#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 2.83 -0.60 1.61 0.01 -1.26 -5.03 113.70 111.26 1x50 s SER 2 Ca 0.00 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.81 1x50 s SER 2 Cb 0.00 -0.50 0.43 0.00 0.21 0.00 0.00 66.02 66.16 1x50 s SER 2 CO 0.00 0.27 1.79 -1.54 0.41 0.00 0.00 173.24 174.17 1x50 n SER 3 N 2.69 6.89 -4.63 2.44 3.41 -1.26 -4.98 113.62 118.19 1x50 n SER 3 Ca -0.16 -3.78 -0.31 0.00 -0.26 0.00 0.00 58.87 54.35 1x50 n SER 3 Cb 0.52 -0.82 -0.08 0.00 -0.26 0.00 0.00 64.21 63.57 1x50 n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x50 s GLY 4 N -2.21 2.92 0.11 5.00 0.00 -1.26 -5.16 107.32 106.72 1x50 s GLY 4 Ca 0.59 -0.64 0.09 0.00 0.00 0.00 0.00 44.72 44.76 1x50 s GLY 4 CO -0.07 -2.12 -0.24 -0.56 0.00 0.00 0.00 173.10 170.11 1x50 s SER 5 N -3.81 2.89 0.15 1.64 0.01 -1.26 -5.04 113.70 108.27 1x50 s SER 5 Ca 0.11 -0.69 -0.14 0.00 1.31 0.00 0.00 55.95 56.53 1x50 s SER 5 Cb 0.02 -0.19 0.03 0.00 0.21 0.00 0.00 66.02 66.10 1x50 s SER 5 CO 0.06 0.13 1.72 0.28 0.41 0.00 0.00 173.24 175.83 1x50 h SER 6 N 4.10 0.65 -3.62 2.44 0.02 -2.02 -3.39 113.55 111.73 1x50 h SER 6 Ca -0.48 -0.15 -0.70 0.00 -0.84 0.00 0.00 61.79 59.62 1x50 h SER 6 Cb 1.17 -0.17 -0.21 0.00 0.14 0.00 0.00 62.40 63.34 1x50 h SER 6 CO 0.40 0.62 -0.47 -0.83 -1.14 0.00 0.00 176.83 175.41 1x50 s GLY 7 N -2.98 1.97 -1.13 -3.77 0.00 -1.26 -5.01 107.32 95.14 1x50 s GLY 7 Ca -0.13 -1.54 -0.22 0.00 0.00 0.00 0.00 44.72 42.83 1x50 s GLY 7 CO 0.77 0.83 1.84 0.30 0.00 0.00 0.00 173.10 176.83 1x50 s HIS 8 N 1.68 2.17 -1.55 1.90 4.02 -1.26 -4.24 115.29 118.01 1x50 s HIS 8 Ca 0.05 -0.11 -0.07 0.00 1.02 0.00 0.00 55.06 55.95 1x50 s HIS 8 Cb -0.18 -4.26 0.07 0.00 -1.02 0.00 0.00 32.58 27.19 1x50 s HIS 8 CO 0.09 -1.54 0.18 1.04 1.02 0.00 0.00 174.74 175.53 1x50 n GLN 9 N 8.50 -0.88 -3.73 1.40 1.13 -1.26 -4.91 117.38 117.64 1x50 n GLN 9 Ca 0.43 0.10 -0.13 0.00 -1.94 0.00 0.00 57.00 55.46 1x50 n GLN 9 Cb 0.47 -3.67 -0.13 0.00 0.11 0.00 0.00 30.24 27.01 1x50 n GLN 9 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1x50 s GLN 10 N -7.01 0.17 0.01 -1.09 2.00 -1.26 -5.06 119.66 107.42 1x50 s GLN 10 Ca 0.25 0.51 -0.06 0.00 -2.00 0.00 0.00 55.36 54.06 1x50 s GLN 10 Cb -0.15 -0.13 -0.02 0.00 0.80 0.00 0.00 33.01 33.51 1x50 s GLN 10 CO 0.94 -0.18 -0.11 1.28 -0.50 0.00 0.00 175.29 176.73 1x50 n LEU 11 N 4.32 1.29 -4.55 3.68 4.77 -1.26 -4.86 117.00 120.40 1x50 n LEU 11 Ca -0.24 0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.51 1x50 n LEU 11 Cb 0.52 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1x50 n LEU 11 CO 0.14 -0.59 1.48 0.21 -1.33 0.00 0.00 177.39 177.30 1x50 s ASN 12 N -5.87 6.57 0.40 -1.43 2.47 -1.26 -4.97 114.94 110.85 1x50 s ASN 12 Ca -0.09 -1.67 0.03 0.00 0.42 0.00 0.00 52.86 51.54 1x50 s ASN 12 Cb 0.01 -2.55 0.06 0.00 -1.45 0.00 0.00 41.25 37.32 1x50 s ASN 12 CO 0.13 -1.40 0.43 -1.54 -3.72 0.00 0.00 177.10 171.01 1x50 n SER 13 N 8.49 0.86 -4.71 -4.21 3.41 -1.26 -5.13 113.62 111.07 1x50 n SER 13 Ca 0.34 -1.66 -0.25 0.00 -0.26 0.00 0.00 58.87 57.04 1x50 n SER 13 Cb 0.50 -0.26 -0.07 0.00 -0.26 0.00 0.00 64.21 64.13 1x50 n SER 13 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 1x50 s LEU 14 N 0.00 3.46 0.84 1.04 2.34 -1.26 -5.12 118.68 119.99 1x50 s LEU 14 Ca 0.31 -0.39 -0.11 0.00 0.06 0.00 0.00 54.13 54.00 1x50 s LEU 14 Cb -0.02 -2.05 0.10 0.00 -0.56 0.00 0.00 46.19 43.66 1x50 s LEU 14 CO 0.20 0.04 1.09 -2.16 -1.06 0.00 0.00 176.35 174.46 1x50 s PRO 15 N -3.35 1.69 0.79 1.48 0.04 -1.26 -5.03 135.00 129.36 1x50 s PRO 15 Ca 0.30 0.97 -0.11 0.00 0.04 0.00 0.00 61.00 62.20 1x50 s PRO 15 Cb -0.08 -1.85 0.07 0.00 0.04 0.00 0.00 34.50 32.68 1x50 s PRO 15 CO 0.21 -1.99 1.09 -0.08 0.04 0.00 0.00 177.00 176.27 1x50 s THR 16 N -2.92 3.20 -0.46 1.26 -1.32 -1.26 -4.95 115.64 109.20 1x50 s THR 16 Ca 0.62 0.39 0.01 0.00 -1.21 0.00 0.00 61.69 61.50 1x50 s THR 16 Cb -0.18 -3.06 0.46 0.00 -1.51 0.00 0.00 72.50 68.22 1x50 s THR 16 CO 0.57 -0.51 1.89 0.23 -2.21 0.00 0.00 174.62 174.59 1x50 n MET 17 N -3.47 2.20 -0.59 7.08 2.81 -1.26 -4.97 117.12 118.92 1x50 n MET 17 Ca 0.07 -2.59 -0.17 0.00 -1.81 0.00 0.00 57.70 53.20 1x50 n MET 17 Cb 0.55 -2.01 0.14 0.00 -0.71 0.00 0.00 33.22 31.19 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 -0.68 -2.25 0.00 0.03 -0.58 -1.26 -4.82 120.64 111.08 1x50 n GLU 18 Ca 0.51 -1.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.25 1x50 n GLU 18 Cb 1.06 -0.94 0.00 0.00 -0.57 0.00 0.00 31.44 31.00 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 -1.69 1.04 3.74 0.62 0.00 -1.26 -4.86 105.19 102.79 1x50 n GLY 19 Ca 0.09 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 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 1.70 0.13 1.61 0.04 -1.26 -5.06 135.00 132.17 1x50 s PRO 20 Ca 0.00 0.98 -0.02 0.00 0.04 0.00 0.00 61.00 62.00 1x50 s PRO 20 Cb 0.00 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.72 1x50 s PRO 20 CO 0.00 -1.97 0.12 -0.35 0.04 0.00 0.00 177.00 174.83 1x50 n PRO 21 N -3.72 -1.25 -3.23 0.56 -0.04 -1.26 -5.05 135.00 121.00 1x50 n PRO 21 Ca 0.08 -0.19 -0.24 0.00 -0.04 0.00 0.00 63.50 63.11 1x50 n PRO 21 Cb 0.54 -0.18 -0.01 0.00 -0.04 0.00 0.00 33.50 33.82 1x50 n PRO 21 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1x50 s THR 22 N -1.21 4.81 -0.22 0.52 2.01 -1.13 -5.02 115.64 115.40 1x50 s THR 22 Ca 0.08 -0.43 -0.17 0.00 0.31 0.00 0.00 61.69 61.47 1x50 s THR 22 Cb -0.01 -3.76 0.06 0.00 0.01 0.00 0.00 72.50 68.80 1x50 s THR 22 CO 0.06 -0.52 0.57 -0.36 -0.69 0.00 0.00 174.62 173.68 1x50 s PHE 23 N -2.40 -0.72 -1.55 4.92 0.08 -1.26 -3.93 117.98 113.11 1x50 s PHE 23 Ca 0.43 1.62 -0.03 0.00 0.12 0.00 0.00 56.93 59.07 1x50 s PHE 23 Cb -0.10 0.32 0.03 0.00 -0.57 0.00 0.00 43.02 42.70 1x50 s PHE 23 CO 0.37 -0.36 0.23 0.09 -0.10 0.00 0.00 175.22 175.45 1x50 n ASN 24 N 3.39 0.05 -4.76 1.36 3.02 -0.40 -4.86 115.26 113.05 1x50 n ASN 24 Ca -0.17 -1.18 -0.41 0.00 -0.03 0.00 0.00 54.58 52.80 1x50 n ASN 24 Cb 0.56 -2.10 -0.03 0.00 -0.61 0.00 0.00 39.78 37.60 1x50 n ASN 24 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1x50 s PRO 25 N -7.10 4.44 0.77 3.52 0.04 -1.26 -5.01 135.00 130.40 1x50 s PRO 25 Ca 0.13 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 63.09 1x50 s PRO 25 Cb -0.07 -3.15 0.19 0.00 0.04 0.00 0.00 34.50 31.51 1x50 s PRO 25 CO 0.96 -0.11 0.68 -0.35 0.04 0.00 0.00 177.00 178.22 1x50 n PRO 26 N 1.56 -2.35 -3.82 0.56 -0.04 -1.26 -4.48 135.00 125.17 1x50 n PRO 26 Ca 0.02 -1.09 -0.13 0.00 -0.04 0.00 0.00 63.50 62.26 1x50 n PRO 26 Cb 0.43 -1.02 -0.13 0.00 -0.04 0.00 0.00 33.50 32.74 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 -2.23 -0.01 0.44 0.52 1.01 -1.26 -3.16 120.40 115.71 1x50 s VAL 27 Ca 0.44 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.23 1x50 s VAL 27 Cb -0.04 -0.17 -0.08 0.00 0.00 0.00 0.00 36.38 36.09 1x50 s VAL 27 CO 0.34 0.02 1.17 -2.16 0.00 0.00 0.00 175.10 174.47 1x50 s PRO 28 N 0.29 3.85 -0.26 2.72 0.04 -1.26 -5.05 135.00 135.33 1x50 s PRO 28 Ca -0.02 1.81 -0.14 0.00 0.04 0.00 0.00 61.00 62.69 1x50 s PRO 28 Cb -0.03 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 1x50 s PRO 28 CO -0.01 -0.49 0.32 -0.47 0.04 0.00 0.00 177.00 176.39 1x50 s TYR 29 N -1.50 3.26 -0.50 0.56 6.14 -0.90 -4.89 117.35 119.53 1x50 s TYR 29 Ca 0.61 0.36 -0.14 0.00 0.64 0.00 0.00 57.07 58.54 1x50 s TYR 29 Cb -0.30 -2.49 0.11 0.00 0.42 0.00 0.00 41.96 39.70 1x50 s TYR 29 CO 0.36 -0.16 0.43 -0.06 0.64 0.00 0.00 175.55 176.77 1x50 s PHE 30 N 1.81 3.29 -0.41 4.97 0.08 -1.26 -1.92 117.98 124.53 1x50 s PHE 30 Ca 0.13 -1.34 -0.16 0.00 0.12 0.00 0.00 56.93 55.68 1x50 s PHE 30 Cb -0.15 -3.55 0.02 0.00 -0.57 0.00 0.00 43.02 38.77 1x50 s PHE 30 CO 0.09 -0.96 0.34 0.20 -0.10 0.00 0.00 175.22 174.80 1x50 s GLY 31 N 3.10 1.97 -0.67 4.36 0.00 0.94 -4.98 107.32 112.06 1x50 s GLY 31 Ca 0.04 -1.66 -0.27 0.00 0.00 0.00 0.00 44.72 42.83 1x50 s GLY 31 CO 0.03 1.00 1.69 0.50 0.00 0.00 0.00 173.10 176.32 1x50 s ARG 32 N 1.82 2.80 -0.78 2.90 1.81 -1.26 -1.36 118.95 124.88 1x50 s ARG 32 Ca 0.07 0.31 -0.25 0.00 -1.72 0.00 0.00 55.73 54.14 1x50 s ARG 32 Cb -0.18 -4.37 -0.06 0.00 -0.45 0.00 0.00 34.95 29.89 1x50 s ARG 32 CO 0.11 -2.58 2.07 -0.51 -0.68 0.00 0.00 175.30 173.70 1x50 s LEU 33 N 8.10 3.15 -0.77 2.53 1.43 -0.86 -4.76 118.68 127.49 1x50 s LEU 33 Ca 0.58 -0.15 -0.25 0.00 -1.03 0.00 0.00 54.13 53.27 1x50 s LEU 33 Cb -0.11 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.51 1x50 s LEU 33 CO 0.18 -2.92 2.01 -1.10 0.23 0.00 0.00 176.35 174.75 1x50 s GLN 34 N 7.52 2.43 0.00 1.70 1.11 -1.26 -2.40 119.66 128.76 1x50 s GLN 34 Ca 0.77 0.19 0.00 0.00 0.01 0.00 0.00 55.36 56.32 1x50 s GLN 34 Cb -0.10 -4.80 0.00 0.00 -1.01 0.00 0.00 33.01 27.10 1x50 s GLN 34 CO 0.08 -3.31 0.00 0.41 0.01 0.00 0.00 175.29 172.48 1x50 n GLY 35 N 6.45 3.65 0.00 3.09 0.00 -1.26 -5.08 105.19 112.04 1x50 n GLY 35 Ca 0.35 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.22 3.56 -0.02 0.00 -1.01 -4.76 105.19 102.74 1x50 n GLY 36 Ca 0.00 -1.82 -0.26 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.53 3.13 0.16 0.99 1.43 -0.42 -4.90 118.68 117.54 1x50 s LEU 37 Ca 0.00 0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 1x50 s LEU 37 Cb 0.00 -2.54 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 1x50 s LEU 37 CO 0.00 -3.04 0.14 0.42 0.23 0.00 0.00 176.35 174.10 1x50 s THR 38 N 11.66 4.54 0.53 5.49 -4.23 -1.26 -3.79 115.64 128.58 1x50 s THR 38 Ca 0.81 -1.03 0.32 0.00 -1.18 0.00 0.00 61.69 60.60 1x50 s THR 38 Cb -0.11 -3.31 0.50 0.00 1.34 0.00 0.00 72.50 70.92 1x50 s THR 38 CO 0.10 -0.09 1.85 0.00 -0.54 0.00 0.00 174.62 175.94 1x50 h ALA 39 N 2.46 2.89 -0.84 3.99 0.00 -1.73 0.45 119.26 126.48 1x50 h ALA 39 Ca -0.48 -0.03 -0.51 0.00 0.00 0.00 0.00 54.91 53.89 1x50 h ALA 39 Cb 1.20 0.07 -0.28 0.00 0.00 0.00 0.00 17.79 18.78 1x50 h ALA 39 CO 0.64 -1.19 0.40 0.54 0.00 0.00 0.00 179.25 179.64 1x50 n ARG 40 N -4.27 2.50 -4.39 0.00 3.00 -1.26 -4.30 116.66 107.94 1x50 n ARG 40 Ca 0.22 -3.30 -0.34 0.00 -0.01 0.00 0.00 57.85 54.42 1x50 n ARG 40 Cb 1.06 -2.16 -0.11 0.00 0.00 0.00 0.00 32.46 31.25 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 -3.52 3.31 -0.11 5.56 6.06 0.16 -3.52 118.95 126.89 1x50 s ARG 41 Ca 0.57 -0.47 -0.02 0.00 -2.50 0.00 0.00 55.73 53.31 1x50 s ARG 41 Cb 0.47 -2.85 0.04 0.00 0.06 0.00 0.00 34.95 32.67 1x50 s ARG 41 CO 0.03 0.48 0.03 0.99 -2.50 0.00 0.00 175.30 174.34 1x50 s THR 42 N -0.27 0.24 -0.03 4.11 2.01 -0.50 -0.44 115.64 120.75 1x50 s THR 42 Ca 0.05 -0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.87 1x50 s THR 42 Cb -0.12 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.76 1x50 s THR 42 CO 0.02 0.06 0.48 -0.63 -0.69 0.00 0.00 174.62 173.86 1x50 s ILE 43 N 2.01 5.03 -0.05 1.82 1.09 0.18 -1.53 121.20 129.74 1x50 s ILE 43 Ca 0.03 0.98 0.03 0.00 -1.10 0.00 0.00 60.65 60.60 1x50 s ILE 43 Cb -0.14 -3.80 0.00 0.00 -1.06 0.00 0.00 42.46 37.46 1x50 s ILE 43 CO -0.06 0.47 -0.15 -0.63 -0.10 0.00 0.00 174.94 174.47 1x50 s ILE 44 N -0.37 1.28 -0.22 2.92 1.01 -1.10 0.66 121.20 125.38 1x50 s ILE 44 Ca 0.26 -0.60 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 1x50 s ILE 44 Cb -0.17 -1.13 0.07 0.00 0.01 0.00 0.00 42.46 41.24 1x50 s ILE 44 CO 0.13 0.38 0.06 -0.63 0.00 0.00 0.00 174.94 174.88 1x50 s ILE 45 N 0.32 0.50 -0.31 2.92 1.01 0.11 -3.41 121.20 122.34 1x50 s ILE 45 Ca -0.09 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 59.82 1x50 s ILE 45 Cb -0.13 -1.11 0.03 0.00 0.01 0.00 0.00 42.46 41.27 1x50 s ILE 45 CO 0.03 -0.33 0.06 -0.54 0.00 0.00 0.00 174.94 174.15 1x50 s LYS 46 N 1.85 2.68 0.00 2.79 1.02 -0.20 -1.69 119.74 126.19 1x50 s LYS 46 Ca 0.02 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 54.89 1x50 s LYS 46 Cb -0.17 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.82 1x50 s LYS 46 CO -0.13 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.12 1x50 n GLY 47 N 4.76 5.41 3.35 -3.33 0.00 -1.21 -0.85 105.19 113.31 1x50 n GLY 47 Ca -0.13 -0.80 0.02 0.00 0.00 0.00 0.00 46.02 45.10 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 1.64 -0.53 -0.16 1.61 6.14 0.68 -3.42 117.35 123.30 1x50 s TYR 48 Ca 0.00 0.92 -0.29 0.00 0.64 0.00 0.00 57.07 58.34 1x50 s TYR 48 Cb 0.00 0.32 -0.04 0.00 0.42 0.00 0.00 41.96 42.66 1x50 s TYR 48 CO 0.00 -0.27 1.60 0.08 0.64 0.00 0.00 175.55 177.61 1x50 s VAL 49 N 2.36 3.71 0.66 3.14 1.01 -1.24 -2.21 120.40 127.82 1x50 s VAL 49 Ca -0.02 0.82 -0.15 0.00 0.00 0.00 0.00 61.98 62.63 1x50 s VAL 49 Cb -0.05 -3.64 -0.00 0.00 0.00 0.00 0.00 36.38 32.69 1x50 s VAL 49 CO -0.17 -0.19 1.11 -2.16 0.00 0.00 0.00 175.10 173.69 1x50 s PRO 50 N 4.36 2.80 0.34 2.72 0.04 -1.26 -0.63 135.00 143.38 1x50 s PRO 50 Ca 0.71 1.39 0.26 0.00 0.04 0.00 0.00 61.00 63.41 1x50 s PRO 50 Cb -0.28 -1.95 1.11 0.00 0.04 0.00 0.00 34.50 33.42 1x50 s PRO 50 CO 0.28 -1.25 1.79 -1.00 0.04 0.00 0.00 177.00 176.86 1x50 h PRO 51 N 0.04 0.00 -0.29 0.56 0.13 -1.94 -2.57 132.00 127.93 1x50 h PRO 51 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1x50 h PRO 51 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 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 -2.47 2.14 -4.20 1.56 -2.24 -1.26 -4.95 114.28 102.85 1x50 n THR 52 Ca 0.02 -1.74 -0.34 0.00 -2.27 0.00 0.00 64.05 59.72 1x50 n THR 52 Cb 0.24 -0.15 -0.14 0.00 -2.10 0.00 0.00 70.33 68.18 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 -1.75 1.56 0.03 3.38 0.00 -0.97 -5.03 107.32 104.55 1x50 s GLY 53 Ca 0.40 -1.08 -0.27 0.00 0.00 0.00 0.00 44.72 43.77 1x50 s GLY 53 CO 0.10 0.21 1.25 0.50 0.00 0.00 0.00 173.10 175.17 1x50 h LYS 54 N 7.63 -0.93 -1.53 2.90 1.57 -1.87 -3.45 116.57 120.89 1x50 h LYS 54 Ca -0.37 0.06 0.22 0.00 -1.87 0.00 0.00 60.65 58.69 1x50 h LYS 54 Cb 1.17 0.21 -0.20 0.00 0.08 0.00 0.00 32.23 33.50 1x50 h LYS 54 CO 0.60 -0.62 0.76 -1.54 -0.57 0.00 0.00 179.45 178.08 1x50 s SER 55 N -3.88 -0.18 0.26 0.86 1.04 -1.26 -4.28 113.70 106.26 1x50 s SER 55 Ca -0.14 0.05 0.02 0.00 0.48 0.00 0.00 55.95 56.35 1x50 s SER 55 Cb 0.01 0.18 0.02 0.00 0.10 0.00 0.00 66.02 66.33 1x50 s SER 55 CO 0.42 -0.27 0.17 2.22 0.98 0.00 0.00 173.24 176.77 1x50 n PHE 56 N 0.04 -0.86 -3.66 5.02 -1.74 -1.25 -1.89 117.46 113.13 1x50 n PHE 56 Ca -0.02 -1.12 -0.08 0.00 -0.56 0.00 0.00 57.45 55.66 1x50 n PHE 56 Cb 0.59 -0.21 -0.08 0.00 1.52 0.00 0.00 39.48 41.30 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 -2.38 -1.59 -0.39 1.98 0.00 0.05 -3.78 121.76 115.65 1x50 s ALA 57 Ca 0.13 2.10 -0.03 0.00 0.00 0.00 0.00 51.96 54.16 1x50 s ALA 57 Cb -0.01 -1.24 0.10 0.00 0.00 0.00 0.00 23.12 21.97 1x50 s ALA 57 CO 0.08 -0.34 0.18 0.42 0.00 0.00 0.00 175.76 176.10 1x50 s ILE 58 N 1.50 3.31 -0.05 0.00 1.09 -0.03 -1.90 121.20 125.12 1x50 s ILE 58 Ca -0.09 -1.91 -0.04 0.00 -1.10 0.00 0.00 60.65 57.51 1x50 s ILE 58 Cb -0.06 -3.20 -0.04 0.00 -1.06 0.00 0.00 42.46 38.10 1x50 s ILE 58 CO -0.17 -0.59 0.14 0.20 -0.10 0.00 0.00 174.94 174.42 1x50 s ASN 59 N 1.76 6.19 -0.43 3.58 0.01 -0.95 -2.48 114.94 122.61 1x50 s ASN 59 Ca 0.06 0.34 -0.01 0.00 -0.71 0.00 0.00 52.86 52.54 1x50 s ASN 59 Cb -0.22 -1.93 0.12 0.00 0.41 0.00 0.00 41.25 39.63 1x50 s ASN 59 CO -0.03 0.32 0.20 -0.36 -1.51 0.00 0.00 177.10 175.72 1x50 s PHE 60 N -1.18 3.58 0.44 2.20 0.40 -0.17 -2.11 117.98 121.15 1x50 s PHE 60 Ca 0.22 -2.66 0.04 0.00 -0.60 0.00 0.00 56.93 53.93 1x50 s PHE 60 Cb -0.12 -3.12 0.01 0.00 0.51 0.00 0.00 43.02 40.30 1x50 s PHE 60 CO 0.12 -0.93 0.63 0.21 0.70 0.00 0.00 175.22 175.94 1x50 s LYS 61 N 0.81 2.85 -0.24 0.44 2.20 -0.18 -1.13 119.74 124.49 1x50 s LYS 61 Ca 0.11 -0.92 -0.10 0.00 -0.36 0.00 0.00 55.97 54.70 1x50 s LYS 61 Cb -0.22 -2.66 -0.05 0.00 -1.51 0.00 0.00 37.83 33.40 1x50 s LYS 61 CO -0.05 -0.32 0.15 0.08 -0.36 0.00 0.00 175.35 174.85 1x50 s VAL 62 N -2.47 5.19 0.26 4.02 1.01 -0.62 -1.10 120.40 126.69 1x50 s VAL 62 Ca 0.52 0.12 -0.05 0.00 0.00 0.00 0.00 61.98 62.57 1x50 s VAL 62 Cb -0.10 -3.43 0.26 0.00 0.00 0.00 0.00 36.38 33.11 1x50 s VAL 62 CO 0.35 0.33 1.93 1.23 0.00 0.00 0.00 175.10 178.95 1x50 h GLY 63 N 7.70 1.39 0.00 4.51 0.00 -1.78 0.81 103.07 115.70 1x50 h GLY 63 Ca -0.37 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.45 1x50 h GLY 63 CO 0.63 0.49 0.00 -1.26 0.00 0.00 0.00 176.54 176.40 1x50 n SER 64 N -4.39 0.00 0.00 0.19 2.88 -1.26 -4.60 113.62 106.43 1x50 n SER 64 Ca 0.12 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 1x50 n SER 64 Cb 0.03 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 1x50 n SER 64 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x50 n SER 65 N -1.90 0.00 0.00 -3.46 7.64 -1.23 -5.04 113.62 109.63 1x50 n SER 65 Ca 0.00 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1x50 n SER 65 Cb 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 1x50 n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x50 n GLY 66 N 2.02 0.58 3.54 0.23 0.00 0.28 -4.96 105.19 106.88 1x50 n GLY 66 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.86 4.32 -0.38 1.61 1.01 -1.26 -4.68 116.67 116.42 1x50 s ASP 67 Ca 0.00 -0.22 -0.22 0.00 0.71 0.00 0.00 52.55 52.82 1x50 s ASP 67 Cb 0.00 -0.92 0.01 0.00 1.01 0.00 0.00 42.92 43.02 1x50 s ASP 67 CO 0.00 0.29 0.72 -0.63 0.21 0.00 0.00 175.17 175.76 1x50 s ILE 68 N -0.93 4.78 0.01 0.77 1.01 0.15 -1.59 121.20 125.40 1x50 s ILE 68 Ca 0.15 0.64 -0.13 0.00 0.00 0.00 0.00 60.65 61.31 1x50 s ILE 68 Cb -0.11 -4.18 -0.33 0.00 0.01 0.00 0.00 42.46 37.84 1x50 s ILE 68 CO 0.06 -0.46 0.91 0.00 0.00 0.00 0.00 174.94 175.45 1x50 h ALA 69 N 8.60 -0.03 -3.66 9.38 0.00 -1.35 -0.75 119.26 131.45 1x50 h ALA 69 Ca -0.25 -0.95 -0.34 0.00 0.00 0.00 0.00 54.91 53.37 1x50 h ALA 69 Cb 1.10 0.25 -0.31 0.00 0.00 0.00 0.00 17.79 18.82 1x50 h ALA 69 CO 0.89 0.83 -0.75 -1.17 0.00 0.00 0.00 179.25 179.05 1x50 s LEU 70 N -7.44 1.58 -0.33 0.00 2.96 -1.25 -4.46 118.68 109.74 1x50 s LEU 70 Ca -0.10 -0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1x50 s LEU 70 Cb 0.05 -0.25 0.11 0.00 0.50 0.00 0.00 46.19 46.60 1x50 s LEU 70 CO 0.91 -0.02 0.14 -2.28 -1.32 0.00 0.00 176.35 173.78 1x50 s HIS 71 N 0.48 1.24 -0.17 5.38 5.65 0.66 -1.00 115.29 127.54 1x50 s HIS 71 Ca -0.05 -1.60 -0.08 0.00 0.25 0.00 0.00 55.06 53.58 1x50 s HIS 71 Cb -0.08 -1.41 -0.04 0.00 -1.18 0.00 0.00 32.58 29.86 1x50 s HIS 71 CO -0.01 -0.84 0.11 0.42 -0.65 0.00 0.00 174.74 173.77 1x50 s ILE 72 N 1.48 5.23 -0.21 0.89 1.01 -1.04 -0.57 121.20 127.99 1x50 s ILE 72 Ca 0.12 0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.84 1x50 s ILE 72 Cb -0.19 -3.34 0.08 0.00 0.01 0.00 0.00 42.46 39.02 1x50 s ILE 72 CO -0.21 0.51 0.12 0.21 0.00 0.00 0.00 174.94 175.57 1x50 s ASN 73 N -0.13 2.65 0.65 3.58 3.04 -0.71 -0.85 114.94 123.18 1x50 s ASN 73 Ca 0.09 -0.81 -0.15 0.00 0.04 0.00 0.00 52.86 52.03 1x50 s ASN 73 Cb -0.12 -0.22 -0.00 0.00 -1.54 0.00 0.00 41.25 39.38 1x50 s ASN 73 CO 0.00 -0.38 1.11 -2.16 -3.04 0.00 0.00 177.10 172.64 1x50 s PRO 74 N 2.15 2.83 -0.37 0.43 0.04 -1.25 -2.50 135.00 136.32 1x50 s PRO 74 Ca 0.05 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.50 1x50 s PRO 74 Cb -0.16 -1.95 0.12 0.00 0.04 0.00 0.00 34.50 32.55 1x50 s PRO 74 CO -0.19 -1.23 0.16 1.03 0.04 0.00 0.00 177.00 176.81 1x50 s ARG 75 N -4.04 1.01 0.43 4.56 0.52 -1.19 -4.47 118.95 115.77 1x50 s ARG 75 Ca 0.67 -1.55 0.17 0.00 -0.52 0.00 0.00 55.73 54.51 1x50 s ARG 75 Cb -0.21 -2.18 1.09 0.00 0.52 0.00 0.00 34.95 34.17 1x50 s ARG 75 CO 0.41 -1.07 1.89 0.52 0.02 0.00 0.00 175.30 177.06 1x50 h MET 76 N 7.40 0.38 0.00 3.54 2.86 -1.84 -0.93 114.93 126.34 1x50 h MET 76 Ca -0.07 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1x50 h MET 76 Cb 0.97 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1x50 h MET 76 CO 0.47 0.25 0.00 0.41 1.06 0.00 0.00 176.91 179.10 1x50 n GLY 77 N -1.53 0.00 0.14 8.32 0.00 -1.26 -4.16 105.19 106.70 1x50 n GLY 77 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 0.50 0.00 1.61 2.35 -2.02 -3.49 115.58 114.53 1x50 h ASN 78 Ca 0.00 -0.92 0.00 0.00 -0.55 0.00 0.00 56.30 54.83 1x50 h ASN 78 Cb 0.00 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.21 1x50 h ASN 78 CO 0.00 1.78 0.00 0.61 -1.65 0.00 0.00 177.43 178.17 1x50 n GLY 79 N 1.88 0.98 3.13 2.83 0.00 -0.35 -5.06 105.19 108.59 1x50 n GLY 79 Ca -0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.22 2.20 -0.40 2.61 -4.23 -1.23 -4.71 115.64 108.67 1x50 s THR 80 Ca 0.00 -1.03 -0.15 0.00 -1.18 0.00 0.00 61.69 59.33 1x50 s THR 80 Cb 0.00 -2.00 0.02 0.00 1.34 0.00 0.00 72.50 71.86 1x50 s THR 80 CO 0.00 0.42 0.30 -0.69 -0.54 0.00 0.00 174.62 174.12 1x50 s VAL 81 N 1.27 5.25 0.28 2.29 1.01 -1.26 -3.14 120.40 126.11 1x50 s VAL 81 Ca 0.03 -0.60 -0.23 0.00 0.00 0.00 0.00 61.98 61.17 1x50 s VAL 81 Cb -0.14 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.23 1x50 s VAL 81 CO -0.11 -0.29 0.85 -0.69 0.00 0.00 0.00 175.10 174.86 1x50 s VAL 82 N 1.71 4.38 -0.11 2.92 1.01 -1.04 -4.31 120.40 124.96 1x50 s VAL 82 Ca 0.06 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.61 1x50 s VAL 82 Cb -0.19 -3.92 0.02 0.00 0.00 0.00 0.00 36.38 32.29 1x50 s VAL 82 CO 0.10 0.14 -0.13 -0.13 0.00 0.00 0.00 175.10 175.09 1x50 s ARG 83 N -2.08 1.96 0.36 2.72 3.00 0.22 -1.73 118.95 123.39 1x50 s ARG 83 Ca 0.48 -0.46 0.06 0.00 0.00 0.00 0.00 55.73 55.81 1x50 s ARG 83 Cb -0.17 -1.75 -0.03 0.00 0.00 0.00 0.00 34.95 33.00 1x50 s ARG 83 CO 0.22 -0.12 0.22 -0.80 0.00 0.00 0.00 175.30 174.82 1x50 s ASN 84 N 1.18 2.04 -0.29 0.23 -0.87 0.27 -0.81 114.94 116.69 1x50 s ASN 84 Ca -0.04 -1.72 0.02 0.00 -1.57 0.00 0.00 52.86 49.55 1x50 s ASN 84 Cb -0.14 0.54 0.19 0.00 -0.02 0.00 0.00 41.25 41.82 1x50 s ASN 84 CO -0.04 -1.01 0.56 -0.94 -2.57 0.00 0.00 177.10 173.11 1x50 s SER 85 N -3.45 -1.21 -0.27 -1.22 1.04 -1.26 0.24 113.70 107.56 1x50 s SER 85 Ca 0.34 0.48 -0.29 0.00 0.48 0.00 0.00 55.95 56.96 1x50 s SER 85 Cb 0.02 1.95 0.01 0.00 0.10 0.00 0.00 66.02 68.11 1x50 s SER 85 CO 0.22 -0.29 1.16 -0.22 0.98 0.00 0.00 173.24 175.10 1x50 s LEU 86 N 2.80 3.99 0.37 2.42 2.96 -0.29 -0.07 118.68 130.87 1x50 s LEU 86 Ca 0.15 1.27 0.02 0.00 -0.22 0.00 0.00 54.13 55.35 1x50 s LEU 86 Cb -0.13 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 1x50 s LEU 86 CO -0.23 -0.87 0.56 -0.76 -1.32 0.00 0.00 176.35 173.73 1x50 s LEU 87 N 3.73 3.90 -0.87 -0.68 1.43 0.76 0.33 118.68 127.27 1x50 s LEU 87 Ca 0.50 0.25 -0.33 0.00 -1.03 0.00 0.00 54.13 53.51 1x50 s LEU 87 Cb -0.16 -3.12 -0.21 0.00 0.03 0.00 0.00 46.19 42.74 1x50 s LEU 87 CO 0.16 -0.45 2.57 0.59 0.23 0.00 0.00 176.35 179.45 1x50 n ASN 88 N -1.84 0.49 0.00 2.29 3.02 -1.26 0.21 115.26 118.17 1x50 n ASN 88 Ca -0.02 0.26 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 6.68 0.40 3.53 7.41 0.00 -1.26 -4.91 105.19 117.04 1x50 n GLY 89 Ca 0.62 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.40 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 -2.33 3.05 0.20 1.61 0.15 0.56 -5.17 113.70 111.76 1x50 s SER 90 Ca 0.00 -1.39 0.07 0.00 0.70 0.00 0.00 55.95 55.32 1x50 s SER 90 Cb 0.00 -0.17 -0.05 0.00 -1.71 0.00 0.00 66.02 64.09 1x50 s SER 90 CO 0.00 -0.56 -0.12 0.26 1.20 0.00 0.00 173.24 174.02 1x50 s TRP 91 N -3.04 1.60 0.00 3.44 0.52 -1.26 0.27 118.94 120.47 1x50 s TRP 91 Ca 0.35 -0.65 0.00 0.00 0.02 0.00 0.00 56.10 55.81 1x50 s TRP 91 Cb 0.09 -0.79 0.00 0.00 -1.15 0.00 0.00 33.47 31.62 1x50 s TRP 91 CO 0.16 0.26 0.00 0.41 0.02 0.00 0.00 176.95 177.80 1x50 n GLY 92 N -0.35 1.00 3.65 0.98 0.00 0.89 -4.71 105.19 106.64 1x50 n GLY 92 Ca -0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.12 -0.23 1.61 0.01 -1.26 -4.96 113.70 107.75 1x50 s SER 93 Ca 0.00 -0.18 -0.20 0.00 1.31 0.00 0.00 55.95 56.88 1x50 s SER 93 Cb 0.00 0.27 -0.02 0.00 0.21 0.00 0.00 66.02 66.47 1x50 s SER 93 CO 0.00 -0.48 0.60 -1.61 0.41 0.00 0.00 173.24 172.16 1x50 s GLU 94 N -2.72 4.15 -0.20 12.44 2.02 -1.26 -3.91 118.70 129.22 1x50 s GLU 94 Ca 0.12 0.54 0.01 0.00 0.02 0.00 0.00 54.97 55.66 1x50 s GLU 94 Cb 0.02 -3.61 0.04 0.00 0.10 0.00 0.00 34.13 30.68 1x50 s GLU 94 CO -0.03 -0.31 -0.13 -1.21 0.02 0.00 0.00 175.26 173.60 1x50 s GLU 95 N 2.15 2.34 -0.18 1.61 2.02 0.01 -4.90 118.70 121.75 1x50 s GLU 95 Ca 0.26 -0.94 0.01 0.00 0.02 0.00 0.00 54.97 54.33 1x50 s GLU 95 Cb -0.16 -2.54 0.02 0.00 0.10 0.00 0.00 34.13 31.55 1x50 s GLU 95 CO 0.09 -0.39 -0.19 0.15 0.02 0.00 0.00 175.26 174.94 1x50 s LYS 96 N 1.31 2.99 -0.30 1.61 1.02 -1.26 -0.61 119.74 124.50 1x50 s LYS 96 Ca -0.01 -0.83 -0.12 0.00 0.02 0.00 0.00 55.97 55.03 1x50 s LYS 96 Cb -0.16 -2.59 0.18 0.00 -0.52 0.00 0.00 37.83 34.74 1x50 s LYS 96 CO -0.09 -0.22 1.04 0.21 -0.92 0.00 0.00 175.35 175.37 1x50 s LYS 97 N 1.29 0.17 0.01 1.68 2.36 -1.26 -5.08 119.74 118.92 1x50 s LYS 97 Ca 0.05 0.24 -0.03 0.00 -2.55 0.00 0.00 55.97 53.68 1x50 s LYS 97 Cb -0.13 0.12 -0.01 0.00 -1.05 0.00 0.00 37.83 36.76 1x50 s LYS 97 CO -0.12 -0.25 0.03 -1.50 1.55 0.00 0.00 175.35 175.05 1x50 s ILE 98 N 2.95 0.10 -0.05 5.43 2.07 -1.26 -4.73 121.20 125.71 1x50 s ILE 98 Ca 0.12 -0.82 -0.13 0.00 -1.41 0.00 0.00 60.65 58.41 1x50 s ILE 98 Cb -0.06 -0.32 -0.31 0.00 0.13 0.00 0.00 42.46 41.90 1x50 s ILE 98 CO -0.17 -0.45 0.70 0.00 -1.91 0.00 0.00 174.94 173.12 1x50 h THR 99 N 4.51 1.04 -2.55 4.00 1.03 -1.87 -3.47 112.91 115.60 1x50 h THR 99 Ca -0.31 -2.52 -0.10 0.00 -0.01 0.00 0.00 66.41 63.47 1x50 h THR 99 Cb 1.20 2.82 -0.25 0.00 -1.07 0.00 0.00 68.15 70.86 1x50 h THR 99 CO 0.41 0.81 -0.21 -1.38 -0.01 0.00 0.00 175.52 175.14 1x50 s HIS 100 N -2.55 -0.63 -0.62 0.00 0.00 -1.26 -5.12 115.29 105.12 1x50 s HIS 100 Ca -0.16 1.38 -0.12 0.00 -3.00 0.00 0.00 55.06 53.16 1x50 s HIS 100 Cb 0.05 0.28 0.16 0.00 -4.00 0.00 0.00 32.58 29.06 1x50 s HIS 100 CO 0.85 -0.33 0.53 1.21 -1.00 0.00 0.00 174.74 176.00 1x50 s ASN 101 N 1.01 6.11 0.12 7.38 3.84 -1.26 -4.92 114.94 127.22 1x50 s ASN 101 Ca -0.06 -2.23 -0.13 0.00 0.21 0.00 0.00 52.86 50.65 1x50 s ASN 101 Cb -0.06 -2.11 -0.06 0.00 -0.55 0.00 0.00 41.25 38.46 1x50 s ASN 101 CO -0.09 -0.67 1.45 1.55 -2.79 0.00 0.00 177.10 176.55 1x50 h PRO 102 N 8.20 0.83 -3.87 0.43 0.13 -1.98 -3.45 132.00 132.29 1x50 h PRO 102 Ca -0.12 -0.44 -0.44 0.00 -0.87 0.00 0.00 66.00 64.13 1x50 h PRO 102 Cb 1.06 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 1x50 h PRO 102 CO 0.86 1.07 1.10 1.19 -0.23 0.00 0.00 178.00 182.00 1x50 n PHE 103 N -4.16 0.59 -4.72 1.56 3.72 -1.26 -4.88 117.46 108.32 1x50 n PHE 103 Ca -0.03 0.40 -0.24 0.00 -0.05 0.00 0.00 57.45 57.53 1x50 n PHE 103 Cb 0.51 -1.66 -0.16 0.00 -0.94 0.00 0.00 39.48 37.24 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 5.38 0.79 -0.69 1.37 0.00 -1.26 -4.69 107.32 108.22 1x50 s GLY 104 Ca 0.91 -0.62 -0.26 0.00 0.00 0.00 0.00 44.72 44.75 1x50 s GLY 104 CO 0.40 -0.38 1.89 2.56 0.00 0.00 0.00 173.10 177.57 1x50 s PRO 105 N -0.09 2.60 0.00 2.90 0.04 -1.26 -2.10 135.00 137.09 1x50 s PRO 105 Ca 0.00 0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.40 1x50 s PRO 105 Cb -0.09 -4.58 0.00 0.00 0.04 0.00 0.00 34.50 29.88 1x50 s PRO 105 CO 0.01 -2.92 0.00 0.41 0.04 0.00 0.00 177.00 174.54 1x50 n GLY 106 N 6.02 1.14 2.99 0.56 0.00 0.20 -4.63 105.19 111.46 1x50 n GLY 106 Ca 0.26 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.08 0.72 1.08 1.61 -2.07 -0.89 -5.00 119.66 115.03 1x50 s GLN 107 Ca 0.00 -0.26 -0.12 0.00 -1.82 0.00 0.00 55.36 53.16 1x50 s GLN 107 Cb 0.00 -0.69 0.24 0.00 -1.09 0.00 0.00 33.01 31.46 1x50 s GLN 107 CO 0.00 0.12 1.07 -0.06 -1.32 0.00 0.00 175.29 175.10 1x50 s PHE 108 N 0.04 1.47 -0.26 9.60 0.40 -1.26 -3.72 117.98 124.24 1x50 s PHE 108 Ca -0.00 1.37 -0.15 0.00 -0.60 0.00 0.00 56.93 57.54 1x50 s PHE 108 Cb -0.06 -3.17 0.08 0.00 0.51 0.00 0.00 43.02 40.38 1x50 s PHE 108 CO -0.00 -3.50 0.64 -0.59 0.70 0.00 0.00 175.22 172.47 1x50 s PHE 109 N -2.54 -0.97 -0.45 0.36 -0.12 -1.22 -4.83 117.98 108.22 1x50 s PHE 109 Ca 0.68 1.97 -0.12 0.00 -0.05 0.00 0.00 56.93 59.41 1x50 s PHE 109 Cb -0.24 0.55 0.08 0.00 -0.63 0.00 0.00 43.02 42.78 1x50 s PHE 109 CO 0.62 -0.49 0.33 0.34 -0.05 0.00 0.00 175.22 175.97 1x50 s ASP 110 N 1.52 5.87 -0.12 1.98 -1.08 -1.26 -3.32 116.67 120.26 1x50 s ASP 110 Ca -0.09 -1.46 -0.04 0.00 -0.52 0.00 0.00 52.55 50.44 1x50 s ASP 110 Cb -0.06 -2.08 -0.04 0.00 -1.46 0.00 0.00 42.92 39.29 1x50 s ASP 110 CO -0.18 -0.60 0.04 -0.22 0.52 0.00 0.00 175.17 174.73 1x50 s LEU 111 N 1.52 3.75 -0.17 -1.34 1.98 -0.68 -1.45 118.68 122.28 1x50 s LEU 111 Ca 0.04 0.16 -0.04 0.00 -2.89 0.00 0.00 54.13 51.40 1x50 s LEU 111 Cb -0.24 -1.90 0.08 0.00 0.66 0.00 0.00 46.19 44.80 1x50 s LEU 111 CO 0.04 0.31 0.22 -0.44 -1.89 0.00 0.00 176.35 174.59 1x50 s SER 112 N -0.48 1.09 -0.04 3.68 0.01 -0.76 0.10 113.70 117.31 1x50 s SER 112 Ca 0.09 0.02 -0.12 0.00 1.31 0.00 0.00 55.95 57.25 1x50 s SER 112 Cb -0.12 0.42 -0.05 0.00 0.21 0.00 0.00 66.02 66.48 1x50 s SER 112 CO 0.02 -0.30 0.32 -0.63 0.41 0.00 0.00 173.24 173.06 1x50 s ILE 113 N 2.34 5.18 -0.08 1.44 1.09 0.21 -0.13 121.20 131.26 1x50 s ILE 113 Ca 0.05 0.63 0.02 0.00 -1.10 0.00 0.00 60.65 60.25 1x50 s ILE 113 Cb -0.14 -3.61 -0.03 0.00 -1.06 0.00 0.00 42.46 37.62 1x50 s ILE 113 CO -0.10 0.59 -0.11 -0.13 -0.10 0.00 0.00 174.94 175.08 1x50 s ARG 114 N -1.07 2.80 -0.29 2.79 0.52 -0.13 0.48 118.95 124.05 1x50 s ARG 114 Ca 0.21 -0.64 -0.06 0.00 -0.52 0.00 0.00 55.73 54.72 1x50 s ARG 114 Cb -0.15 -2.51 0.02 0.00 0.52 0.00 0.00 34.95 32.82 1x50 s ARG 114 CO 0.10 0.54 0.05 0.00 0.02 0.00 0.00 175.30 176.01 1x50 n GLY 116 N 4.81 3.15 0.00 0.00 0.00 -1.22 -3.68 105.19 108.26 1x50 n GLY 116 Ca -0.15 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 2.51 0.06 0.99 4.77 -1.26 -4.12 117.00 119.95 1x50 n LEU 117 Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.79 1x50 n LEU 117 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1x50 n LEU 117 CO 0.00 0.42 -0.46 -2.24 -1.33 0.00 0.00 177.39 173.78 1x50 h ASP 118 N 0.00 0.45 -5.68 -1.43 2.03 -1.99 -3.49 116.42 106.30 1x50 h ASP 118 Ca 0.00 -0.68 0.29 0.00 -0.73 0.00 0.00 57.03 55.91 1x50 h ASP 118 Cb 0.92 -0.15 -0.10 0.00 -0.83 0.00 0.00 39.33 39.18 1x50 h ASP 118 CO 0.00 1.58 0.77 0.00 -1.03 0.00 0.00 179.24 180.56 1x50 s ARG 119 N -2.60 0.61 0.28 4.15 1.70 -1.26 -4.23 118.95 117.60 1x50 s ARG 119 Ca -0.12 -0.36 -0.04 0.00 -0.47 0.00 0.00 55.73 54.74 1x50 s ARG 119 Cb 0.06 0.19 -0.05 0.00 -0.57 0.00 0.00 34.95 34.59 1x50 s ARG 119 CO 0.84 -0.28 0.52 -0.06 -1.08 0.00 0.00 175.30 175.24 1x50 s PHE 120 N -2.46 3.48 -0.30 5.89 0.40 -0.98 -3.38 117.98 120.63 1x50 s PHE 120 Ca 0.17 0.56 0.00 0.00 -0.60 0.00 0.00 56.93 57.06 1x50 s PHE 120 Cb 0.02 -2.04 0.09 0.00 0.51 0.00 0.00 43.02 41.61 1x50 s PHE 120 CO -0.01 0.21 0.06 0.15 0.70 0.00 0.00 175.22 176.33 1x50 s LYS 121 N -3.57 0.98 0.02 0.44 1.02 -0.53 -2.81 119.74 115.29 1x50 s LYS 121 Ca 0.42 -1.17 -0.20 0.00 0.02 0.00 0.00 55.97 55.05 1x50 s LYS 121 Cb -0.11 -2.31 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 1x50 s LYS 121 CO 0.30 -0.90 0.57 0.08 -0.92 0.00 0.00 175.35 174.49 1x50 s VAL 122 N 1.47 4.86 0.17 3.17 1.01 -0.73 -0.96 120.40 129.40 1x50 s VAL 122 Ca 0.07 1.21 0.11 0.00 0.00 0.00 0.00 61.98 63.37 1x50 s VAL 122 Cb -0.18 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1x50 s VAL 122 CO -0.18 0.47 -0.25 -0.31 0.00 0.00 0.00 175.10 174.83 1x50 s TYR 123 N -0.52 2.28 -0.22 5.22 1.51 0.82 -0.25 117.35 126.19 1x50 s TYR 123 Ca 0.30 -0.37 -0.03 0.00 -1.01 0.00 0.00 57.07 55.95 1x50 s TYR 123 Cb -0.18 -1.16 0.07 0.00 -0.11 0.00 0.00 41.96 40.58 1x50 s TYR 123 CO 0.17 0.44 0.07 0.00 -1.11 0.00 0.00 175.55 175.13 1x50 s ALA 124 N -1.50 0.86 -1.39 3.71 0.00 0.17 -1.82 121.76 121.78 1x50 s ALA 124 Ca 0.18 -0.78 -0.08 0.00 0.00 0.00 0.00 51.96 51.29 1x50 s ALA 124 Cb -0.08 -1.23 0.05 0.00 0.00 0.00 0.00 23.12 21.85 1x50 s ALA 124 CO 0.08 -1.31 0.56 0.09 0.00 0.00 0.00 175.76 175.18 1x50 n ASN 125 N 5.12 -4.68 0.00 0.00 3.02 -0.53 -1.12 115.26 117.06 1x50 n ASN 125 Ca -0.07 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 1x50 n ASN 125 Cb 0.46 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 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 -1.33 0.69 2.70 7.41 0.00 -1.26 -5.06 105.19 108.34 1x50 n GLY 126 Ca -0.05 -0.72 -0.20 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.25 -0.05 -0.55 1.61 -1.52 -0.28 -5.09 119.66 110.53 1x50 s GLN 127 Ca 0.00 0.40 -0.30 0.00 -1.95 0.00 0.00 55.36 53.51 1x50 s GLN 127 Cb 0.00 -0.52 -0.12 0.00 -0.22 0.00 0.00 33.01 32.15 1x50 s GLN 127 CO 0.00 -0.34 2.40 1.58 -0.25 0.00 0.00 175.29 178.68 1x50 n HIS 128 N 5.30 1.30 0.08 0.91 -0.00 -1.26 0.46 115.22 122.01 1x50 n HIS 128 Ca -0.04 0.22 -0.03 0.00 -0.00 0.00 0.00 57.72 57.88 1x50 n HIS 128 Cb 0.50 -2.54 -0.01 0.00 -0.00 0.00 0.00 29.99 27.93 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 15.14 -0.17 -7.95 0.27 5.85 -0.91 -3.45 115.31 124.09 1x50 h LEU 129 Ca -0.21 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1x50 h LEU 129 Cb 1.30 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.35 1x50 h LEU 129 CO 1.16 -0.08 0.40 0.72 -0.34 0.00 0.00 178.44 180.30 1x50 s PHE 130 N -2.77 0.05 0.12 1.25 -0.12 -1.21 -3.53 117.98 111.76 1x50 s PHE 130 Ca -0.03 -0.56 0.10 0.00 -0.05 0.00 0.00 56.93 56.39 1x50 s PHE 130 Cb 0.00 0.76 -0.04 0.00 -0.63 0.00 0.00 43.02 43.11 1x50 s PHE 130 CO 0.09 -1.23 -0.22 0.16 -0.05 0.00 0.00 175.22 173.97 1x50 s ASP 131 N -3.16 3.62 -0.31 1.98 1.47 -1.26 -1.77 116.67 117.24 1x50 s ASP 131 Ca 0.17 -0.65 0.01 0.00 1.18 0.00 0.00 52.55 53.26 1x50 s ASP 131 Cb -0.04 -0.39 0.07 0.00 -0.34 0.00 0.00 42.92 42.22 1x50 s ASP 131 CO 0.08 0.18 -0.00 0.12 0.68 0.00 0.00 175.17 176.23 1x50 s PHE 132 N -1.10 3.39 0.25 2.11 5.36 -1.13 -4.96 117.98 121.91 1x50 s PHE 132 Ca 0.16 -2.29 -0.31 0.00 -0.96 0.00 0.00 56.93 53.54 1x50 s PHE 132 Cb -0.10 -2.33 -0.11 0.00 -0.34 0.00 0.00 43.02 40.14 1x50 s PHE 132 CO 0.08 -0.87 1.57 0.00 -1.46 0.00 0.00 175.22 174.53 1x50 s ALA 133 N 1.13 3.75 -0.20 11.12 0.00 -1.26 -2.31 121.76 133.98 1x50 s ALA 133 Ca -0.02 1.48 -0.28 0.00 0.00 0.00 0.00 51.96 53.13 1x50 s ALA 133 Cb -0.20 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.24 1x50 s ALA 133 CO -0.04 -0.88 2.21 -1.01 0.00 0.00 0.00 175.76 176.04 1x50 s HIS 134 N 0.35 1.16 -0.23 0.00 0.09 -1.26 -4.84 115.29 110.56 1x50 s HIS 134 Ca 0.65 0.46 -0.18 0.00 -0.00 0.00 0.00 55.06 56.00 1x50 s HIS 134 Cb -0.46 -3.95 -0.14 0.00 -0.00 0.00 0.00 32.58 28.03 1x50 s HIS 134 CO 0.42 -4.22 -0.05 0.54 -0.00 0.00 0.00 174.74 171.43 1x50 n ARG 135 N 8.68 0.56 -3.27 1.40 1.74 -1.26 -4.83 116.66 119.68 1x50 n ARG 135 Ca 0.29 0.44 -0.43 0.00 -0.77 0.00 0.00 57.85 57.38 1x50 n ARG 135 Cb 0.45 -1.64 -0.08 0.00 -1.02 0.00 0.00 32.46 30.17 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 -7.78 4.94 0.47 0.55 2.96 -1.26 -4.93 118.68 113.62 1x50 s LEU 136 Ca -0.31 -0.78 0.26 0.00 -0.22 0.00 0.00 54.13 53.08 1x50 s LEU 136 Cb 0.09 -2.41 1.29 0.00 0.50 0.00 0.00 46.19 45.66 1x50 s LEU 136 CO 0.51 -0.68 1.81 -1.28 -1.32 0.00 0.00 176.35 175.39 1x50 h SER 137 N 8.81 0.24 -0.10 3.68 0.87 -2.01 0.61 113.55 125.65 1x50 h SER 137 Ca -0.27 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.30 1x50 h SER 137 Cb 1.11 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.05 1x50 h SER 137 CO 0.85 0.05 0.05 0.00 -0.53 0.00 0.00 176.83 177.25 1x50 n ALA 138 N -2.60 2.79 -0.32 6.23 0.00 -1.26 -4.40 120.51 120.95 1x50 n ALA 138 Ca 0.23 -0.30 0.19 0.00 0.00 0.00 0.00 53.44 53.56 1x50 n ALA 138 Cb 0.97 -1.04 0.39 0.00 0.00 0.00 0.00 19.45 19.78 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 0.71 -0.96 0.00 -0.00 -0.12 0.40 116.94 117.26 1x50 h PHE 139 Ca 0.05 0.04 0.21 0.00 -0.00 0.00 0.00 57.97 58.27 1x50 h PHE 139 Cb 1.00 -0.16 -0.11 0.00 -0.00 0.00 0.00 35.95 36.67 1x50 h PHE 139 CO 0.17 -0.16 0.53 -0.56 -0.00 0.00 0.00 178.31 178.29 1x50 h GLN 140 N 0.31 0.58 -0.99 6.09 3.07 -1.77 0.17 115.11 122.58 1x50 h GLN 140 Ca 0.65 -0.04 0.10 0.00 0.09 0.00 0.00 58.65 59.46 1x50 h GLN 140 Cb 1.40 -0.13 -0.08 0.00 0.08 0.00 0.00 27.48 28.75 1x50 h GLN 140 CO -0.61 0.39 0.63 0.00 0.09 0.00 0.00 178.83 179.33 1x50 h ARG 141 N 0.60 1.00 -5.75 0.06 3.08 -0.49 -2.77 114.38 110.12 1x50 h ARG 141 Ca 0.58 -0.06 -0.63 0.00 0.07 0.00 0.00 59.98 59.94 1x50 h ARG 141 Cb 1.01 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 1x50 h ARG 141 CO -0.44 0.66 1.49 0.28 -1.07 0.00 0.00 179.97 180.90 1x50 n VAL 142 N -4.57 0.08 -2.28 2.04 0.31 0.61 -4.40 118.33 110.12 1x50 n VAL 142 Ca 0.18 -0.23 -0.01 0.00 -0.01 0.00 0.00 64.34 64.26 1x50 n VAL 142 Cb 0.31 -1.37 0.07 0.00 -0.91 0.00 0.00 33.84 31.93 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 10.35 1.97 -3.63 4.52 5.68 -1.19 -1.30 116.55 132.96 1x50 n ASP 143 Ca 0.48 -2.76 -0.21 0.00 -0.50 0.00 0.00 54.79 51.80 1x50 n ASP 143 Cb 0.18 -0.41 -0.16 0.00 -1.14 0.00 0.00 41.12 39.59 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 -2.47 -0.16 -0.33 2.12 2.01 -0.26 -2.04 115.64 114.51 1x50 s THR 144 Ca 0.36 0.14 -0.03 0.00 0.31 0.00 0.00 61.69 62.48 1x50 s THR 144 Cb 0.37 -0.39 0.06 0.00 0.01 0.00 0.00 72.50 72.55 1x50 s THR 144 CO -0.08 -0.03 0.06 -0.22 -0.69 0.00 0.00 174.62 173.65 1x50 s LEU 145 N 2.21 4.23 0.12 4.42 2.96 -0.46 -1.01 118.68 131.14 1x50 s LEU 145 Ca 0.04 -1.41 0.07 0.00 -0.22 0.00 0.00 54.13 52.62 1x50 s LEU 145 Cb -0.14 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1x50 s LEU 145 CO -0.07 -0.33 -0.10 -1.83 -1.32 0.00 0.00 176.35 172.71 1x50 s GLU 146 N 1.25 2.13 -0.21 1.98 -1.05 -0.90 -0.04 118.70 121.86 1x50 s GLU 146 Ca -0.02 -1.06 -0.04 0.00 -0.15 0.00 0.00 54.97 53.70 1x50 s GLU 146 Cb -0.20 -2.29 0.07 0.00 -0.44 0.00 0.00 34.13 31.27 1x50 s GLU 146 CO -0.01 0.50 0.09 0.42 0.95 0.00 0.00 175.26 177.20 1x50 s ILE 147 N -1.30 0.11 0.46 1.83 1.01 -0.81 -2.23 121.20 120.28 1x50 s ILE 147 Ca 0.22 -0.47 0.06 0.00 0.00 0.00 0.00 60.65 60.45 1x50 s ILE 147 Cb -0.11 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.49 1x50 s ILE 147 CO 0.14 -0.40 0.16 0.00 0.00 0.00 0.00 174.94 174.84 1x50 s GLN 148 N 2.03 2.18 0.00 2.79 0.00 -0.80 -2.11 119.66 123.77 1x50 s GLN 148 Ca 0.04 -2.04 0.00 0.00 -0.00 0.00 0.00 55.36 53.36 1x50 s GLN 148 Cb -0.16 -1.85 0.00 0.00 0.00 0.00 0.00 33.01 30.99 1x50 s GLN 148 CO -0.17 -0.25 0.00 0.41 0.00 0.00 0.00 175.29 175.29 1x50 n GLY 149 N -1.30 0.31 3.11 2.60 0.00 -1.26 -0.77 105.19 107.88 1x50 n GLY 149 Ca -0.06 -1.84 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 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 5.28 -0.16 1.61 1.01 -0.79 -4.91 116.67 114.71 1x50 s ASP 150 Ca 0.00 -2.67 -0.13 0.00 0.71 0.00 0.00 52.55 50.46 1x50 s ASP 150 Cb 0.00 -1.86 0.04 0.00 1.01 0.00 0.00 42.92 42.11 1x50 s ASP 150 CO 0.00 -0.41 0.41 0.54 0.21 0.00 0.00 175.17 175.91 1x50 s VAL 151 N 0.21 -0.01 -0.72 -1.27 0.11 -1.26 -3.86 120.40 113.60 1x50 s VAL 151 Ca 0.15 0.02 -0.15 0.00 -2.93 0.00 0.00 61.98 59.07 1x50 s VAL 151 Cb -0.21 -0.57 0.18 0.00 -1.53 0.00 0.00 36.38 34.25 1x50 s VAL 151 CO -0.04 0.01 0.68 -0.89 -3.33 0.00 0.00 175.10 171.53 1x50 s THR 152 N 0.44 5.43 0.23 5.04 2.01 -0.94 -4.94 115.64 122.92 1x50 s THR 152 Ca -0.02 -2.06 -0.30 0.00 0.31 0.00 0.00 61.69 59.62 1x50 s THR 152 Cb -0.04 -4.43 -0.09 0.00 0.01 0.00 0.00 72.50 67.95 1x50 s THR 152 CO -0.02 -0.98 1.10 -0.76 -0.69 0.00 0.00 174.62 173.27 1x50 s LEU 153 N 0.80 4.52 -0.00 4.42 1.43 -1.26 -0.23 118.68 128.36 1x50 s LEU 153 Ca 0.13 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 1x50 s LEU 153 Cb -0.18 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.43 1x50 s LEU 153 CO -0.04 -0.18 -0.00 -1.20 0.23 0.00 0.00 176.35 175.15 1x50 n SER 154 N 1.80 4.05 -3.75 2.29 7.64 -0.03 -4.03 113.62 121.59 1x50 n SER 154 Ca 0.01 -0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 1x50 n SER 154 Cb 0.45 0.03 -0.12 0.00 -1.01 0.00 0.00 64.21 63.57 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 -2.01 -0.36 -0.18 1.43 6.14 -0.13 -1.28 117.35 120.97 1x50 s TYR 155 Ca -0.00 0.85 -0.05 0.00 0.64 0.00 0.00 57.07 58.51 1x50 s TYR 155 Cb 0.00 0.11 0.06 0.00 0.42 0.00 0.00 41.96 42.56 1x50 s TYR 155 CO 0.01 -0.21 0.10 0.08 0.64 0.00 0.00 175.55 176.17 1x50 s VAL 156 N 0.68 -0.10 -0.04 3.14 1.01 -1.25 -1.04 120.40 122.80 1x50 s VAL 156 Ca -0.04 -0.19 0.06 0.00 0.00 0.00 0.00 61.98 61.81 1x50 s VAL 156 Cb -0.06 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.72 1x50 s VAL 156 CO -0.04 -0.30 -0.23 -1.58 0.00 0.00 0.00 175.10 172.94 1x50 s GLN 157 N 2.14 2.25 -0.73 2.72 0.74 -1.22 -2.82 119.66 122.74 1x50 s GLN 157 Ca 0.03 -0.84 -0.11 0.00 0.05 0.00 0.00 55.36 54.49 1x50 s GLN 157 Cb -0.16 -1.98 0.19 0.00 1.10 0.00 0.00 33.01 32.16 1x50 s GLN 157 CO -0.11 0.39 0.64 0.42 -0.55 0.00 0.00 175.29 176.08 1x50 s ILE 158 N -0.24 5.00 0.53 -2.34 1.01 -1.26 -2.71 121.20 121.20 1x50 s ILE 158 Ca -0.00 -2.49 -0.19 0.00 0.00 0.00 0.00 60.65 57.96 1x50 s ILE 158 Cb -0.12 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.14 1x50 s ILE 158 CO 0.02 -0.96 1.08 -0.44 0.00 0.00 0.00 174.94 174.64 1x50 s SER 159 N 1.90 5.96 0.00 3.58 0.01 -0.58 -4.94 113.70 119.64 1x50 s SER 159 Ca 0.16 2.01 0.00 0.00 1.31 0.00 0.00 55.95 59.43 1x50 s SER 159 Cb -0.15 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.51 1x50 s SER 159 CO -0.06 -1.05 0.00 0.61 0.41 0.00 0.00 173.24 173.15 1x50 n GLY 160 N -0.20 -0.57 3.77 3.44 0.00 -1.26 -1.41 105.19 108.95 1x50 n GLY 160 Ca 0.10 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.92 2.21 -0.69 1.61 0.04 -1.23 -5.01 135.00 131.01 1x50 s PRO 161 Ca 0.00 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.21 1x50 s PRO 161 Cb 0.00 -1.89 0.17 0.00 0.04 0.00 0.00 34.50 32.82 1x50 s PRO 161 CO 0.00 -1.67 0.49 0.45 0.04 0.00 0.00 177.00 176.31 1x50 s SER 162 N -3.40 5.01 -0.02 6.66 0.15 -1.26 -5.07 113.70 115.77 1x50 s SER 162 Ca 0.61 -3.47 -0.30 0.00 0.70 0.00 0.00 55.95 53.49 1x50 s SER 162 Cb -0.17 -1.73 -0.04 0.00 -1.71 0.00 0.00 66.02 62.37 1x50 s SER 162 CO 0.56 -0.18 1.19 -0.55 1.20 0.00 0.00 173.24 175.46 1x50 s SER 163 N -0.57 7.08 0.00 5.45 0.15 -1.26 -5.35 113.70 119.19 1x50 s SER 163 Ca 0.22 1.87 0.15 0.00 0.70 0.00 0.00 55.95 58.88 1x50 s SER 163 Cb -0.13 -2.56 0.87 0.00 -1.71 0.00 0.00 66.02 62.48 1x50 s SER 163 CO -0.10 -0.53 1.29 0.61 1.20 0.00 0.00 173.24 175.71