 33.47 1x50 s LYS 61 CO -0.07 -0.47 0.15 0.08 -0.36 0.00 0.00 175.35 174.68 1x50 s VAL 62 N -2.57 5.28 0.41 4.02 1.01 -0.76 -0.95 120.40 126.83 1x50 s VAL 62 Ca 0.55 0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.75 1x50 s VAL 62 Cb -0.10 -3.46 0.25 0.00 0.00 0.00 0.00 36.38 33.07 1x50 s VAL 62 CO 0.36 0.35 2.05 1.23 0.00 0.00 0.00 175.10 179.08 1x50 h GLY 63 N 7.54 0.53 0.00 4.51 0.00 -1.76 -1.44 103.07 112.45 1x50 h GLY 63 Ca -0.38 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1x50 h GLY 63 CO 0.65 0.20 0.00 1.44 0.00 0.00 0.00 176.54 178.83 1x50 n SER 64 N -4.46 0.00 0.00 0.19 7.64 -1.26 -4.73 113.62 111.00 1x50 n SER 64 Ca 0.02 0.68 0.00 0.00 1.01 0.00 0.00 58.87 60.58 1x50 n SER 64 Cb 0.08 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1x50 n SER 64 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1x50 n SER 65 N -1.84 0.00 0.00 6.43 3.41 -1.23 -5.03 113.62 115.36 1x50 n SER 65 Ca 0.00 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1x50 n SER 65 Cb 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1x50 n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x50 n GLY 66 N 2.23 0.33 3.52 5.00 0.00 -0.54 -4.94 105.19 110.79 1x50 n GLY 66 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.38 4.20 -0.37 1.61 1.01 -1.26 -4.69 116.67 116.79 1x50 s ASP 67 Ca 0.00 -0.29 -0.21 0.00 0.71 0.00 0.00 52.55 52.75 1x50 s ASP 67 Cb 0.00 -0.83 0.01 0.00 1.01 0.00 0.00 42.92 43.10 1x50 s ASP 67 CO 0.00 0.27 0.67 -0.63 0.21 0.00 0.00 175.17 175.69 1x50 s ILE 68 N -0.97 4.84 -0.01 0.77 1.01 0.70 -1.83 121.20 125.71 1x50 s ILE 68 Ca 0.16 0.58 0.06 0.00 0.00 0.00 0.00 60.65 61.45 1x50 s ILE 68 Cb -0.11 -4.13 -0.24 0.00 0.01 0.00 0.00 42.46 37.99 1x50 s ILE 68 CO 0.07 -0.39 0.78 0.00 0.00 0.00 0.00 174.94 175.40 1x50 h ALA 69 N 8.54 0.56 -3.49 9.38 0.00 -1.41 -0.32 119.26 132.52 1x50 h ALA 69 Ca -0.26 -1.29 -0.36 0.00 0.00 0.00 0.00 54.91 53.00 1x50 h ALA 69 Cb 1.10 0.36 -0.34 0.00 0.00 0.00 0.00 17.79 18.91 1x50 h ALA 69 CO 0.86 1.41 -0.75 -1.17 0.00 0.00 0.00 179.25 179.59 1x50 s LEU 70 N -6.49 1.21 -0.35 0.00 2.96 -1.25 -4.51 118.68 110.24 1x50 s LEU 70 Ca -0.06 -0.05 -0.00 0.00 -0.22 0.00 0.00 54.13 53.79 1x50 s LEU 70 Cb 0.08 -0.28 0.12 0.00 0.50 0.00 0.00 46.19 46.61 1x50 s LEU 70 CO 0.82 -0.09 0.17 -2.28 -1.32 0.00 0.00 176.35 173.66 1x50 s HIS 71 N 0.99 1.32 -0.16 5.38 5.65 0.62 -0.57 115.29 128.52 1x50 s HIS 71 Ca -0.10 -1.78 -0.09 0.00 0.25 0.00 0.00 55.06 53.34 1x50 s HIS 71 Cb -0.14 -1.43 -0.05 0.00 -1.18 0.00 0.00 32.58 29.79 1x50 s HIS 71 CO -0.01 -0.83 0.15 0.42 -0.65 0.00 0.00 174.74 173.82 1x50 s ILE 72 N 1.18 5.44 -0.21 0.89 1.01 -1.01 -0.68 121.20 127.82 1x50 s ILE 72 Ca 0.14 0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.99 1x50 s ILE 72 Cb -0.21 -3.45 0.08 0.00 0.01 0.00 0.00 42.46 38.89 1x50 s ILE 72 CO -0.13 0.52 0.14 0.21 0.00 0.00 0.00 174.94 175.68 1x50 s ASN 73 N -0.29 2.42 0.66 3.58 3.04 -0.82 -0.75 114.94 122.78 1x50 s ASN 73 Ca 0.12 -0.72 -0.15 0.00 0.04 0.00 0.00 52.86 52.15 1x50 s ASN 73 Cb -0.12 -0.11 0.00 0.00 -1.54 0.00 0.00 41.25 39.48 1x50 s ASN 73 CO 0.01 -0.37 1.11 -2.16 -3.04 0.00 0.00 177.10 172.65 1x50 s PRO 74 N 2.18 2.79 -0.35 0.43 0.04 -1.25 -2.47 135.00 136.37 1x50 s PRO 74 Ca 0.05 1.38 0.01 0.00 0.04 0.00 0.00 61.00 62.48 1x50 s PRO 74 Cb -0.16 -1.95 0.11 0.00 0.04 0.00 0.00 34.50 32.54 1x50 s PRO 74 CO -0.18 -1.25 0.12 1.03 0.04 0.00 0.00 177.00 176.76 1x50 s ARG 75 N -4.12 1.01 0.47 4.56 0.52 -1.21 -4.45 118.95 115.74 1x50 s ARG 75 Ca 0.67 -1.47 0.19 0.00 -0.52 0.00 0.00 55.73 54.60 1x50 s ARG 75 Cb -0.20 -2.32 1.18 0.00 0.52 0.00 0.00 34.95 34.12 1x50 s ARG 75 CO 0.42 -1.02 1.98 0.52 0.02 0.00 0.00 175.30 177.21 1x50 h MET 76 N 7.66 0.24 0.00 3.54 2.86 -1.85 -0.55 114.93 126.82 1x50 h MET 76 Ca -0.09 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1x50 h MET 76 Cb 0.99 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.60 1x50 h MET 76 CO 0.49 0.16 0.00 0.41 1.06 0.00 0.00 176.91 179.03 1x50 n GLY 77 N -1.57 -1.02 0.13 8.32 0.00 -1.26 -4.24 105.19 105.57 1x50 n GLY 77 Ca 0.10 0.13 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 1x50 n GLY 77 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1x50 h ASN 78 N 0.00 0.42 0.00 1.61 2.35 -2.02 -3.49 115.58 114.45 1x50 h ASN 78 Ca 0.00 -0.89 0.00 0.00 -0.55 0.00 0.00 56.30 54.86 1x50 h ASN 78 Cb 0.00 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1x50 h ASN 78 CO 0.00 1.77 0.00 0.61 -1.65 0.00 0.00 177.43 178.16 1x50 n GLY 79 N 1.87 1.64 3.35 2.83 0.00 -0.22 -5.02 105.19 109.64 1x50 n GLY 79 Ca -0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.89 3.75 -0.37 2.61 -4.23 -1.24 -4.59 115.64 109.69 1x50 s THR 80 Ca 0.00 -0.51 -0.15 0.00 -1.18 0.00 0.00 61.69 59.85 1x50 s THR 80 Cb 0.00 -2.81 -0.00 0.00 1.34 0.00 0.00 72.50 71.03 1x50 s THR 80 CO 0.00 0.28 0.35 -0.69 -0.54 0.00 0.00 174.62 174.02 1x50 s VAL 81 N 1.51 5.18 0.27 2.29 1.01 -1.26 -3.29 120.40 126.11 1x50 s VAL 81 Ca 0.05 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.65 1x50 s VAL 81 Cb -0.16 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 1x50 s VAL 81 CO 0.00 -0.18 0.82 -0.69 0.00 0.00 0.00 175.10 175.06 1x50 s VAL 82 N 1.96 4.42 -0.12 2.92 1.01 -1.03 -4.26 120.40 125.30 1x50 s VAL 82 Ca 0.10 1.51 0.02 0.00 0.00 0.00 0.00 61.98 63.61 1x50 s VAL 82 Cb -0.17 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.32 1x50 s VAL 82 CO 0.12 0.15 -0.17 -0.13 0.00 0.00 0.00 175.10 175.07 1x50 s ARG 83 N -2.08 2.42 0.32 2.72 3.00 -0.44 -1.95 118.95 122.94 1x50 s ARG 83 Ca 0.47 -0.64 0.06 0.00 0.00 0.00 0.00 55.73 55.62 1x50 s ARG 83 Cb -0.17 -2.02 -0.03 0.00 0.00 0.00 0.00 34.95 32.73 1x50 s ARG 83 CO 0.22 -0.04 0.25 -0.80 0.00 0.00 0.00 175.30 174.92 1x50 s ASN 84 N 0.93 1.56 -0.30 0.23 -0.87 0.14 -1.06 114.94 115.57 1x50 s ASN 84 Ca -0.07 -1.71 -0.00 0.00 -1.57 0.00 0.00 52.86 49.51 1x50 s ASN 84 Cb -0.15 0.53 0.19 0.00 -0.02 0.00 0.00 41.25 41.80 1x50 s ASN 84 CO -0.01 -1.02 0.62 -0.94 -2.57 0.00 0.00 177.10 173.17 1x50 s SER 85 N -3.36 -1.40 -0.25 -1.22 1.04 -1.26 0.23 113.70 107.47 1x50 s SER 85 Ca 0.39 0.70 -0.29 0.00 0.48 0.00 0.00 55.95 57.23 1x50 s SER 85 Cb 0.03 2.10 0.00 0.00 0.10 0.00 0.00 66.02 68.25 1x50 s SER 85 CO 0.25 -0.26 1.21 -0.22 0.98 0.00 0.00 173.24 175.20 1x50 s LEU 86 N 2.86 4.01 0.39 2.42 2.96 -0.13 -0.50 118.68 130.68 1x50 s LEU 86 Ca 0.18 1.34 -0.00 0.00 -0.22 0.00 0.00 54.13 55.43 1x50 s LEU 86 Cb -0.14 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1x50 s LEU 86 CO -0.22 -0.89 0.60 -0.76 -1.32 0.00 0.00 176.35 173.76 1x50 s LEU 87 N 3.83 3.88 -0.89 -0.68 1.43 0.60 -0.22 118.68 126.62 1x50 s LEU 87 Ca 0.52 0.45 -0.32 0.00 -1.03 0.00 0.00 54.13 53.75 1x50 s LEU 87 Cb -0.17 -3.33 -0.21 0.00 0.03 0.00 0.00 46.19 42.52 1x50 s LEU 87 CO 0.17 -0.43 2.60 0.59 0.23 0.00 0.00 176.35 179.51 1x50 n ASN 88 N -1.91 0.50 0.00 2.29 3.02 -1.26 0.21 115.26 118.11 1x50 n ASN 88 Ca -0.03 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1x50 n ASN 88 Cb 0.56 -0.96 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 1x50 n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x50 n GLY 89 N 6.60 0.57 3.58 7.41 0.00 -1.26 -4.92 105.19 117.18 1x50 n GLY 89 Ca 0.63 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.38 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 -2.46 3.25 0.16 1.61 0.15 0.56 -5.17 113.70 111.80 1x50 s SER 90 Ca 0.00 -1.49 0.05 0.00 0.70 0.00 0.00 55.95 55.21 1x50 s SER 90 Cb 0.00 0.08 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 1x50 s SER 90 CO 0.00 -0.68 -0.11 0.26 1.20 0.00 0.00 173.24 173.90 1x50 s TRP 91 N -3.03 1.38 0.00 3.44 0.52 -1.26 0.22 118.94 120.21 1x50 s TRP 91 Ca 0.27 -0.70 0.00 0.00 0.02 0.00 0.00 56.10 55.69 1x50 s TRP 91 Cb 0.06 -0.68 0.00 0.00 -1.15 0.00 0.00 33.47 31.70 1x50 s TRP 91 CO 0.13 0.15 0.00 0.41 0.02 0.00 0.00 176.95 177.67 1x50 n GLY 92 N -0.18 0.97 3.82 0.98 0.00 0.34 -4.72 105.19 106.40 1x50 n GLY 92 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.07 -0.24 1.61 0.01 -1.26 -4.95 113.70 107.79 1x50 s SER 93 Ca 0.00 -0.98 -0.08 0.00 1.31 0.00 0.00 55.95 56.20 1x50 s SER 93 Cb 0.00 0.81 -0.04 0.00 0.21 0.00 0.00 66.02 67.01 1x50 s SER 93 CO 0.00 -1.58 0.09 -1.61 0.41 0.00 0.00 173.24 170.55 1x50 s GLU 94 N -2.82 3.82 -0.22 12.44 2.02 -1.25 -3.76 118.70 128.92 1x50 s GLU 94 Ca 0.14 -0.40 0.02 0.00 0.02 0.00 0.00 54.97 54.75 1x50 s GLU 94 Cb -0.05 -3.37 0.05 0.00 0.10 0.00 0.00 34.13 30.86 1x50 s GLU 94 CO 0.10 -0.05 -0.12 -1.21 0.02 0.00 0.00 175.26 174.00 1x50 s GLU 95 N 1.28 2.27 -0.22 1.61 0.41 -0.23 -4.88 118.70 118.93 1x50 s GLU 95 Ca 0.05 -1.07 -0.02 0.00 -0.41 0.00 0.00 54.97 53.52 1x50 s GLU 95 Cb -0.15 -2.66 0.01 0.00 -1.78 0.00 0.00 34.13 29.55 1x50 s GLU 95 CO 0.04 -0.46 -0.07 0.15 -0.49 0.00 0.00 175.26 174.43 1x50 s LYS 96 N 1.25 3.13 -0.30 1.61 1.02 -1.26 -1.33 119.74 123.86 1x50 s LYS 96 Ca -0.04 -0.78 -0.10 0.00 0.02 0.00 0.00 55.97 55.07 1x50 s LYS 96 Cb -0.17 -2.93 0.18 0.00 -0.52 0.00 0.00 37.83 34.39 1x50 s LYS 96 CO -0.08 -0.27 0.98 0.21 -0.92 0.00 0.00 175.35 175.28 1x50 s LYS 97 N 1.40 0.22 -0.03 1.68 2.47 -1.26 -5.06 119.74 119.16 1x50 s LYS 97 Ca 0.04 0.31 -0.06 0.00 -1.56 0.00 0.00 55.97 54.70 1x50 s LYS 97 Cb -0.15 0.16 0.01 0.00 -1.46 0.00 0.00 37.83 36.39 1x50 s LYS 97 CO -0.05 -0.32 0.14 -1.50 0.16 0.00 0.00 175.35 173.77 1x50 s ILE 98 N 2.94 0.03 -0.10 5.43 2.07 -1.26 -4.73 121.20 125.57 1x50 s ILE 98 Ca 0.12 -0.26 -0.25 0.00 -1.41 0.00 0.00 60.65 58.86 1x50 s ILE 98 Cb -0.07 -0.29 -0.21 0.00 0.13 0.00 0.00 42.46 42.02 1x50 s ILE 98 CO -0.17 -0.14 0.79 0.00 -1.91 0.00 0.00 174.94 173.51 1x50 h THR 99 N 4.69 1.42 -3.56 4.00 1.03 -1.88 -3.46 112.91 115.14 1x50 h THR 99 Ca -0.27 -1.84 -0.26 0.00 -0.01 0.00 0.00 66.41 64.02 1x50 h THR 99 Cb 1.20 2.58 -0.31 0.00 -1.07 0.00 0.00 68.15 70.55 1x50 h THR 99 CO 0.41 0.44 -0.70 -1.38 -0.01 0.00 0.00 175.52 174.28 1x50 s HIS 100 N -2.67 -0.01 -0.55 0.00 0.00 -1.26 -5.11 115.29 105.69 1x50 s HIS 100 Ca -0.16 0.13 -0.14 0.00 -3.00 0.00 0.00 55.06 51.89 1x50 s HIS 100 Cb -0.01 -0.12 0.13 0.00 -4.00 0.00 0.00 32.58 28.58 1x50 s HIS 100 CO 0.59 -0.06 0.49 1.21 -1.00 0.00 0.00 174.74 175.96 1x50 s ASN 101 N 0.64 6.12 0.13 7.38 3.84 -1.26 -4.92 114.94 126.86 1x50 s ASN 101 Ca -0.05 -1.90 -0.12 0.00 0.21 0.00 0.00 52.86 51.00 1x50 s ASN 101 Cb -0.07 -2.16 -0.06 0.00 -0.55 0.00 0.00 41.25 38.41 1x50 s ASN 101 CO -0.02 -0.80 1.46 1.55 -2.79 0.00 0.00 177.10 176.50 1x50 h PRO 102 N 8.69 0.87 -6.00 0.43 0.13 -1.99 -3.44 132.00 130.68 1x50 h PRO 102 Ca -0.25 -0.46 -0.78 0.00 -0.87 0.00 0.00 66.00 63.64 1x50 h PRO 102 Cb 1.09 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 1x50 h PRO 102 CO 0.98 1.10 1.22 1.19 -0.23 0.00 0.00 178.00 182.25 1x50 n PHE 103 N -4.12 1.31 -4.24 1.56 3.72 -1.26 -4.91 117.46 109.52 1x50 n PHE 103 Ca -0.03 0.79 -0.19 0.00 -0.05 0.00 0.00 57.45 57.97 1x50 n PHE 103 Cb 0.52 -2.30 -0.16 0.00 -0.94 0.00 0.00 39.48 36.60 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 5.56 0.43 -0.71 1.37 0.00 -1.26 -4.72 107.32 107.98 1x50 s GLY 104 Ca 1.16 -0.17 -0.26 0.00 0.00 0.00 0.00 44.72 45.45 1x50 s GLY 104 CO 0.67 0.14 1.89 2.56 0.00 0.00 0.00 173.10 178.36 1x50 s PRO 105 N 0.46 2.60 0.00 2.90 0.04 -1.26 -2.23 135.00 137.51 1x50 s PRO 105 Ca -0.06 0.29 0.00 0.00 0.04 0.00 0.00 61.00 61.27 1x50 s PRO 105 Cb -0.10 -4.63 0.00 0.00 0.04 0.00 0.00 34.50 29.81 1x50 s PRO 105 CO 0.00 -2.96 0.00 0.41 0.04 0.00 0.00 177.00 174.49 1x50 n GLY 106 N 6.10 0.28 3.05 0.56 0.00 -0.13 -4.65 105.19 110.41 1x50 n GLY 106 Ca 0.27 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 0.51 1.02 1.61 -2.07 -0.94 -4.97 119.66 114.82 1x50 s GLN 107 Ca 0.00 -0.92 -0.14 0.00 -1.82 0.00 0.00 55.36 52.48 1x50 s GLN 107 Cb 0.00 0.03 0.20 0.00 -1.09 0.00 0.00 33.01 32.15 1x50 s GLN 107 CO 0.00 -0.05 1.12 -0.06 -1.32 0.00 0.00 175.29 174.98 1x50 s PHE 108 N -2.51 1.87 -0.27 9.60 0.40 -1.26 -3.09 117.98 122.71 1x50 s PHE 108 Ca -0.04 0.80 -0.22 0.00 -0.60 0.00 0.00 56.93 56.87 1x50 s PHE 108 Cb -0.02 -3.39 0.08 0.00 0.51 0.00 0.00 43.02 40.20 1x50 s PHE 108 CO -0.04 -2.95 0.73 -0.59 0.70 0.00 0.00 175.22 173.07 1x50 s PHE 109 N -3.12 -0.87 -0.37 0.36 -0.71 -1.21 -4.78 117.98 107.27 1x50 s PHE 109 Ca 0.67 1.96 -0.05 0.00 -1.04 0.00 0.00 56.93 58.46 1x50 s PHE 109 Cb -0.15 0.40 0.07 0.00 -1.21 0.00 0.00 43.02 42.14 1x50 s PHE 109 CO 0.56 -0.42 0.16 0.34 -1.34 0.00 0.00 175.22 174.51 1x50 s ASP 110 N 0.83 5.31 -0.09 1.98 2.15 -1.26 -3.04 116.67 122.56 1x50 s ASP 110 Ca -0.04 -1.51 -0.02 0.00 0.43 0.00 0.00 52.55 51.42 1x50 s ASP 110 Cb -0.05 -1.86 -0.03 0.00 -0.30 0.00 0.00 42.92 40.68 1x50 s ASP 110 CO -0.07 -0.43 -0.00 -0.22 -0.17 0.00 0.00 175.17 174.27 1x50 s LEU 111 N 1.31 3.55 -0.15 -1.34 1.98 -0.52 -1.37 118.68 122.14 1x50 s LEU 111 Ca 0.02 0.13 -0.04 0.00 -2.89 0.00 0.00 54.13 51.35 1x50 s LEU 111 Cb -0.21 -1.81 0.07 0.00 0.66 0.00 0.00 46.19 44.90 1x50 s LEU 111 CO -0.00 0.37 0.21 -0.44 -1.89 0.00 0.00 176.35 174.60 1x50 s SER 112 N -0.85 1.02 -0.21 3.68 0.01 -0.92 0.11 113.70 116.54 1x50 s SER 112 Ca 0.13 0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.36 1x50 s SER 112 Cb -0.11 0.40 -0.05 0.00 0.21 0.00 0.00 66.02 66.47 1x50 s SER 112 CO 0.02 -0.29 0.22 -0.63 0.41 0.00 0.00 173.24 172.98 1x50 s ILE 113 N 2.33 5.33 -0.17 1.44 1.09 0.30 -0.21 121.20 131.31 1x50 s ILE 113 Ca 0.05 0.35 -0.09 0.00 -1.10 0.00 0.00 60.65 59.86 1x50 s ILE 113 Cb -0.14 -3.56 -0.05 0.00 -1.06 0.00 0.00 42.46 37.66 1x50 s ILE 113 CO -0.09 0.36 0.13 -0.13 -0.10 0.00 0.00 174.94 175.11 1x50 s ARG 114 N 0.80 3.91 -0.55 2.79 0.52 0.35 0.39 118.95 127.16 1x50 s ARG 114 Ca 0.11 -0.20 -0.17 0.00 -0.52 0.00 0.00 55.73 54.96 1x50 s ARG 114 Cb -0.13 -3.33 0.12 0.00 0.52 0.00 0.00 34.95 32.13 1x50 s ARG 114 CO 0.03 0.46 0.55 0.00 0.02 0.00 0.00 175.30 176.37 1x50 n GLY 116 N 5.25 1.45 0.00 0.00 0.00 -0.98 -3.81 105.19 107.10 1x50 n GLY 116 Ca -0.13 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 2.20 0.04 0.99 4.77 -1.26 -3.88 117.00 119.86 1x50 n LEU 117 Ca 0.00 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1x50 n LEU 117 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 1x50 n LEU 117 CO 0.00 0.37 -0.39 -0.67 -1.33 0.00 0.00 177.39 175.37 1x50 n ASP 118 N -2.28 0.48 -2.41 -1.43 2.03 -1.26 -5.01 116.55 106.67 1x50 n ASP 118 Ca 0.00 0.19 0.01 0.00 0.52 0.00 0.00 54.79 55.51 1x50 n ASP 118 Cb 0.43 1.02 0.01 0.00 -0.72 0.00 0.00 41.12 41.86 1x50 n ASP 118 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1x50 n ARG 119 N -2.56 0.14 -4.16 -0.67 -4.01 -1.26 -3.92 116.66 100.22 1x50 n ARG 119 Ca -0.05 -0.47 -0.31 0.00 -1.04 0.00 0.00 57.85 55.98 1x50 n ARG 119 Cb 0.64 0.73 -0.08 0.00 -3.04 0.00 0.00 32.46 30.71 1x50 n ARG 119 CO 0.00 0.00 0.00 -0.06 -3.04 0.00 0.00 177.63 174.53 1x50 s PHE 120 N -2.83 3.02 -0.32 2.89 0.40 -0.44 -2.32 117.98 118.37 1x50 s PHE 120 Ca 0.15 -0.00 0.04 0.00 -0.60 0.00 0.00 56.93 56.52 1x50 s PHE 120 Cb -0.01 -1.57 0.09 0.00 0.51 0.00 0.00 43.02 42.05 1x50 s PHE 120 CO 0.00 0.48 0.02 0.15 0.70 0.00 0.00 175.22 176.57 1x50 s LYS 121 N -2.16 1.62 -0.10 0.44 -0.14 -0.39 -2.04 119.74 116.96 1x50 s LYS 121 Ca 0.25 -1.77 -0.21 0.00 -1.36 0.00 0.00 55.97 52.88 1x50 s LYS 121 Cb -0.12 -3.13 -0.04 0.00 -1.68 0.00 0.00 37.83 32.86 1x50 s LYS 121 CO 0.17 -0.87 0.59 0.08 -0.76 0.00 0.00 175.35 174.56 1x50 s VAL 122 N 0.95 5.12 0.28 3.17 1.01 -0.22 -0.49 120.40 130.22 1x50 s VAL 122 Ca 0.07 1.19 0.10 0.00 0.00 0.00 0.00 61.98 63.34 1x50 s VAL 122 Cb -0.19 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1x50 s VAL 122 CO -0.08 0.28 -0.08 -0.31 0.00 0.00 0.00 175.10 174.92 1x50 s TYR 123 N 0.75 2.52 -0.11 5.22 1.51 0.70 -0.45 117.35 127.49 1x50 s TYR 123 Ca 0.31 -0.29 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 1x50 s TYR 123 Cb -0.16 -1.16 0.05 0.00 -0.11 0.00 0.00 41.96 40.58 1x50 s TYR 123 CO 0.14 0.64 0.08 0.00 -1.11 0.00 0.00 175.55 175.29 1x50 s ALA 124 N -2.42 0.35 -1.63 3.71 0.00 0.19 -2.17 121.76 119.78 1x50 s ALA 124 Ca 0.31 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.98 1x50 s ALA 124 Cb -0.05 -0.85 0.19 0.00 0.00 0.00 0.00 23.12 22.41 1x50 s ALA 124 CO 0.18 -0.87 0.56 0.09 0.00 0.00 0.00 175.76 175.71 1x50 n ASN 125 N 5.29 -2.05 0.00 0.00 3.02 -0.47 0.16 115.26 121.21 1x50 n ASN 125 Ca -0.05 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1x50 n ASN 125 Cb 0.49 -1.77 0.00 0.00 -0.61 0.00 0.00 39.78 37.90 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 -1.05 0.63 2.67 7.41 0.00 -1.26 -5.06 105.19 108.53 1x50 n GLY 126 Ca 0.10 -0.77 -0.23 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.01 0.13 -0.67 1.61 -1.52 0.42 -5.08 119.66 111.54 1x50 s GLN 127 Ca 0.00 0.12 -0.32 0.00 -1.95 0.00 0.00 55.36 53.21 1x50 s GLN 127 Cb 0.00 -1.15 -0.15 0.00 -0.22 0.00 0.00 33.01 31.49 1x50 s GLN 127 CO 0.00 -0.46 2.46 1.58 -0.25 0.00 0.00 175.29 178.61 1x50 n HIS 128 N 5.25 1.09 0.04 0.91 -0.00 -1.26 0.54 115.22 121.79 1x50 n HIS 128 Ca -0.05 0.32 -0.02 0.00 -0.00 0.00 0.00 57.72 57.97 1x50 n HIS 128 Cb 0.49 -2.48 -0.01 0.00 -0.00 0.00 0.00 29.99 28.00 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 13.90 -0.09 -7.91 0.27 5.85 -1.02 -3.46 115.31 122.85 1x50 h LEU 129 Ca -0.16 0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.66 1x50 h LEU 129 Cb 1.31 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1x50 h LEU 129 CO 1.22 -0.03 0.42 0.72 -0.34 0.00 0.00 178.44 180.43 1x50 s PHE 130 N -2.31 0.01 0.22 1.25 -0.12 -1.09 -3.74 117.98 112.20 1x50 s PHE 130 Ca -0.02 -0.49 0.10 0.00 -0.05 0.00 0.00 56.93 56.48 1x50 s PHE 130 Cb 0.00 0.73 -0.04 0.00 -0.63 0.00 0.00 43.02 43.08 1x50 s PHE 130 CO 0.05 -1.15 -0.14 0.34 -0.05 0.00 0.00 175.22 174.26 1x50 s ASP 131 N -3.14 3.92 -0.26 1.98 2.15 -1.26 -1.06 116.67 119.00 1x50 s ASP 131 Ca 0.16 -0.78 0.00 0.00 0.43 0.00 0.00 52.55 52.36 1x50 s ASP 131 Cb -0.04 -0.51 0.08 0.00 -0.30 0.00 0.00 42.92 42.15 1x50 s ASP 131 CO 0.07 0.07 0.02 0.12 -0.17 0.00 0.00 175.17 175.28 1x50 s PHE 132 N -2.01 2.12 0.30 -5.34 5.36 -0.87 -4.96 117.98 112.59 1x50 s PHE 132 Ca 0.26 -1.74 -0.29 0.00 -0.96 0.00 0.00 56.93 54.20 1x50 s PHE 132 Cb -0.07 -1.68 -0.11 0.00 -0.34 0.00 0.00 43.02 40.83 1x50 s PHE 132 CO 0.15 -0.79 1.47 0.00 -1.46 0.00 0.00 175.22 174.58 1x50 s ALA 133 N 1.48 3.63 -0.09 11.12 0.00 -1.26 -1.32 121.76 135.32 1x50 s ALA 133 Ca 0.01 1.43 -0.29 0.00 0.00 0.00 0.00 51.96 53.11 1x50 s ALA 133 Cb -0.18 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.29 1x50 s ALA 133 CO -0.12 -0.85 2.02 -1.01 0.00 0.00 0.00 175.76 175.80 1x50 s HIS 134 N -0.37 1.34 -0.24 0.00 0.09 -1.25 -4.86 115.29 110.00 1x50 s HIS 134 Ca 0.58 0.04 -0.13 0.00 -0.00 0.00 0.00 55.06 55.55 1x50 s HIS 134 Cb -0.44 -4.09 -0.16 0.00 -0.00 0.00 0.00 32.58 27.89 1x50 s HIS 134 CO 0.50 -4.69 -0.09 0.54 -0.00 0.00 0.00 174.74 170.99 1x50 n ARG 135 N 8.02 0.61 -3.29 1.40 1.74 -1.26 -4.84 116.66 119.04 1x50 n ARG 135 Ca 0.24 0.34 -0.43 0.00 -0.77 0.00 0.00 57.85 57.23 1x50 n ARG 135 Cb 0.43 -1.60 -0.08 0.00 -1.02 0.00 0.00 32.46 30.20 1x50 n ARG 135 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1x50 s LEU 136 N -7.44 5.00 0.45 0.55 2.96 -1.26 -4.93 118.68 114.01 1x50 s LEU 136 Ca -0.34 -0.83 0.26 0.00 -0.22 0.00 0.00 54.13 53.01 1x50 s LEU 136 Cb 0.11 -2.38 1.30 0.00 0.50 0.00 0.00 46.19 45.72 1x50 s LEU 136 CO 0.56 -0.67 1.76 0.77 -1.32 0.00 0.00 176.35 177.46 1x50 h SER 137 N 8.80 0.27 -0.18 3.68 4.64 -2.01 0.56 113.55 129.32 1x50 h SER 137 Ca -0.27 0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.02 1x50 h SER 137 Cb 1.11 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.16 1x50 h SER 137 CO 0.85 0.02 0.12 0.00 -0.87 0.00 0.00 176.83 176.96 1x50 n ALA 138 N -2.58 3.21 -0.28 5.18 0.00 -1.26 -4.42 120.51 120.37 1x50 n ALA 138 Ca 0.27 -0.54 0.22 0.00 0.00 0.00 0.00 53.44 53.40 1x50 n ALA 138 Cb 1.08 -1.09 0.54 0.00 0.00 0.00 0.00 19.45 19.98 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 0.29 0.52 -0.03 0.00 -0.00 -0.24 0.49 116.94 117.96 1x50 h PHE 139 Ca 0.12 0.02 0.01 0.00 -0.00 0.00 0.00 57.97 58.11 1x50 h PHE 139 Cb 1.30 -0.15 -0.00 0.00 -0.00 0.00 0.00 35.95 37.09 1x50 h PHE 139 CO 0.31 0.09 0.02 -0.56 -0.00 0.00 0.00 178.31 178.17 1x50 h GLN 140 N 0.35 0.00 -0.65 6.09 -0.00 -1.77 -1.72 115.11 117.40 1x50 h GLN 140 Ca 0.53 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 59.10 1x50 h GLN 140 Cb 1.43 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 28.89 1x50 h GLN 140 CO -0.20 0.00 0.09 0.00 -0.00 0.00 0.00 178.83 178.71 1x50 h ARG 141 N 0.00 1.08 -5.59 0.06 3.08 -0.32 -3.18 114.38 109.51 1x50 h ARG 141 Ca 0.01 -0.30 -0.56 0.00 0.07 0.00 0.00 59.98 59.21 1x50 h ARG 141 Cb 0.05 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 1x50 h ARG 141 CO -0.00 1.00 1.59 0.28 -1.07 0.00 0.00 179.97 181.77 1x50 n VAL 142 N -4.21 0.04 -1.91 2.04 0.31 -0.65 -4.37 118.33 109.59 1x50 n VAL 142 Ca 0.04 -0.36 0.01 0.00 -0.01 0.00 0.00 64.34 64.02 1x50 n VAL 142 Cb 0.30 -1.68 0.14 0.00 -0.91 0.00 0.00 33.84 31.69 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 11.99 1.99 -3.81 4.52 5.75 -1.19 -1.49 116.55 134.30 1x50 n ASP 143 Ca 0.47 -3.39 -0.13 0.00 -0.01 0.00 0.00 54.79 51.73 1x50 n ASP 143 Cb 0.27 -0.45 -0.15 0.00 -1.03 0.00 0.00 41.12 39.76 1x50 n ASP 143 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1x50 s THR 144 N -2.76 -0.03 -0.15 2.12 2.01 -0.13 0.96 115.64 117.66 1x50 s THR 144 Ca 0.38 0.11 -0.01 0.00 0.31 0.00 0.00 61.69 62.48 1x50 s THR 144 Cb 0.38 -0.08 0.04 0.00 0.01 0.00 0.00 72.50 72.85 1x50 s THR 144 CO -0.07 0.04 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.63 1x50 s LEU 145 N 0.55 1.46 0.14 4.42 2.96 0.35 -1.72 118.68 126.85 1x50 s LEU 145 Ca -0.04 -0.59 0.11 0.00 -0.22 0.00 0.00 54.13 53.39 1x50 s LEU 145 Cb -0.06 -0.85 -0.04 0.00 0.50 0.00 0.00 46.19 45.73 1x50 s LEU 145 CO -0.02 -0.18 -0.26 -1.83 -1.32 0.00 0.00 176.35 172.74 1x50 s GLU 146 N 1.68 1.43 -0.14 1.98 -1.05 -0.76 0.37 118.70 122.21 1x50 s GLU 146 Ca 0.01 -1.39 -0.04 0.00 -0.15 0.00 0.00 54.97 53.41 1x50 s GLU 146 Cb -0.15 -1.89 0.05 0.00 -0.44 0.00 0.00 34.13 31.71 1x50 s GLU 146 CO -0.08 0.44 0.07 0.42 0.95 0.00 0.00 175.26 177.07 1x50 s ILE 147 N -1.20 -0.02 0.45 1.83 1.01 -0.10 -2.03 121.20 121.13 1x50 s ILE 147 Ca 0.16 -0.04 0.03 0.00 0.00 0.00 0.00 60.65 60.80 1x50 s ILE 147 Cb -0.10 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 1x50 s ILE 147 CO 0.07 -0.14 0.03 0.00 0.00 0.00 0.00 174.94 174.90 1x50 s GLN 148 N 2.12 2.04 0.00 2.79 0.00 -0.75 -0.90 119.66 124.96 1x50 s GLN 148 Ca 0.03 -2.25 0.00 0.00 -0.00 0.00 0.00 55.36 53.14 1x50 s GLN 148 Cb -0.15 -1.33 0.00 0.00 0.00 0.00 0.00 33.01 31.53 1x50 s GLN 148 CO -0.07 -0.29 0.00 0.41 0.00 0.00 0.00 175.29 175.33 1x50 n GLY 149 N -1.08 0.34 3.12 2.60 0.00 -1.26 -0.76 105.19 108.15 1x50 n GLY 149 Ca -0.12 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.72 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 5.34 -0.14 1.61 1.11 -0.61 -4.90 116.67 115.07 1x50 s ASP 150 Ca 0.00 -2.67 -0.14 0.00 0.18 0.00 0.00 52.55 49.92 1x50 s ASP 150 Cb 0.00 -1.88 0.04 0.00 1.07 0.00 0.00 42.92 42.15 1x50 s ASP 150 CO 0.00 -0.42 0.40 0.54 1.18 0.00 0.00 175.17 176.87 1x50 s VAL 151 N 0.21 0.00 -0.70 -1.27 0.11 -1.26 -3.78 120.40 113.71 1x50 s VAL 151 Ca 0.15 -0.02 -0.14 0.00 -2.93 0.00 0.00 61.98 59.03 1x50 s VAL 151 Cb -0.20 -0.57 0.18 0.00 -1.53 0.00 0.00 36.38 34.26 1x50 s VAL 151 CO -0.04 -0.01 0.65 -0.89 -3.33 0.00 0.00 175.10 171.48 1x50 s THR 152 N 0.12 5.37 0.09 5.04 2.01 -0.50 -4.91 115.64 122.85 1x50 s THR 152 Ca -0.01 -2.10 -0.30 0.00 0.31 0.00 0.00 61.69 59.60 1x50 s THR 152 Cb -0.03 -4.37 -0.05 0.00 0.01 0.00 0.00 72.50 68.06 1x50 s THR 152 CO 0.01 -0.96 1.02 -0.76 -0.69 0.00 0.00 174.62 173.24 1x50 s LEU 153 N 0.74 4.45 -0.02 4.42 1.43 -1.26 0.11 118.68 128.55 1x50 s LEU 153 Ca 0.12 1.83 0.01 0.00 -1.03 0.00 0.00 54.13 55.06 1x50 s LEU 153 Cb -0.18 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.43 1x50 s LEU 153 CO -0.04 -0.19 -0.01 -1.20 0.23 0.00 0.00 176.35 175.14 1x50 n SER 154 N 3.16 4.25 -3.71 2.29 7.64 0.39 -3.63 113.62 124.01 1x50 n SER 154 Ca 0.04 -0.01 -0.11 0.00 1.01 0.00 0.00 58.87 59.81 1x50 n SER 154 Cb 0.49 0.29 -0.11 0.00 -1.01 0.00 0.00 64.21 63.86 1x50 n SER 154 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1x50 s TYR 155 N -2.04 -0.51 -0.22 1.43 6.14 -0.34 -0.05 117.35 121.75 1x50 s TYR 155 Ca -0.02 1.13 -0.04 0.00 0.64 0.00 0.00 57.07 58.78 1x50 s TYR 155 Cb 0.01 0.20 0.08 0.00 0.42 0.00 0.00 41.96 42.66 1x50 s TYR 155 CO 0.06 -0.31 0.12 0.08 0.64 0.00 0.00 175.55 176.15 1x50 s VAL 156 N 1.32 -0.12 -0.08 3.14 1.01 -1.19 -0.97 120.40 123.50 1x50 s VAL 156 Ca -0.09 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1x50 s VAL 156 Cb -0.09 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 1x50 s VAL 156 CO -0.11 -0.44 -0.15 -1.58 0.00 0.00 0.00 175.10 172.83 1x50 s GLN 157 N 2.15 2.84 -0.81 2.72 0.74 -1.23 -2.84 119.66 123.24 1x50 s GLN 157 Ca 0.05 -0.71 -0.10 0.00 0.05 0.00 0.00 55.36 54.66 1x50 s GLN 157 Cb -0.16 -2.46 0.21 0.00 1.10 0.00 0.00 33.01 31.70 1x50 s GLN 157 CO -0.20 0.45 0.72 0.42 -0.55 0.00 0.00 175.29 176.13 1x50 s ILE 158 N -0.28 5.06 0.30 -2.34 1.01 -1.26 -2.90 121.20 120.78 1x50 s ILE 158 Ca 0.02 -2.80 -0.30 0.00 0.00 0.00 0.00 60.65 57.57 1x50 s ILE 158 Cb -0.13 -4.15 -0.11 0.00 0.01 0.00 0.00 42.46 38.09 1x50 s ILE 158 CO 0.03 -1.01 1.51 -0.44 0.00 0.00 0.00 174.94 175.03 1x50 s SER 159 N 1.50 6.47 0.32 3.58 0.01 -0.63 -4.94 113.70 120.02 1x50 s SER 159 Ca 0.20 2.87 -0.18 0.00 1.31 0.00 0.00 55.95 60.15 1x50 s SER 159 Cb -0.13 -2.64 0.06 0.00 0.21 0.00 0.00 66.02 63.53 1x50 s SER 159 CO -0.08 -0.82 0.86 -0.83 0.41 0.00 0.00 173.24 172.78 1x50 s GLY 160 N 0.29 0.26 0.02 3.44 0.00 -1.26 -2.12 107.32 107.95 1x50 s GLY 160 Ca 0.59 -0.59 -0.30 0.00 0.00 0.00 0.00 44.72 44.42 1x50 s GLY 160 CO 0.49 0.45 1.43 2.56 0.00 0.00 0.00 173.10 178.03 1x50 s PRO 161 N -2.39 4.28 -0.57 2.90 0.04 -1.25 -4.98 135.00 133.03 1x50 s PRO 161 Ca 0.17 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 63.02 1x50 s PRO 161 Cb -0.04 -3.54 0.07 0.00 0.04 0.00 0.00 34.50 31.03 1x50 s PRO 161 CO 0.09 -0.58 0.81 -1.12 0.04 0.00 0.00 177.00 176.24 1x50 s SER 162 N 1.85 6.23 -1.65 6.66 0.01 -1.26 -4.34 113.70 121.21 1x50 s SER 162 Ca 0.65 -0.89 -0.14 0.00 1.31 0.00 0.00 55.95 56.88 1x50 s SER 162 Cb -0.33 -2.36 0.12 0.00 0.21 0.00 0.00 66.02 63.66 1x50 s SER 162 CO 0.28 -1.16 0.68 -0.24 0.41 0.00 0.00 173.24 173.21 1x50 n SER 163 N 6.92 -2.52 0.00 2.44 2.88 -1.26 -5.34 113.62 116.74 1x50 n SER 163 Ca -0.04 -1.03 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 1x50 n SER 163 Cb 0.45 -2.74 0.00 0.00 -0.75 0.00 0.00 64.21 61.18 1x50 n SER 163 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42