#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 -0.71 0.19 1.61 0.01 -1.26 -5.18 113.70 108.37 1x50 s SER 2 Ca 0.00 1.33 0.05 0.00 1.31 0.00 0.00 55.95 58.64 1x50 s SER 2 Cb 0.00 1.32 -0.05 0.00 0.21 0.00 0.00 66.02 67.50 1x50 s SER 2 CO 0.00 -0.23 -0.08 -0.44 0.41 0.00 0.00 173.24 172.90 1x50 s SER 3 N 0.56 2.04 0.00 2.44 0.01 -1.26 -5.10 113.70 112.40 1x50 s SER 3 Ca -0.02 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.16 1x50 s SER 3 Cb -0.05 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.14 1x50 s SER 3 CO -0.03 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 173.89 1x50 n GLY 4 N -0.33 0.02 3.63 3.44 0.00 -1.26 -5.12 105.19 105.58 1x50 n GLY 4 Ca -0.08 -1.41 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 1x50 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x50 s SER 5 N -0.83 -0.78 0.02 1.61 0.01 -1.26 -5.07 113.70 107.40 1x50 s SER 5 Ca 0.00 1.44 -0.25 0.00 1.31 0.00 0.00 55.95 58.44 1x50 s SER 5 Cb 0.00 1.42 -0.17 0.00 0.21 0.00 0.00 66.02 67.48 1x50 s SER 5 CO 0.00 -0.24 1.35 -1.28 0.41 0.00 0.00 173.24 173.47 1x50 h SER 6 N 5.45 -0.20 -5.79 2.44 0.87 -2.08 -3.49 113.55 110.75 1x50 h SER 6 Ca -0.29 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1x50 h SER 6 Cb 1.18 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.16 1x50 h SER 6 CO 0.08 0.13 -0.80 0.61 -0.53 0.00 0.00 176.83 176.31 1x50 n GLY 7 N -0.34 -1.92 2.73 5.77 0.00 -1.26 -4.99 105.19 105.17 1x50 n GLY 7 Ca -0.09 0.49 -0.30 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.70 1.58 0.30 1.61 -0.00 -1.26 -5.00 115.29 111.82 1x50 s HIS 8 Ca -0.07 -1.61 0.06 0.00 -0.00 0.00 0.00 55.06 53.44 1x50 s HIS 8 Cb 0.00 -1.60 0.77 0.00 -0.00 0.00 0.00 32.58 31.75 1x50 s HIS 8 CO 0.31 -0.85 1.73 0.37 -0.00 0.00 0.00 174.74 176.31 1x50 h GLN 9 N 8.12 0.56 -2.62 -0.38 -0.00 -2.06 -3.39 115.11 115.33 1x50 h GLN 9 Ca -0.14 -0.03 -0.13 0.00 -0.00 0.00 0.00 58.65 58.35 1x50 h GLN 9 Cb 1.02 -0.13 -0.28 0.00 0.00 0.00 0.00 27.48 28.09 1x50 h GLN 9 CO 0.46 0.37 -0.39 -0.65 0.00 0.00 0.00 178.83 178.62 1x50 s GLN 10 N -5.85 0.30 -0.06 1.69 -0.21 -1.26 -5.12 119.66 109.14 1x50 s GLN 10 Ca -0.11 0.92 -0.37 0.00 0.02 0.00 0.00 55.36 55.82 1x50 s GLN 10 Cb 0.25 0.18 -0.15 0.00 1.00 0.00 0.00 33.01 34.30 1x50 s GLN 10 CO 0.79 -0.24 1.63 1.28 -2.12 0.00 0.00 175.29 176.63 1x50 n LEU 11 N 5.13 2.50 -4.15 2.90 4.32 -1.26 -4.95 117.00 121.49 1x50 n LEU 11 Ca -0.11 1.07 -0.15 0.00 -0.02 0.00 0.00 56.01 56.80 1x50 n LEU 11 Cb 0.51 -1.25 -0.06 0.00 -1.62 0.00 0.00 43.42 41.00 1x50 n LEU 11 CO 0.02 -0.51 0.01 0.20 -1.22 0.00 0.00 177.39 175.89 1x50 s ASN 12 N 2.35 0.86 -0.01 -1.43 0.02 -1.26 -5.17 114.94 110.31 1x50 s ASN 12 Ca 0.90 -1.48 0.01 0.00 -1.02 0.00 0.00 52.86 51.28 1x50 s ASN 12 Cb -0.90 0.57 -0.03 0.00 0.02 0.00 0.00 41.25 40.91 1x50 s ASN 12 CO 0.53 -1.13 -0.02 -0.94 0.02 0.00 0.00 177.10 175.56 1x50 s SER 13 N -3.23 4.98 0.78 -1.22 1.04 -1.26 -5.10 113.70 109.68 1x50 s SER 13 Ca 0.34 -0.02 -0.14 0.00 0.48 0.00 0.00 55.95 56.60 1x50 s SER 13 Cb 0.02 -1.28 0.06 0.00 0.10 0.00 0.00 66.02 64.92 1x50 s SER 13 CO 0.19 0.30 1.21 0.00 0.98 0.00 0.00 173.24 175.92 1x50 n LEU 14 N 1.58 4.69 0.00 2.42 -0.00 -1.26 -5.01 117.00 119.42 1x50 n LEU 14 Ca -0.15 0.64 -0.20 0.00 -0.00 0.00 0.00 56.01 56.29 1x50 n LEU 14 Cb 0.53 -1.51 0.17 0.00 -0.00 0.00 0.00 43.42 42.60 1x50 n LEU 14 CO 0.32 -1.58 0.41 -0.81 -0.00 0.00 0.00 177.39 175.73 1x50 n PRO 15 N -2.96 -2.46 -0.91 1.47 -0.04 -1.26 -5.00 135.00 123.84 1x50 n PRO 15 Ca 0.14 -1.17 -0.31 0.00 -0.04 0.00 0.00 63.50 62.12 1x50 n PRO 15 Cb 0.50 -1.10 0.14 0.00 -0.04 0.00 0.00 33.50 33.00 1x50 n PRO 15 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1x50 s THR 16 N -2.32 2.52 -0.69 0.52 -1.32 -1.26 -4.93 115.64 108.17 1x50 s THR 16 Ca 0.48 0.17 -0.02 0.00 -1.21 0.00 0.00 61.69 61.11 1x50 s THR 16 Cb -0.05 -2.37 0.38 0.00 -1.51 0.00 0.00 72.50 68.96 1x50 s THR 16 CO 0.36 -0.22 2.07 0.23 -2.21 0.00 0.00 174.62 174.85 1x50 n MET 17 N -3.96 2.63 -1.75 7.08 2.81 -1.26 -4.98 117.12 117.68 1x50 n MET 17 Ca 0.11 -3.18 -0.27 0.00 -1.81 0.00 0.00 57.70 52.54 1x50 n MET 17 Cb 0.52 -2.23 0.19 0.00 -0.71 0.00 0.00 33.22 31.00 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 -0.62 -1.22 0.00 0.03 -0.58 -1.26 -4.94 120.64 112.05 1x50 n GLU 18 Ca 0.57 -1.90 0.00 0.00 -0.42 0.00 0.00 57.16 55.41 1x50 n GLU 18 Cb 0.52 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 30.12 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 -3.05 -1.19 3.68 0.62 0.00 -1.26 -4.94 105.19 99.04 1x50 n GLY 19 Ca 0.15 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 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 0.40 0.79 1.61 0.04 -1.26 -5.03 135.00 131.55 1x50 s PRO 20 Ca 0.00 0.51 -0.11 0.00 0.04 0.00 0.00 61.00 61.45 1x50 s PRO 20 Cb 0.00 -1.73 0.07 0.00 0.04 0.00 0.00 34.50 32.87 1x50 s PRO 20 CO 0.00 -2.75 1.09 -1.25 0.04 0.00 0.00 177.00 174.13 1x50 s PRO 21 N -4.96 2.12 0.41 0.56 0.04 -1.26 -5.02 135.00 126.89 1x50 s PRO 21 Ca 0.65 1.12 -0.22 0.00 0.04 0.00 0.00 61.00 62.59 1x50 s PRO 21 Cb -0.19 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 1x50 s PRO 21 CO 0.58 -1.73 0.97 -0.08 0.04 0.00 0.00 177.00 176.78 1x50 s THR 22 N -2.91 4.19 -0.11 1.26 -1.32 -1.11 -4.99 115.64 110.66 1x50 s THR 22 Ca 0.61 1.50 -0.00 0.00 -1.21 0.00 0.00 61.69 62.59 1x50 s THR 22 Cb -0.17 -3.68 0.02 0.00 -1.51 0.00 0.00 72.50 67.16 1x50 s THR 22 CO 0.56 -0.17 -0.08 -0.36 -2.21 0.00 0.00 174.62 172.37 1x50 s PHE 23 N -1.97 1.46 -1.06 9.09 0.40 -1.26 -3.58 117.98 121.06 1x50 s PHE 23 Ca 0.60 -0.71 -0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1x50 s PHE 23 Cb -0.14 -1.21 -0.01 0.00 0.51 0.00 0.00 43.02 42.17 1x50 s PHE 23 CO 0.18 -0.49 0.90 0.09 0.70 0.00 0.00 175.22 176.59 1x50 n ASN 24 N 4.86 -2.96 -4.76 1.36 4.13 -0.74 -4.96 115.26 112.20 1x50 n ASN 24 Ca -0.13 -0.58 -0.41 0.00 1.68 0.00 0.00 54.58 55.14 1x50 n ASN 24 Cb 0.50 -4.74 -0.03 0.00 -1.54 0.00 0.00 39.78 33.97 1x50 n ASN 24 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1x50 s PRO 25 N -5.03 4.45 1.22 3.52 0.04 -1.26 -5.02 135.00 132.93 1x50 s PRO 25 Ca 0.09 2.05 -0.20 0.00 0.04 0.00 0.00 61.00 62.98 1x50 s PRO 25 Cb -0.01 -3.14 0.30 0.00 0.04 0.00 0.00 34.50 31.69 1x50 s PRO 25 CO 0.67 -0.08 1.11 -1.25 0.04 0.00 0.00 177.00 177.49 1x50 s PRO 26 N -1.29 -1.41 -0.01 0.56 0.04 -1.26 -4.48 135.00 127.15 1x50 s PRO 26 Ca 0.49 -0.13 0.01 0.00 0.04 0.00 0.00 61.00 61.41 1x50 s PRO 26 Cb -0.37 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1x50 s PRO 26 CO 0.46 -3.82 -0.02 0.08 0.04 0.00 0.00 177.00 173.74 1x50 s VAL 27 N -3.01 0.19 0.40 -0.36 1.01 -1.26 -2.86 120.40 114.50 1x50 s VAL 27 Ca 0.72 -0.07 -0.26 0.00 0.00 0.00 0.00 61.98 62.37 1x50 s VAL 27 Cb -0.09 -0.18 -0.09 0.00 0.00 0.00 0.00 36.38 36.02 1x50 s VAL 27 CO 0.56 0.07 1.19 -2.16 0.00 0.00 0.00 175.10 174.76 1x50 s PRO 28 N 0.13 4.06 -0.32 2.72 0.04 -1.26 -5.04 135.00 135.33 1x50 s PRO 28 Ca -0.01 1.90 -0.16 0.00 0.04 0.00 0.00 61.00 62.77 1x50 s PRO 28 Cb -0.03 -2.71 -0.02 0.00 0.04 0.00 0.00 34.50 31.78 1x50 s PRO 28 CO -0.00 -0.33 0.40 -0.47 0.04 0.00 0.00 177.00 176.64 1x50 s TYR 29 N -1.37 3.21 -0.47 0.56 6.14 -0.09 -4.90 117.35 120.43 1x50 s TYR 29 Ca 0.56 0.16 -0.15 0.00 0.64 0.00 0.00 57.07 58.28 1x50 s TYR 29 Cb -0.32 -2.70 0.07 0.00 0.42 0.00 0.00 41.96 39.43 1x50 s TYR 29 CO 0.41 -0.39 0.39 -0.06 0.64 0.00 0.00 175.55 176.53 1x50 s PHE 30 N 2.13 3.25 -0.33 4.97 0.08 -1.26 -1.17 117.98 125.64 1x50 s PHE 30 Ca 0.14 -0.93 0.02 0.00 0.12 0.00 0.00 56.93 56.28 1x50 s PHE 30 Cb -0.16 -3.15 0.09 0.00 -0.57 0.00 0.00 43.02 39.23 1x50 s PHE 30 CO 0.11 -0.79 0.04 0.20 -0.10 0.00 0.00 175.22 174.68 1x50 s GLY 31 N 2.57 1.87 0.19 4.36 0.00 0.46 -5.00 107.32 111.78 1x50 s GLY 31 Ca 0.04 -2.28 -0.30 0.00 0.00 0.00 0.00 44.72 42.18 1x50 s GLY 31 CO 0.07 0.86 1.20 1.09 0.00 0.00 0.00 173.10 176.31 1x50 s ARG 32 N 1.03 4.49 -0.26 2.90 1.04 -1.26 -0.93 118.95 125.96 1x50 s ARG 32 Ca 0.04 1.89 -0.27 0.00 -1.04 0.00 0.00 55.73 56.36 1x50 s ARG 32 Cb -0.20 -3.23 0.00 0.00 -2.04 0.00 0.00 34.95 29.48 1x50 s ARG 32 CO -0.06 -0.09 0.93 -0.51 -0.04 0.00 0.00 175.30 175.54 1x50 s LEU 33 N -0.34 4.07 -0.81 -1.89 1.43 0.39 -4.80 118.68 116.73 1x50 s LEU 33 Ca 0.53 1.11 -0.25 0.00 -1.03 0.00 0.00 54.13 54.48 1x50 s LEU 33 Cb -0.33 -3.35 -0.00 0.00 0.03 0.00 0.00 46.19 42.54 1x50 s LEU 33 CO 0.37 -0.63 1.68 -1.10 0.23 0.00 0.00 176.35 176.90 1x50 s GLN 34 N 3.10 2.93 0.00 1.70 -0.21 -1.26 -3.59 119.66 122.32 1x50 s GLN 34 Ca 0.39 -0.20 0.00 0.00 0.02 0.00 0.00 55.36 55.57 1x50 s GLN 34 Cb -0.15 -4.75 0.00 0.00 1.00 0.00 0.00 33.01 29.12 1x50 s GLN 34 CO 0.09 -2.69 0.00 0.41 -2.12 0.00 0.00 175.29 170.98 1x50 n GLY 35 N 6.22 3.21 0.00 3.09 0.00 -1.26 -5.07 105.19 111.39 1x50 n GLY 35 Ca 0.25 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 1.51 3.56 -0.02 0.00 -1.24 -4.89 105.19 104.11 1x50 n GLY 36 Ca 0.00 -2.26 -0.38 0.00 0.00 0.00 0.00 46.02 43.39 1x50 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x50 s LEU 37 N 0.00 3.39 -0.04 0.99 1.43 -0.18 -4.92 118.68 119.36 1x50 s LEU 37 Ca 0.00 1.00 0.07 0.00 -1.03 0.00 0.00 54.13 54.17 1x50 s LEU 37 Cb 0.00 -2.65 -0.01 0.00 0.03 0.00 0.00 46.19 43.56 1x50 s LEU 37 CO 0.00 -2.64 -0.25 0.42 0.23 0.00 0.00 176.35 174.11 1x50 s THR 38 N 10.96 1.97 0.63 5.49 -4.23 -1.26 -4.03 115.64 125.16 1x50 s THR 38 Ca 0.90 -1.05 0.19 0.00 -1.18 0.00 0.00 61.69 60.56 1x50 s THR 38 Cb -0.18 -1.65 0.27 0.00 1.34 0.00 0.00 72.50 72.28 1x50 s THR 38 CO 0.26 0.55 1.30 0.00 -0.54 0.00 0.00 174.62 176.20 1x50 h ALA 39 N 5.77 2.51 -0.84 3.99 0.00 -1.76 1.92 119.26 130.85 1x50 h ALA 39 Ca -0.38 -0.02 -0.50 0.00 0.00 0.00 0.00 54.91 54.01 1x50 h ALA 39 Cb 1.15 0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.71 1x50 h ALA 39 CO 0.47 -1.35 0.43 0.54 0.00 0.00 0.00 179.25 179.34 1x50 n ARG 40 N -3.04 2.43 -5.23 0.00 5.12 -1.26 -4.59 116.66 110.09 1x50 n ARG 40 Ca 0.13 -3.25 -0.30 0.00 -1.93 0.00 0.00 57.85 52.50 1x50 n ARG 40 Cb 1.23 -2.15 -0.16 0.00 -1.16 0.00 0.00 32.46 30.22 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 -3.49 2.01 -0.09 5.56 3.52 0.65 -3.97 118.95 123.15 1x50 s ARG 41 Ca 0.56 -0.88 -0.02 0.00 -0.13 0.00 0.00 55.73 55.26 1x50 s ARG 41 Cb 0.47 -1.94 0.04 0.00 -1.56 0.00 0.00 34.95 31.96 1x50 s ARG 41 CO 0.04 0.53 0.04 0.99 -0.81 0.00 0.00 175.30 176.08 1x50 s THR 42 N -0.56 0.15 -0.05 4.11 2.01 -0.81 -1.35 115.64 119.14 1x50 s THR 42 Ca 0.09 0.12 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 1x50 s THR 42 Cb -0.10 -0.45 -0.05 0.00 0.01 0.00 0.00 72.50 71.91 1x50 s THR 42 CO -0.01 0.11 0.52 -0.63 -0.69 0.00 0.00 174.62 173.92 1x50 s ILE 43 N 2.06 5.03 -0.04 1.82 1.09 0.16 -1.56 121.20 129.75 1x50 s ILE 43 Ca 0.04 1.07 0.04 0.00 -1.10 0.00 0.00 60.65 60.70 1x50 s ILE 43 Cb -0.13 -3.85 0.00 0.00 -1.06 0.00 0.00 42.46 37.42 1x50 s ILE 43 CO -0.05 0.41 -0.15 -0.63 -0.10 0.00 0.00 174.94 174.42 1x50 s ILE 44 N -0.04 1.27 -0.22 2.92 1.01 -1.19 0.78 121.20 125.72 1x50 s ILE 44 Ca 0.28 -0.61 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 1x50 s ILE 44 Cb -0.17 -1.11 0.07 0.00 0.01 0.00 0.00 42.46 41.27 1x50 s ILE 44 CO 0.14 0.37 0.06 -0.63 0.00 0.00 0.00 174.94 174.88 1x50 s ILE 45 N 0.19 0.42 -0.36 2.92 1.01 0.91 -3.40 121.20 122.89 1x50 s ILE 45 Ca -0.06 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 1x50 s ILE 45 Cb -0.12 -1.05 0.05 0.00 0.01 0.00 0.00 42.46 41.36 1x50 s ILE 45 CO 0.02 -0.34 0.14 -0.54 0.00 0.00 0.00 174.94 174.23 1x50 s LYS 46 N 1.89 2.57 0.00 2.79 1.02 0.02 -1.70 119.74 126.33 1x50 s LYS 46 Ca 0.02 -1.29 0.00 0.00 0.02 0.00 0.00 55.97 54.72 1x50 s LYS 46 Cb -0.17 -3.53 0.00 0.00 -0.52 0.00 0.00 37.83 33.61 1x50 s LYS 46 CO -0.13 -0.75 0.00 0.41 -0.92 0.00 0.00 175.35 173.95 1x50 n GLY 47 N 4.81 5.51 3.63 -3.33 0.00 -1.21 -0.04 105.19 114.55 1x50 n GLY 47 Ca -0.11 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 44.86 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 1.38 -0.68 -0.31 1.61 6.14 0.23 -3.18 117.35 122.53 1x50 s TYR 48 Ca 0.00 1.34 -0.29 0.00 0.64 0.00 0.00 57.07 58.76 1x50 s TYR 48 Cb 0.00 0.41 0.01 0.00 0.42 0.00 0.00 41.96 42.79 1x50 s TYR 48 CO 0.00 -0.34 1.22 0.08 0.64 0.00 0.00 175.55 177.15 1x50 s VAL 49 N 1.50 4.27 0.67 3.14 1.01 -1.21 -0.96 120.40 128.82 1x50 s VAL 49 Ca -0.09 1.44 -0.14 0.00 0.00 0.00 0.00 61.98 63.19 1x50 s VAL 49 Cb -0.04 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 32.09 1x50 s VAL 49 CO -0.16 -0.48 1.11 -2.16 0.00 0.00 0.00 175.10 173.40 1x50 s PRO 50 N 3.98 2.74 0.32 2.72 0.04 -1.26 -0.87 135.00 142.67 1x50 s PRO 50 Ca 0.52 1.37 0.26 0.00 0.04 0.00 0.00 61.00 63.19 1x50 s PRO 50 Cb -0.15 -1.94 1.07 0.00 0.04 0.00 0.00 34.50 33.51 1x50 s PRO 50 CO 0.21 -1.29 1.77 -1.00 0.04 0.00 0.00 177.00 176.72 1x50 h PRO 51 N -0.09 0.00 -0.35 0.56 0.13 -1.94 -2.49 132.00 127.81 1x50 h PRO 51 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1x50 h PRO 51 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1x50 h PRO 51 CO 0.54 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.56 1x50 n THR 52 N -2.40 1.57 -4.08 1.56 -2.24 -1.26 -4.95 114.28 102.48 1x50 n THR 52 Ca 0.02 -1.35 -0.35 0.00 -2.27 0.00 0.00 64.05 60.10 1x50 n THR 52 Cb 0.24 0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.51 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 -1.33 1.63 0.03 3.38 0.00 -0.94 -5.02 107.32 105.07 1x50 s GLY 53 Ca 0.33 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.68 1x50 s GLY 53 CO 0.14 0.28 1.25 0.50 0.00 0.00 0.00 173.10 175.28 1x50 h LYS 54 N 7.72 -1.04 -1.54 2.90 1.57 -1.86 -3.44 116.57 120.88 1x50 h LYS 54 Ca -0.38 0.07 0.23 0.00 -1.87 0.00 0.00 60.65 58.70 1x50 h LYS 54 Cb 1.17 0.24 -0.19 0.00 0.08 0.00 0.00 32.23 33.53 1x50 h LYS 54 CO 0.60 -0.69 0.77 -1.54 -0.57 0.00 0.00 179.45 178.02 1x50 s SER 55 N -4.25 -0.17 0.21 0.86 1.04 -1.26 -4.27 113.70 105.86 1x50 s SER 55 Ca -0.16 0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.31 1x50 s SER 55 Cb 0.02 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.32 1x50 s SER 55 CO 0.47 -0.27 0.11 2.22 0.98 0.00 0.00 173.24 176.76 1x50 n PHE 56 N -0.02 -0.73 -3.68 5.02 -1.74 -1.25 -1.75 117.46 113.32 1x50 n PHE 56 Ca -0.01 -0.91 -0.11 0.00 -0.56 0.00 0.00 57.45 55.85 1x50 n PHE 56 Cb 0.59 -0.16 -0.09 0.00 1.52 0.00 0.00 39.48 41.34 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 -2.31 -1.41 -0.35 1.98 0.00 0.11 -3.74 121.76 116.04 1x50 s ALA 57 Ca 0.09 1.75 -0.00 0.00 0.00 0.00 0.00 51.96 53.79 1x50 s ALA 57 Cb -0.01 -1.03 0.09 0.00 0.00 0.00 0.00 23.12 22.17 1x50 s ALA 57 CO 0.06 -0.29 0.08 0.42 0.00 0.00 0.00 175.76 176.03 1x50 s ILE 58 N 0.84 2.86 -0.04 0.00 1.09 0.91 -1.91 121.20 124.94 1x50 s ILE 58 Ca -0.04 -1.90 -0.02 0.00 -1.10 0.00 0.00 60.65 57.59 1x50 s ILE 58 Cb -0.05 -2.88 -0.04 0.00 -1.06 0.00 0.00 42.46 38.43 1x50 s ILE 58 CO -0.07 -0.45 0.07 0.20 -0.10 0.00 0.00 174.94 174.59 1x50 s ASN 59 N 1.37 5.66 -0.37 3.58 0.01 -0.86 -1.78 114.94 122.55 1x50 s ASN 59 Ca 0.04 0.19 -0.00 0.00 -0.71 0.00 0.00 52.86 52.38 1x50 s ASN 59 Cb -0.21 -1.65 0.10 0.00 0.41 0.00 0.00 41.25 39.90 1x50 s ASN 59 CO -0.04 0.32 0.12 -0.36 -1.51 0.00 0.00 177.10 175.63 1x50 s PHE 60 N -1.09 3.60 0.49 2.20 0.40 0.21 -1.46 117.98 122.35 1x50 s PHE 60 Ca 0.19 -2.54 0.03 0.00 -0.60 0.00 0.00 56.93 54.01 1x50 s PHE 60 Cb -0.12 -2.98 0.02 0.00 0.51 0.00 0.00 43.02 40.46 1x50 s PHE 60 CO 0.09 -0.95 0.69 0.21 0.70 0.00 0.00 175.22 175.97 1x50 s LYS 61 N 1.08 2.70 -0.25 0.44 2.20 -0.30 -1.52 119.74 124.10 1x50 s LYS 61 Ca 0.07 -0.88 -0.10 0.00 -0.36 0.00 0.00 55.97 54.70 1x50 s LYS 61 Cb -0.21 -2.58 -0.05 0.00 -1.51 0.00 0.00 37.83 33.48 1x50 s LYS 61 CO -0.05 -0.51 0.16 0.08 -0.36 0.00 0.00 175.35 174.67 1x50 s VAL 62 N -2.60 5.31 0.40 4.02 1.01 -0.66 -0.66 120.40 127.20 1x50 s VAL 62 Ca 0.55 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.76 1x50 s VAL 62 Cb -0.10 -3.49 0.25 0.00 0.00 0.00 0.00 36.38 33.04 1x50 s VAL 62 CO 0.37 0.32 2.03 1.23 0.00 0.00 0.00 175.10 179.05 1x50 h GLY 63 N 7.73 0.59 0.00 4.51 0.00 -1.78 -0.77 103.07 113.35 1x50 h GLY 63 Ca -0.37 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1x50 h GLY 63 CO 0.63 0.23 0.00 -1.26 0.00 0.00 0.00 176.54 176.14 1x50 n SER 64 N -4.44 0.00 0.00 0.19 2.88 -1.26 -4.70 113.62 106.28 1x50 n SER 64 Ca 0.03 0.71 0.00 0.00 -1.33 0.00 0.00 58.87 58.28 1x50 n SER 64 Cb 0.08 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 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 -1.77 0.00 0.00 -3.46 2.88 -1.23 -5.05 113.62 104.99 1x50 n SER 65 Ca 0.00 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 1x50 n SER 65 Cb 0.00 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 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 1.99 0.42 3.59 0.46 0.00 -0.30 -4.95 105.19 106.40 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 -0.77 4.62 -0.27 1.61 1.01 -1.26 -4.66 116.67 116.95 1x50 s ASP 67 Ca 0.00 -0.12 -0.21 0.00 0.71 0.00 0.00 52.55 52.93 1x50 s ASP 67 Cb 0.00 -1.09 -0.01 0.00 1.01 0.00 0.00 42.92 42.82 1x50 s ASP 67 CO 0.00 0.30 0.67 -0.63 0.21 0.00 0.00 175.17 175.72 1x50 s ILE 68 N -0.95 4.94 -0.09 0.77 1.01 0.10 -1.66 121.20 125.33 1x50 s ILE 68 Ca 0.16 1.14 0.07 0.00 0.00 0.00 0.00 60.65 62.02 1x50 s ILE 68 Cb -0.11 -3.99 -0.24 0.00 0.01 0.00 0.00 42.46 38.13 1x50 s ILE 68 CO 0.06 -0.05 0.49 0.00 0.00 0.00 0.00 174.94 175.44 1x50 n ALA 69 N 5.83 1.33 -3.73 9.38 0.00 -0.57 -1.60 120.51 131.14 1x50 n ALA 69 Ca 0.01 -0.79 -0.16 0.00 0.00 0.00 0.00 53.44 52.50 1x50 n ALA 69 Cb 0.49 -0.71 -0.16 0.00 0.00 0.00 0.00 19.45 19.07 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 1.15 -0.37 0.00 2.96 -1.25 -4.50 118.68 110.36 1x50 s LEU 70 Ca -0.11 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.79 1x50 s LEU 70 Cb 0.07 -0.17 0.13 0.00 0.50 0.00 0.00 46.19 46.72 1x50 s LEU 70 CO 0.80 -0.11 0.19 -2.28 -1.32 0.00 0.00 176.35 173.64 1x50 s HIS 71 N 1.02 1.31 -0.11 5.38 5.65 0.64 -0.62 115.29 128.56 1x50 s HIS 71 Ca -0.10 -1.86 -0.13 0.00 0.25 0.00 0.00 55.06 53.23 1x50 s HIS 71 Cb -0.13 -1.41 -0.05 0.00 -1.18 0.00 0.00 32.58 29.81 1x50 s HIS 71 CO -0.02 -0.82 0.29 0.42 -0.65 0.00 0.00 174.74 173.96 1x50 s ILE 72 N 1.01 5.27 -0.20 0.89 1.01 -0.73 -0.70 121.20 127.76 1x50 s ILE 72 Ca 0.16 0.55 -0.05 0.00 0.00 0.00 0.00 60.65 61.31 1x50 s ILE 72 Cb -0.22 -3.60 0.07 0.00 0.01 0.00 0.00 42.46 38.72 1x50 s ILE 72 CO -0.07 0.49 0.11 0.21 0.00 0.00 0.00 174.94 175.67 1x50 s ASN 73 N -0.29 2.54 0.65 3.58 3.04 -0.37 -0.06 114.94 124.04 1x50 s ASN 73 Ca 0.18 -0.74 -0.15 0.00 0.04 0.00 0.00 52.86 52.19 1x50 s ASN 73 Cb -0.14 -0.23 -0.00 0.00 -1.54 0.00 0.00 41.25 39.34 1x50 s ASN 73 CO 0.06 -0.37 1.11 -2.16 -3.04 0.00 0.00 177.10 172.71 1x50 s PRO 74 N 2.14 2.82 -0.34 0.43 0.04 -1.24 -2.04 135.00 136.82 1x50 s PRO 74 Ca 0.04 1.39 0.00 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 32.53 1x50 s PRO 74 CO -0.15 -1.23 0.12 1.03 0.04 0.00 0.00 177.00 176.80 1x50 s ARG 75 N -4.07 0.89 0.24 4.56 0.52 -1.23 -4.45 118.95 115.40 1x50 s ARG 75 Ca 0.67 -1.33 -0.07 0.00 -0.52 0.00 0.00 55.73 54.48 1x50 s ARG 75 Cb -0.21 -2.17 0.22 0.00 0.52 0.00 0.00 34.95 33.32 1x50 s ARG 75 CO 0.41 -1.02 1.87 0.52 0.02 0.00 0.00 175.30 177.10 1x50 h MET 76 N 7.77 1.28 0.00 3.54 2.86 -1.83 -1.04 114.93 127.51 1x50 h MET 76 Ca -0.10 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.41 1x50 h MET 76 Cb 1.00 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 32.40 1x50 h MET 76 CO 0.48 0.92 0.00 0.41 1.06 0.00 0.00 176.91 179.77 1x50 n GLY 77 N -1.18 -2.33 0.38 8.32 0.00 -1.26 -4.25 105.19 104.87 1x50 n GLY 77 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.22 0.00 1.61 -1.24 -2.01 -3.47 115.58 109.25 1x50 h ASN 78 Ca 0.00 0.17 0.00 0.00 0.71 0.00 0.00 56.30 57.18 1x50 h ASN 78 Cb 0.00 0.51 0.00 0.00 0.73 0.00 0.00 38.32 39.56 1x50 h ASN 78 CO 0.00 -0.40 0.00 0.61 -1.29 0.00 0.00 177.43 176.35 1x50 n GLY 79 N -1.43 1.22 2.75 1.57 0.00 -0.40 -5.11 105.19 103.79 1x50 n GLY 79 Ca -0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 0.16 -0.47 2.61 -4.23 -1.23 -4.88 115.64 105.60 1x50 s THR 80 Ca 0.00 0.22 -0.21 0.00 -1.18 0.00 0.00 61.69 60.53 1x50 s THR 80 Cb 0.00 -0.34 0.03 0.00 1.34 0.00 0.00 72.50 73.54 1x50 s THR 80 CO 0.00 0.21 0.69 -0.69 -0.54 0.00 0.00 174.62 174.28 1x50 s VAL 81 N 1.83 4.77 0.37 2.29 1.01 -1.26 -3.55 120.40 125.85 1x50 s VAL 81 Ca 0.02 0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.78 1x50 s VAL 81 Cb -0.12 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 31.88 1x50 s VAL 81 CO -0.04 -0.71 0.95 -0.69 0.00 0.00 0.00 175.10 174.61 1x50 s VAL 82 N 2.95 4.28 -0.06 2.92 1.01 -0.86 -4.42 120.40 126.20 1x50 s VAL 82 Ca 0.22 1.68 0.02 0.00 0.00 0.00 0.00 61.98 63.91 1x50 s VAL 82 Cb -0.15 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.41 1x50 s VAL 82 CO 0.18 -0.05 -0.12 -0.13 0.00 0.00 0.00 175.10 174.98 1x50 s ARG 83 N -2.52 1.67 0.34 2.72 3.00 0.28 -1.23 118.95 123.21 1x50 s ARG 83 Ca 0.55 -0.41 0.05 0.00 0.00 0.00 0.00 55.73 55.92 1x50 s ARG 83 Cb -0.15 -1.39 -0.02 0.00 0.00 0.00 0.00 34.95 33.40 1x50 s ARG 83 CO 0.19 0.03 0.35 -0.80 0.00 0.00 0.00 175.30 175.07 1x50 s ASN 84 N 0.65 1.53 -0.29 0.23 -0.87 0.12 -0.53 114.94 115.78 1x50 s ASN 84 Ca -0.14 -1.70 0.00 0.00 -1.57 0.00 0.00 52.86 49.45 1x50 s ASN 84 Cb -0.16 0.60 0.18 0.00 -0.02 0.00 0.00 41.25 41.85 1x50 s ASN 84 CO 0.04 -1.15 0.55 -0.94 -2.57 0.00 0.00 177.10 173.02 1x50 s SER 85 N -3.34 -1.04 -0.24 -1.22 1.04 -1.26 0.23 113.70 107.86 1x50 s SER 85 Ca 0.38 0.54 -0.29 0.00 0.48 0.00 0.00 55.95 57.06 1x50 s SER 85 Cb 0.01 1.89 -0.00 0.00 0.10 0.00 0.00 66.02 68.03 1x50 s SER 85 CO 0.26 -0.28 1.21 -0.22 0.98 0.00 0.00 173.24 175.19 1x50 s LEU 86 N 2.78 4.03 0.37 2.42 2.96 -0.63 -0.43 118.68 130.19 1x50 s LEU 86 Ca 0.17 1.38 0.02 0.00 -0.22 0.00 0.00 54.13 55.48 1x50 s LEU 86 Cb -0.14 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.99 1x50 s LEU 86 CO -0.22 -0.87 0.57 -0.76 -1.32 0.00 0.00 176.35 173.75 1x50 s LEU 87 N 3.75 3.90 -0.87 -0.68 1.43 0.66 0.02 118.68 126.89 1x50 s LEU 87 Ca 0.52 0.28 -0.33 0.00 -1.03 0.00 0.00 54.13 53.56 1x50 s LEU 87 Cb -0.17 -3.15 -0.21 0.00 0.03 0.00 0.00 46.19 42.69 1x50 s LEU 87 CO 0.16 -0.44 2.57 0.59 0.23 0.00 0.00 176.35 179.45 1x50 n ASN 88 N -1.85 0.51 0.00 2.29 3.02 -1.26 0.21 115.26 118.17 1x50 n ASN 88 Ca -0.02 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1x50 n ASN 88 Cb 0.57 -0.95 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 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 6.67 0.32 3.54 7.41 0.00 -1.26 -4.91 105.19 116.96 1x50 n GLY 89 Ca 0.62 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.39 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 -2.28 3.00 0.18 1.61 0.15 0.55 -5.17 113.70 111.74 1x50 s SER 90 Ca 0.00 -1.46 0.06 0.00 0.70 0.00 0.00 55.95 55.24 1x50 s SER 90 Cb 0.00 0.03 -0.05 0.00 -1.71 0.00 0.00 66.02 64.29 1x50 s SER 90 CO 0.00 -0.66 -0.11 0.26 1.20 0.00 0.00 173.24 173.93 1x50 s TRP 91 N -3.10 1.49 0.00 3.44 0.52 -1.26 0.24 118.94 120.27 1x50 s TRP 91 Ca 0.30 -0.70 0.00 0.00 0.02 0.00 0.00 56.10 55.72 1x50 s TRP 91 Cb 0.07 -0.74 0.00 0.00 -1.15 0.00 0.00 33.47 31.65 1x50 s TRP 91 CO 0.14 0.19 0.00 0.41 0.02 0.00 0.00 176.95 177.71 1x50 n GLY 92 N -0.30 0.95 3.79 0.98 0.00 0.43 -4.71 105.19 106.33 1x50 n GLY 92 Ca -0.09 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 -0.15 -0.26 1.61 0.01 -1.26 -4.96 113.70 107.69 1x50 s SER 93 Ca 0.00 -0.52 -0.15 0.00 1.31 0.00 0.00 55.95 56.59 1x50 s SER 93 Cb 0.00 0.55 -0.04 0.00 0.21 0.00 0.00 66.02 66.74 1x50 s SER 93 CO 0.00 -1.03 0.37 -1.61 0.41 0.00 0.00 173.24 171.39 1x50 s GLU 94 N -3.13 4.04 -0.16 12.44 2.02 -1.26 -3.89 118.70 128.76 1x50 s GLU 94 Ca 0.14 0.06 0.02 0.00 0.02 0.00 0.00 54.97 55.21 1x50 s GLU 94 Cb -0.02 -3.64 0.02 0.00 0.10 0.00 0.00 34.13 30.58 1x50 s GLU 94 CO 0.04 -0.24 -0.21 -1.21 0.02 0.00 0.00 175.26 173.66 1x50 s GLU 95 N 1.95 2.99 -0.12 1.61 2.02 0.31 -4.90 118.70 122.57 1x50 s GLU 95 Ca 0.15 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.31 1x50 s GLU 95 Cb -0.16 -2.50 0.02 0.00 0.10 0.00 0.00 34.13 31.59 1x50 s GLU 95 CO 0.09 -0.12 -0.13 0.15 0.02 0.00 0.00 175.26 175.27 1x50 s LYS 96 N 1.08 2.04 -0.30 1.61 1.02 -1.26 -0.55 119.74 123.37 1x50 s LYS 96 Ca -0.00 -0.47 -0.10 0.00 0.02 0.00 0.00 55.97 55.42 1x50 s LYS 96 Cb -0.14 -1.86 0.18 0.00 -0.52 0.00 0.00 37.83 35.49 1x50 s LYS 96 CO -0.08 -0.18 0.98 0.21 -0.92 0.00 0.00 175.35 175.36 1x50 s LYS 97 N 1.35 0.23 -0.00 1.68 2.47 -1.26 -5.09 119.74 119.11 1x50 s LYS 97 Ca 0.00 0.33 -0.10 0.00 -1.56 0.00 0.00 55.97 54.64 1x50 s LYS 97 Cb -0.14 0.18 0.01 0.00 -1.46 0.00 0.00 37.83 36.42 1x50 s LYS 97 CO -0.06 -0.32 0.20 -1.50 0.16 0.00 0.00 175.35 173.83 1x50 s ILE 98 N 2.94 0.07 -0.15 5.43 2.07 -1.26 -4.71 121.20 125.59 1x50 s ILE 98 Ca 0.11 -0.60 -0.08 0.00 -1.41 0.00 0.00 60.65 58.67 1x50 s ILE 98 Cb -0.08 -0.50 -0.24 0.00 0.13 0.00 0.00 42.46 41.77 1x50 s ILE 98 CO -0.17 -0.33 0.26 1.07 -1.91 0.00 0.00 174.94 173.86 1x50 n THR 99 N 1.39 1.72 -3.76 4.00 5.66 -1.25 -4.95 114.28 117.09 1x50 n THR 99 Ca -0.22 -0.57 -0.13 0.00 -3.05 0.00 0.00 64.05 60.08 1x50 n THR 99 Cb 0.56 -1.74 -0.14 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 -2.53 -0.19 -0.53 1.09 -3.43 -1.26 -5.11 115.29 103.32 1x50 s HIS 100 Ca -0.25 0.51 -0.06 0.00 -0.80 0.00 0.00 55.06 54.46 1x50 s HIS 100 Cb 0.07 -0.04 0.14 0.00 -1.43 0.00 0.00 32.58 31.32 1x50 s HIS 100 CO 0.72 -0.16 0.38 1.21 -2.00 0.00 0.00 174.74 174.89 1x50 s ASN 101 N 1.01 5.57 0.12 7.38 2.47 -1.26 -4.91 114.94 125.33 1x50 s ASN 101 Ca -0.08 -2.27 -0.13 0.00 0.42 0.00 0.00 52.86 50.81 1x50 s ASN 101 Cb -0.10 -1.94 -0.06 0.00 -1.45 0.00 0.00 41.25 37.70 1x50 s ASN 101 CO -0.05 -0.56 1.45 1.55 -3.72 0.00 0.00 177.10 175.76 1x50 h PRO 102 N 7.91 0.83 -4.49 0.43 0.13 -1.99 -3.44 132.00 131.37 1x50 h PRO 102 Ca -0.11 -0.44 -0.56 0.00 -0.87 0.00 0.00 66.00 64.02 1x50 h PRO 102 Cb 1.03 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 1x50 h PRO 102 CO 0.77 1.07 1.06 1.19 -0.23 0.00 0.00 178.00 181.86 1x50 n PHE 103 N -4.16 0.83 -4.06 1.56 3.72 -1.26 -4.89 117.46 109.19 1x50 n PHE 103 Ca -0.03 0.55 -0.15 0.00 -0.05 0.00 0.00 57.45 57.77 1x50 n PHE 103 Cb 0.51 -1.76 -0.15 0.00 -0.94 0.00 0.00 39.48 37.14 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 4.91 0.19 -0.53 1.37 0.00 -1.26 -4.68 107.32 107.32 1x50 s GLY 104 Ca 0.94 -0.12 -0.27 0.00 0.00 0.00 0.00 44.72 45.26 1x50 s GLY 104 CO 0.49 -0.05 1.81 2.56 0.00 0.00 0.00 173.10 177.91 1x50 s PRO 105 N 0.04 2.87 0.00 2.90 0.04 -1.26 -2.27 135.00 137.32 1x50 s PRO 105 Ca -0.00 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1x50 s PRO 105 Cb -0.03 -4.32 0.00 0.00 0.04 0.00 0.00 34.50 30.20 1x50 s PRO 105 CO -0.00 -2.44 0.00 0.41 0.04 0.00 0.00 177.00 175.01 1x50 n GLY 106 N 5.59 1.11 3.08 0.56 0.00 -0.05 -4.70 105.19 110.78 1x50 n GLY 106 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.07 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 0.63 1.14 1.61 -2.07 -0.96 -5.00 119.66 115.01 1x50 s GLN 107 Ca 0.00 -0.70 -0.15 0.00 -1.82 0.00 0.00 55.36 52.69 1x50 s GLN 107 Cb 0.00 -0.52 0.26 0.00 -1.09 0.00 0.00 33.01 31.66 1x50 s GLN 107 CO 0.00 0.12 1.07 -0.06 -1.32 0.00 0.00 175.29 175.09 1x50 s PHE 108 N -1.07 1.25 -0.29 9.60 0.40 -1.26 -3.29 117.98 123.32 1x50 s PHE 108 Ca -0.05 0.84 -0.13 0.00 -0.60 0.00 0.00 56.93 56.99 1x50 s PHE 108 Cb -0.08 -3.24 0.12 0.00 0.51 0.00 0.00 43.02 40.32 1x50 s PHE 108 CO 0.01 -3.60 0.71 -0.59 0.70 0.00 0.00 175.22 172.44 1x50 s PHE 109 N -2.80 -1.15 -0.48 0.36 -0.12 -1.19 -4.78 117.98 107.81 1x50 s PHE 109 Ca 0.68 2.11 -0.16 0.00 -0.05 0.00 0.00 56.93 59.50 1x50 s PHE 109 Cb -0.17 0.69 0.07 0.00 -0.63 0.00 0.00 43.02 42.98 1x50 s PHE 109 CO 0.59 -0.57 0.44 0.34 -0.05 0.00 0.00 175.22 175.96 1x50 s ASP 110 N 2.31 6.16 -0.12 1.98 2.15 -1.26 -3.35 116.67 124.55 1x50 s ASP 110 Ca -0.07 -1.27 -0.04 0.00 0.43 0.00 0.00 52.55 51.59 1x50 s ASP 110 Cb -0.08 -2.20 -0.04 0.00 -0.30 0.00 0.00 42.92 40.30 1x50 s ASP 110 CO -0.19 -0.69 0.04 -0.22 -0.17 0.00 0.00 175.17 173.93 1x50 s LEU 111 N 1.80 3.75 -0.17 -1.34 1.98 -0.69 -2.16 118.68 121.85 1x50 s LEU 111 Ca 0.06 0.16 -0.04 0.00 -2.89 0.00 0.00 54.13 51.42 1x50 s LEU 111 Cb -0.24 -1.89 0.08 0.00 0.66 0.00 0.00 46.19 44.80 1x50 s LEU 111 CO 0.07 0.32 0.21 -0.44 -1.89 0.00 0.00 176.35 174.62 1x50 s SER 112 N -0.52 1.13 -0.11 3.68 0.01 -0.56 -0.06 113.70 117.27 1x50 s SER 112 Ca 0.10 -0.00 -0.12 0.00 1.31 0.00 0.00 55.95 57.24 1x50 s SER 112 Cb -0.12 0.38 -0.05 0.00 0.21 0.00 0.00 66.02 66.44 1x50 s SER 112 CO 0.02 -0.30 0.27 -0.63 0.41 0.00 0.00 173.24 173.02 1x50 s ILE 113 N 2.32 5.29 -0.19 1.44 1.09 0.23 -0.33 121.20 131.06 1x50 s ILE 113 Ca 0.05 0.51 -0.05 0.00 -1.10 0.00 0.00 60.65 60.07 1x50 s ILE 113 Cb -0.14 -3.58 -0.03 0.00 -1.06 0.00 0.00 42.46 37.65 1x50 s ILE 113 CO -0.10 0.51 -0.01 -0.13 -0.10 0.00 0.00 174.94 175.11 1x50 s ARG 114 N -0.36 3.64 -0.26 2.79 0.52 0.19 0.39 118.95 125.87 1x50 s ARG 114 Ca 0.17 -0.51 -0.17 0.00 -0.52 0.00 0.00 55.73 54.70 1x50 s ARG 114 Cb -0.14 -3.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 1x50 s ARG 114 CO 0.06 0.08 0.48 0.00 0.02 0.00 0.00 175.30 175.95 1x50 n GLY 116 N 4.41 7.51 0.14 0.00 0.00 -1.11 -4.13 105.19 112.01 1x50 n GLY 116 Ca -0.05 -1.96 -0.19 0.00 0.00 0.00 0.00 46.02 43.83 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 2.71 0.10 0.99 4.77 -1.26 -4.38 117.00 119.93 1x50 n LEU 117 Ca 0.00 -0.03 -0.19 0.00 -0.03 0.00 0.00 56.01 55.76 1x50 n LEU 117 Cb 0.00 -0.81 -0.15 0.00 -2.33 0.00 0.00 43.42 40.14 1x50 n LEU 117 CO 0.00 0.81 -0.26 -0.78 -1.33 0.00 0.00 177.39 175.84 1x50 h ASP 118 N -0.21 0.54 -1.97 -1.43 1.82 -1.99 -3.49 116.42 109.70 1x50 h ASP 118 Ca -0.55 -0.66 0.22 0.00 -0.39 0.00 0.00 57.03 55.65 1x50 h ASP 118 Cb 1.76 -0.18 -0.04 0.00 0.68 0.00 0.00 39.33 41.55 1x50 h ASP 118 CO -0.15 1.53 0.65 -2.11 -1.61 0.00 0.00 179.24 177.54 1x50 n ARG 119 N -3.56 0.31 -4.02 0.28 1.85 -1.26 -4.13 116.66 106.12 1x50 n ARG 119 Ca -0.15 -0.88 -0.23 0.00 -1.00 0.00 0.00 57.85 55.59 1x50 n ARG 119 Cb 1.06 1.30 -0.03 0.00 -1.05 0.00 0.00 32.46 33.74 1x50 n ARG 119 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1x50 s PHE 120 N -2.43 3.32 -0.26 2.89 0.40 -1.04 -2.75 117.98 118.10 1x50 s PHE 120 Ca 0.23 -0.02 -0.01 0.00 -0.60 0.00 0.00 56.93 56.52 1x50 s PHE 120 Cb -0.01 -1.53 0.08 0.00 0.51 0.00 0.00 43.02 42.07 1x50 s PHE 120 CO 0.02 0.49 0.06 0.15 0.70 0.00 0.00 175.22 176.63 1x50 s LYS 121 N -3.70 0.80 -0.06 0.44 1.02 -0.32 -2.91 119.74 115.01 1x50 s LYS 121 Ca 0.33 -0.83 -0.18 0.00 0.02 0.00 0.00 55.97 55.31 1x50 s LYS 121 Cb -0.09 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.07 1x50 s LYS 121 CO 0.27 -0.81 0.51 0.08 -0.92 0.00 0.00 175.35 174.47 1x50 s VAL 122 N 1.68 5.06 0.08 3.17 1.01 -0.76 -0.63 120.40 130.00 1x50 s VAL 122 Ca 0.04 1.04 0.09 0.00 0.00 0.00 0.00 61.98 63.15 1x50 s VAL 122 Cb -0.17 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1x50 s VAL 122 CO -0.17 0.40 -0.25 -0.31 0.00 0.00 0.00 175.10 174.78 1x50 s TYR 123 N 0.03 2.14 -0.22 5.22 1.51 0.55 -0.65 117.35 125.92 1x50 s TYR 123 Ca 0.27 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1x50 s TYR 123 Cb -0.17 -1.23 0.07 0.00 -0.11 0.00 0.00 41.96 40.53 1x50 s TYR 123 CO 0.13 0.19 0.04 0.00 -1.11 0.00 0.00 175.55 174.81 1x50 s ALA 124 N -0.93 1.19 -1.48 3.71 0.00 0.91 -1.49 121.76 123.66 1x50 s ALA 124 Ca 0.11 -0.95 -0.12 0.00 0.00 0.00 0.00 51.96 50.99 1x50 s ALA 124 Cb -0.10 -1.29 0.06 0.00 0.00 0.00 0.00 23.12 21.79 1x50 s ALA 124 CO 0.03 -1.28 0.99 0.09 0.00 0.00 0.00 175.76 175.60 1x50 n ASN 125 N 4.98 -5.25 -0.75 0.00 3.02 -0.92 -1.79 115.26 114.55 1x50 n ASN 125 Ca -0.08 -0.68 -0.03 0.00 -0.03 0.00 0.00 54.58 53.76 1x50 n ASN 125 Cb 0.46 -4.18 0.01 0.00 -0.61 0.00 0.00 39.78 35.46 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 -1.74 0.58 2.89 7.41 0.00 -1.26 -5.05 105.19 108.02 1x50 n GLY 126 Ca 0.03 -0.62 -0.15 0.00 0.00 0.00 0.00 46.02 45.28 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 -4.85 0.07 -0.66 1.61 -0.21 -0.74 -5.08 119.66 109.79 1x50 s GLN 127 Ca 0.06 0.52 -0.26 0.00 0.02 0.00 0.00 55.36 55.70 1x50 s GLN 127 Cb -0.03 -0.21 -0.12 0.00 1.00 0.00 0.00 33.01 33.65 1x50 s GLN 127 CO 0.07 -0.25 2.42 1.58 -2.12 0.00 0.00 175.29 176.99 1x50 n HIS 128 N 4.92 1.21 0.06 0.91 -0.00 -1.26 -0.06 115.22 121.00 1x50 n HIS 128 Ca -0.13 0.08 -0.03 0.00 -0.00 0.00 0.00 57.72 57.65 1x50 n HIS 128 Cb 0.51 -2.52 -0.01 0.00 -0.00 0.00 0.00 29.99 27.96 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 19.95 -0.14 -7.90 0.27 5.85 -1.20 -3.45 115.31 128.70 1x50 h LEU 129 Ca -0.12 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.71 1x50 h LEU 129 Cb 1.16 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 1x50 h LEU 129 CO 1.14 -0.10 0.45 0.72 -0.34 0.00 0.00 178.44 180.31 1x50 s PHE 130 N -3.27 0.01 0.21 1.25 -0.12 -1.21 -3.83 117.98 111.02 1x50 s PHE 130 Ca -0.02 -0.47 0.10 0.00 -0.05 0.00 0.00 56.93 56.49 1x50 s PHE 130 Cb 0.00 0.72 -0.04 0.00 -0.63 0.00 0.00 43.02 43.07 1x50 s PHE 130 CO 0.07 -1.10 -0.13 0.34 -0.05 0.00 0.00 175.22 174.35 1x50 s ASP 131 N -3.16 4.00 -0.30 1.98 2.15 -1.26 -1.83 116.67 118.26 1x50 s ASP 131 Ca 0.17 -0.71 0.03 0.00 0.43 0.00 0.00 52.55 52.46 1x50 s ASP 131 Cb -0.03 -0.57 0.08 0.00 -0.30 0.00 0.00 42.92 42.10 1x50 s ASP 131 CO 0.06 0.09 -0.01 0.12 -0.17 0.00 0.00 175.17 175.26 1x50 s PHE 132 N -1.87 3.15 0.29 -5.34 5.36 -1.15 -4.97 117.98 113.45 1x50 s PHE 132 Ca 0.25 -2.45 -0.30 0.00 -0.96 0.00 0.00 56.93 53.47 1x50 s PHE 132 Cb -0.08 -2.27 -0.11 0.00 -0.34 0.00 0.00 43.02 40.22 1x50 s PHE 132 CO 0.14 -0.89 1.60 0.00 -1.46 0.00 0.00 175.22 174.61 1x50 s ALA 133 N 1.13 3.76 -0.56 11.12 0.00 -1.26 -2.49 121.76 133.45 1x50 s ALA 133 Ca 0.02 1.57 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 1x50 s ALA 133 Cb -0.19 -3.65 -0.07 0.00 0.00 0.00 0.00 23.12 19.21 1x50 s ALA 133 CO -0.09 -0.98 2.29 -1.01 0.00 0.00 0.00 175.76 175.97 1x50 s HIS 134 N 0.07 1.22 -0.11 0.00 3.76 -1.26 -4.79 115.29 114.18 1x50 s HIS 134 Ca 0.64 1.43 -0.25 0.00 -0.15 0.00 0.00 55.06 56.73 1x50 s HIS 134 Cb -0.48 -3.68 -0.27 0.00 1.11 0.00 0.00 32.58 29.26 1x50 s HIS 134 CO 0.47 -2.37 0.74 0.00 -0.85 0.00 0.00 174.74 172.73 1x50 h ARG 135 N 17.80 0.12 -4.55 1.40 3.08 -1.89 -3.43 114.38 126.92 1x50 h ARG 135 Ca -0.21 -0.21 -0.72 0.00 0.07 0.00 0.00 59.98 58.91 1x50 h ARG 135 Cb 1.21 0.08 -0.21 0.00 0.08 0.00 0.00 29.97 31.14 1x50 h ARG 135 CO 1.16 1.10 -0.30 -1.17 -1.07 0.00 0.00 179.97 179.69 1x50 s LEU 136 N -8.01 5.23 0.47 3.04 2.96 -1.26 -4.93 118.68 116.17 1x50 s LEU 136 Ca -0.18 -1.01 0.26 0.00 -0.22 0.00 0.00 54.13 52.98 1x50 s LEU 136 Cb -0.00 -2.25 1.31 0.00 0.50 0.00 0.00 46.19 45.75 1x50 s LEU 136 CO 0.74 -0.59 1.81 0.28 -1.32 0.00 0.00 176.35 177.26 1x50 h SER 137 N 8.73 0.23 -0.15 3.68 0.02 -2.01 0.55 113.55 124.60 1x50 h SER 137 Ca -0.27 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 60.65 1x50 h SER 137 Cb 1.11 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.62 1x50 h SER 137 CO 0.82 0.05 0.08 0.00 -1.14 0.00 0.00 176.83 176.65 1x50 n ALA 138 N -2.61 2.95 -0.29 3.77 0.00 -1.26 -4.42 120.51 118.65 1x50 n ALA 138 Ca 0.24 -0.44 0.11 0.00 0.00 0.00 0.00 53.44 53.35 1x50 n ALA 138 Cb 0.99 -1.06 0.27 0.00 0.00 0.00 0.00 19.45 19.64 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 0.28 0.42 -0.98 0.00 -0.00 -0.28 0.22 116.94 116.59 1x50 h PHE 139 Ca 0.08 0.05 0.28 0.00 -0.00 0.00 0.00 57.97 58.38 1x50 h PHE 139 Cb 1.18 -0.05 -0.14 0.00 -0.00 0.00 0.00 35.95 36.94 1x50 h PHE 139 CO 0.25 -0.13 0.53 -0.56 -0.00 0.00 0.00 178.31 178.40 1x50 h GLN 140 N 0.28 0.39 -0.88 6.09 3.07 -1.77 0.39 115.11 122.67 1x50 h GLN 140 Ca 0.52 -0.02 0.11 0.00 0.09 0.00 0.00 58.65 59.35 1x50 h GLN 140 Cb 0.99 -0.09 -0.08 0.00 0.08 0.00 0.00 27.48 28.38 1x50 h GLN 140 CO -0.58 0.26 0.51 0.00 0.09 0.00 0.00 178.83 179.11 1x50 h ARG 141 N 0.40 0.79 -5.63 0.06 3.08 -0.86 -2.40 114.38 109.81 1x50 h ARG 141 Ca 0.68 -0.05 -0.57 0.00 0.07 0.00 0.00 59.98 60.11 1x50 h ARG 141 Cb 1.44 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 31.28 1x50 h ARG 141 CO -0.56 0.52 1.56 0.28 -1.07 0.00 0.00 179.97 180.70 1x50 n VAL 142 N -4.73 0.06 -1.87 2.04 0.31 0.14 -4.33 118.33 109.94 1x50 n VAL 142 Ca 0.16 -0.33 0.05 0.00 -0.01 0.00 0.00 64.34 64.21 1x50 n VAL 142 Cb 0.34 -1.64 0.13 0.00 -0.91 0.00 0.00 33.84 31.76 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 11.62 1.45 -3.84 4.52 5.68 -1.17 -1.01 116.55 133.80 1x50 n ASP 143 Ca 0.47 -3.14 -0.16 0.00 -0.50 0.00 0.00 54.79 51.45 1x50 n ASP 143 Cb 0.26 -0.43 -0.16 0.00 -1.14 0.00 0.00 41.12 39.65 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 -2.02 0.20 -0.23 2.12 2.01 0.16 0.15 115.64 118.03 1x50 s THR 144 Ca 0.35 0.04 -0.00 0.00 0.31 0.00 0.00 61.69 62.38 1x50 s THR 144 Cb 0.35 -0.26 0.06 0.00 0.01 0.00 0.00 72.50 72.66 1x50 s THR 144 CO -0.09 0.13 -0.02 -0.22 -0.69 0.00 0.00 174.62 173.73 1x50 s LEU 145 N 0.78 2.21 0.14 4.42 2.96 -0.10 -1.14 118.68 127.95 1x50 s LEU 145 Ca -0.08 -1.13 0.07 0.00 -0.22 0.00 0.00 54.13 52.77 1x50 s LEU 145 Cb -0.11 -1.00 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 1x50 s LEU 145 CO -0.01 -0.27 -0.06 -1.83 -1.32 0.00 0.00 176.35 172.85 1x50 s GLU 146 N 1.53 2.22 -0.14 1.98 -1.05 -0.53 -0.40 118.70 122.31 1x50 s GLU 146 Ca -0.03 -1.09 -0.03 0.00 -0.15 0.00 0.00 54.97 53.67 1x50 s GLU 146 Cb -0.18 -2.31 0.05 0.00 -0.44 0.00 0.00 34.13 31.25 1x50 s GLU 146 CO -0.08 0.48 0.05 0.42 0.95 0.00 0.00 175.26 177.08 1x50 s ILE 147 N -1.48 0.19 0.43 1.83 1.01 -0.32 -2.03 121.20 120.82 1x50 s ILE 147 Ca 0.24 -0.13 0.04 0.00 0.00 0.00 0.00 60.65 60.80 1x50 s ILE 147 Cb -0.10 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 1x50 s ILE 147 CO 0.16 -0.08 0.04 0.00 0.00 0.00 0.00 174.94 175.05 1x50 s GLN 148 N 2.03 1.98 0.00 2.79 0.00 -0.80 -0.91 119.66 124.75 1x50 s GLN 148 Ca 0.02 -2.19 0.00 0.00 -0.00 0.00 0.00 55.36 53.19 1x50 s GLN 148 Cb -0.15 -1.30 0.00 0.00 0.00 0.00 0.00 33.01 31.56 1x50 s GLN 148 CO -0.07 -0.25 0.00 0.41 0.00 0.00 0.00 175.29 175.38 1x50 n GLY 149 N -1.01 0.43 3.06 2.60 0.00 -1.26 -0.71 105.19 108.29 1x50 n GLY 149 Ca -0.10 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 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 5.00 -0.11 1.61 1.01 -0.72 -4.91 116.67 114.54 1x50 s ASP 150 Ca 0.00 -2.75 -0.15 0.00 0.71 0.00 0.00 52.55 50.36 1x50 s ASP 150 Cb 0.00 -1.79 0.04 0.00 1.01 0.00 0.00 42.92 42.18 1x50 s ASP 150 CO 0.00 -0.36 0.39 0.54 0.21 0.00 0.00 175.17 175.95 1x50 s VAL 151 N 0.08 0.01 -0.70 -1.27 0.11 -1.26 -3.81 120.40 113.57 1x50 s VAL 151 Ca 0.16 -0.11 -0.12 0.00 -2.93 0.00 0.00 61.98 58.97 1x50 s VAL 151 Cb -0.22 -0.59 0.18 0.00 -1.53 0.00 0.00 36.38 34.23 1x50 s VAL 151 CO -0.03 -0.06 0.62 -0.89 -3.33 0.00 0.00 175.10 171.41 1x50 s THR 152 N -0.21 5.13 0.21 5.04 2.01 -0.14 -4.92 115.64 122.77 1x50 s THR 152 Ca -0.04 -2.26 -0.30 0.00 0.31 0.00 0.00 61.69 59.40 1x50 s THR 152 Cb -0.03 -4.23 -0.08 0.00 0.01 0.00 0.00 72.50 68.16 1x50 s THR 152 CO 0.02 -0.95 1.13 -0.76 -0.69 0.00 0.00 174.62 173.37 1x50 s LEU 153 N 0.56 4.49 -0.04 4.42 1.43 -1.26 0.75 118.68 129.04 1x50 s LEU 153 Ca 0.13 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.42 1x50 s LEU 153 Cb -0.17 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.41 1x50 s LEU 153 CO -0.05 -0.25 -0.03 -1.20 0.23 0.00 0.00 176.35 175.06 1x50 n SER 154 N 2.08 3.75 -3.73 2.29 7.64 0.94 -3.98 113.62 122.61 1x50 n SER 154 Ca 0.02 -0.02 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 1x50 n SER 154 Cb 0.45 -0.02 -0.13 0.00 -1.01 0.00 0.00 64.21 63.51 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 -2.07 -0.37 -0.04 1.43 6.14 0.31 -1.78 117.35 120.96 1x50 s TYR 155 Ca -0.05 0.85 -0.02 0.00 0.64 0.00 0.00 57.07 58.50 1x50 s TYR 155 Cb 0.01 0.08 0.03 0.00 0.42 0.00 0.00 41.96 42.51 1x50 s TYR 155 CO 0.09 -0.24 0.07 0.08 0.64 0.00 0.00 175.55 176.19 1x50 s VAL 156 N 1.18 -0.11 -0.13 3.14 1.01 -1.24 -0.80 120.40 123.46 1x50 s VAL 156 Ca -0.08 0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 1x50 s VAL 156 Cb -0.09 -0.15 0.05 0.00 0.00 0.00 0.00 36.38 36.18 1x50 s VAL 156 CO -0.08 0.13 0.32 -1.58 0.00 0.00 0.00 175.10 173.89 1x50 s GLN 157 N 1.71 0.32 -0.94 2.72 0.74 -1.22 -2.74 119.66 120.24 1x50 s GLN 157 Ca -0.02 0.59 -0.17 0.00 0.05 0.00 0.00 55.36 55.82 1x50 s GLN 157 Cb -0.12 -0.00 0.17 0.00 1.10 0.00 0.00 33.01 34.15 1x50 s GLN 157 CO -0.04 -0.13 1.06 0.42 -0.55 0.00 0.00 175.29 176.06 1x50 s ILE 158 N 0.99 5.05 0.18 -2.34 1.09 -1.26 -3.19 121.20 121.72 1x50 s ILE 158 Ca -0.07 -2.01 -0.33 0.00 -1.10 0.00 0.00 60.65 57.15 1x50 s ILE 158 Cb -0.07 -4.70 -0.14 0.00 -1.06 0.00 0.00 42.46 36.49 1x50 s ILE 158 CO -0.07 -1.38 1.56 -1.20 -0.10 0.00 0.00 174.94 173.75 1x50 n SER 159 N 5.59 3.11 0.00 3.58 7.64 -0.60 -4.90 113.62 128.04 1x50 n SER 159 Ca 0.23 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.20 1x50 n SER 159 Cb 0.47 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1x50 n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x50 n GLY 160 N 3.17 6.31 0.00 0.23 0.00 -1.26 -1.93 105.19 111.71 1x50 n GLY 160 Ca 0.16 -1.70 0.08 0.00 0.00 0.00 0.00 46.02 44.56 1x50 n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x50 n PRO 161 N 0.00 0.42 -0.12 1.61 -0.04 -1.25 -3.94 135.00 131.67 1x50 n PRO 161 Ca 0.00 0.04 -0.08 0.00 -0.04 0.00 0.00 63.50 63.41 1x50 n PRO 161 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1x50 n PRO 161 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1x50 h SER 162 N 0.00 -1.21 -2.18 3.54 0.87 -1.94 -3.37 113.55 109.26 1x50 h SER 162 Ca 0.00 0.16 -0.56 0.00 -1.23 0.00 0.00 61.79 60.17 1x50 h SER 162 Cb 0.03 0.50 0.01 0.00 -0.44 0.00 0.00 62.40 62.51 1x50 h SER 162 CO 0.00 -0.23 1.35 -0.24 -0.53 0.00 0.00 176.83 177.17 1x50 n SER 163 N -4.38 3.76 0.00 6.23 2.88 -1.25 -5.29 113.62 115.56 1x50 n SER 163 Ca -0.02 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.13 1x50 n SER 163 Cb 0.20 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.13 1x50 n SER 163 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42