#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vam s ASP 2 N 0.00 4.72 -0.24 0.00 1.01 -1.26 -5.02 116.67 115.88 1vam s ASP 2 Ca 0.00 1.80 -0.09 0.00 0.71 0.00 0.00 52.55 54.97 1vam s ASP 2 Cb 0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 1vam s ASP 2 CO 0.00 -1.89 0.12 -0.89 0.21 0.00 0.00 175.17 172.72 1vam s THR 3 N -2.88 4.85 0.03 -1.27 2.01 -1.26 -5.02 115.64 112.11 1vam s THR 3 Ca 0.61 0.01 0.08 0.00 0.31 0.00 0.00 61.69 62.70 1vam s THR 3 Cb -0.17 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 1vam s THR 3 CO 0.54 0.34 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.95 1vam s ILE 4 N 1.31 2.34 -0.20 1.82 -1.09 -1.26 -3.59 121.20 120.53 1vam s ILE 4 Ca 0.06 -1.26 -0.05 0.00 -2.23 0.00 0.00 60.65 57.17 1vam s ILE 4 Cb -0.15 -1.92 0.07 0.00 -1.58 0.00 0.00 42.46 38.89 1vam s ILE 4 CO 0.05 0.40 0.11 -0.69 -1.23 0.00 0.00 174.94 173.59 1vam s VAL 5 N -0.80 -0.11 0.10 2.92 1.01 -0.90 -0.30 120.40 122.32 1vam s VAL 5 Ca 0.12 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.86 1vam s VAL 5 Cb -0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1vam s VAL 5 CO 0.02 -0.36 -0.09 0.00 0.00 0.00 0.00 175.10 174.68 1vam s ALA 6 N 2.15 1.07 -0.27 5.51 0.00 -0.33 -1.24 121.76 128.64 1vam s ALA 6 Ca 0.04 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 1vam s ALA 6 Cb -0.16 0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.08 1vam s ALA 6 CO -0.15 -0.11 -0.04 0.08 0.00 0.00 0.00 175.76 175.53 1vam s VAL 7 N -2.90 2.84 -0.01 0.00 1.01 -0.33 -0.16 120.40 120.86 1vam s VAL 7 Ca 0.08 -1.24 -0.08 0.00 0.00 0.00 0.00 61.98 60.74 1vam s VAL 7 Cb 0.00 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 1vam s VAL 7 CO -0.02 0.05 0.28 -1.83 0.00 0.00 0.00 175.10 173.58 1vam s GLU 8 N 1.27 3.62 -0.66 2.72 -1.05 0.22 -1.85 118.70 122.97 1vam s GLU 8 Ca -0.03 0.01 -0.03 0.00 -0.15 0.00 0.00 54.97 54.77 1vam s GLU 8 Cb -0.18 -3.11 0.17 0.00 -0.44 0.00 0.00 34.13 30.57 1vam s GLU 8 CO -0.03 0.67 0.49 -0.51 0.95 0.00 0.00 175.26 176.82 1vam s LEU 9 N -1.57 5.31 -0.48 1.83 1.02 0.28 -0.76 118.68 124.31 1vam s LEU 9 Ca 0.26 -2.96 -0.21 0.00 0.02 0.00 0.00 54.13 51.23 1vam s LEU 9 Cb -0.14 -1.87 0.04 0.00 0.02 0.00 0.00 46.19 44.24 1vam s LEU 9 CO 0.14 -0.35 0.72 -0.62 0.02 0.00 0.00 176.35 176.26 1vam s ASP 10 N 0.59 6.32 0.26 2.29 -1.08 0.90 -1.92 116.67 124.03 1vam s ASP 10 Ca 0.18 -0.45 0.15 0.00 -0.52 0.00 0.00 52.55 51.92 1vam s ASP 10 Cb -0.19 -2.35 0.05 0.00 -1.46 0.00 0.00 42.92 38.98 1vam s ASP 10 CO -0.04 -0.92 1.38 0.71 0.52 0.00 0.00 175.17 176.81 1vam h THR 11 N 5.92 0.79 -3.25 1.71 1.35 -1.77 -0.83 112.91 116.83 1vam h THR 11 Ca -0.26 -2.15 -0.66 0.00 -0.55 0.00 0.00 66.41 62.79 1vam h THR 11 Cb 1.09 2.36 -0.31 0.00 -1.73 0.00 0.00 68.15 69.56 1vam h THR 11 CO 0.96 0.45 -0.80 -0.47 -0.25 0.00 0.00 175.52 175.42 1vam s TYR 12 N -2.97 2.83 -0.78 4.73 6.14 -1.24 -4.48 117.35 121.58 1vam s TYR 12 Ca 0.03 -1.19 -0.26 0.00 0.64 0.00 0.00 57.07 56.30 1vam s TYR 12 Cb 0.08 -1.96 0.02 0.00 0.42 0.00 0.00 41.96 40.51 1vam s TYR 12 CO 0.75 -0.59 1.48 -2.14 0.64 0.00 0.00 175.55 175.69 1vam s PRO 13 N 1.14 3.11 -1.17 4.97 0.02 -1.26 -4.93 135.00 136.88 1vam s PRO 13 Ca 0.01 -0.26 -0.08 0.00 0.02 0.00 0.00 61.00 60.69 1vam s PRO 13 Cb -0.14 -4.53 0.24 0.00 0.02 0.00 0.00 34.50 30.08 1vam s PRO 13 CO -0.05 -2.37 1.49 0.09 -0.33 0.00 0.00 177.00 175.83 1vam n ASN 14 N 10.31 5.64 -0.25 2.53 4.13 -1.26 -4.87 115.26 131.49 1vam n ASN 14 Ca 0.15 -3.16 0.18 0.00 1.68 0.00 0.00 54.58 53.43 1vam n ASN 14 Cb 0.50 -1.41 0.48 0.00 -1.54 0.00 0.00 39.78 37.81 1vam n ASN 14 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1vam h THR 15 N 3.79 0.70 0.00 3.41 1.35 -1.87 -1.27 112.91 119.02 1vam h THR 15 Ca 0.27 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.97 1vam h THR 15 Cb 0.73 0.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.34 1vam h THR 15 CO 1.32 0.08 0.18 -2.24 -0.25 0.00 0.00 175.52 174.62 1vam h ASP 16 N 0.46 0.00 0.00 5.36 2.03 -1.89 -1.66 116.42 120.72 1vam h ASP 16 Ca 0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.77 1vam h ASP 16 Cb 1.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.60 1vam h ASP 16 CO -0.20 0.00 0.00 2.30 -1.03 0.00 0.00 179.24 180.31 1vam n ILE 17 N -2.54 0.20 0.00 4.15 -5.35 -0.50 -5.02 119.36 110.30 1vam n ILE 17 Ca -0.02 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 1vam n ILE 17 Cb 0.22 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 1vam n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vam n GLY 18 N -0.10 1.59 3.72 3.28 0.00 -0.62 -4.76 105.19 108.30 1vam n GLY 18 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1vam n GLY 18 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vam n ASP 19 N 0.00 3.86 -4.73 1.61 8.00 -1.12 -4.90 116.55 119.27 1vam n ASP 19 Ca 0.00 1.10 -0.32 0.00 0.71 0.00 0.00 54.79 56.28 1vam n ASP 19 Cb 0.00 -1.57 0.11 0.00 -0.02 0.00 0.00 41.12 39.65 1vam n ASP 19 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1vam s PRO 20 N 0.49 1.83 0.00 -0.24 0.02 -1.26 -3.64 135.00 132.20 1vam s PRO 20 Ca 0.71 1.44 0.00 0.00 0.02 0.00 0.00 61.00 63.17 1vam s PRO 20 Cb -0.52 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.17 1vam s PRO 20 CO 0.39 -2.00 0.94 -1.13 -0.33 0.00 0.00 177.00 174.87 1vam n SER 21 N -3.53 2.53 -3.53 2.53 3.41 -1.26 -4.55 113.62 109.22 1vam n SER 21 Ca 0.11 -1.61 -0.08 0.00 -0.26 0.00 0.00 58.87 57.03 1vam n SER 21 Cb 0.52 -0.52 -0.02 0.00 -0.26 0.00 0.00 64.21 63.92 1vam n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1vam s TYR 22 N 0.92 -0.30 0.74 7.33 -0.85 -1.26 -5.01 117.35 118.93 1vam s TYR 22 Ca 0.00 0.21 -0.15 0.00 -0.52 0.00 0.00 57.07 56.61 1vam s TYR 22 Cb 0.00 0.53 0.04 0.00 0.38 0.00 0.00 41.96 42.91 1vam s TYR 22 CO 0.00 -0.46 1.24 -2.14 -1.52 0.00 0.00 175.55 172.68 1vam s PRO 23 N -2.84 2.01 0.27 -3.49 0.02 -1.26 -4.64 135.00 125.07 1vam s PRO 23 Ca 0.06 1.88 -0.21 0.00 0.02 0.00 0.00 61.00 62.75 1vam s PRO 23 Cb -0.01 -1.80 0.02 0.00 0.02 0.00 0.00 34.50 32.73 1vam s PRO 23 CO -0.07 -1.96 0.70 -3.38 -0.33 0.00 0.00 177.00 171.95 1vam s HIS 24 N -1.84 -0.19 -0.11 6.54 -3.43 -0.32 -1.64 115.29 114.30 1vam s HIS 24 Ca 0.77 -0.25 -0.01 0.00 -0.80 0.00 0.00 55.06 54.77 1vam s HIS 24 Cb -0.32 0.67 -0.03 0.00 -1.43 0.00 0.00 32.58 31.48 1vam s HIS 24 CO 0.46 -1.20 -0.07 0.96 -2.00 0.00 0.00 174.74 172.89 1vam s ILE 25 N -3.91 3.64 0.08 -5.38 -4.36 -0.81 -0.07 121.20 110.38 1vam s ILE 25 Ca 0.11 -0.47 -0.03 0.00 -0.26 0.00 0.00 60.65 59.99 1vam s ILE 25 Cb -0.05 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 41.09 1vam s ILE 25 CO 0.06 0.55 0.04 -0.83 0.24 0.00 0.00 174.94 175.00 1vam s GLY 26 N -0.18 0.48 -0.27 6.27 0.00 0.06 -1.29 107.32 112.39 1vam s GLY 26 Ca 0.02 -1.11 -0.02 0.00 0.00 0.00 0.00 44.72 43.61 1vam s GLY 26 CO 0.03 -1.20 -0.03 -0.42 0.00 0.00 0.00 173.10 171.49 1vam s ILE 27 N -3.93 2.99 -0.16 0.90 1.01 -0.31 -0.61 121.20 121.09 1vam s ILE 27 Ca 0.10 -1.16 -0.09 0.00 0.00 0.00 0.00 60.65 59.49 1vam s ILE 27 Cb 0.07 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 1vam s ILE 27 CO -0.08 0.06 0.16 -1.81 0.00 0.00 0.00 174.94 173.27 1vam s ASP 28 N 1.30 6.32 -0.36 3.58 1.01 0.78 -0.49 116.67 128.80 1vam s ASP 28 Ca -0.02 0.37 0.00 0.00 0.71 0.00 0.00 52.55 53.61 1vam s ASP 28 Cb -0.18 -2.10 0.12 0.00 1.01 0.00 0.00 42.92 41.77 1vam s ASP 28 CO -0.03 0.26 0.16 -0.63 0.21 0.00 0.00 175.17 175.15 1vam s ILE 29 N -0.17 1.01 -1.64 0.77 1.01 -1.26 -1.19 121.20 119.72 1vam s ILE 29 Ca 0.12 -1.88 -0.01 0.00 0.00 0.00 0.00 60.65 58.87 1vam s ILE 29 Cb -0.12 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 40.62 1vam s ILE 29 CO 0.01 -0.80 0.15 0.29 0.00 0.00 0.00 174.94 174.59 1vam n LYS 30 N 4.25 -2.36 -3.59 2.79 5.02 0.59 -4.95 118.16 119.91 1vam n LYS 30 Ca 0.04 0.94 -0.09 0.00 -2.02 0.00 0.00 58.31 57.18 1vam n LYS 30 Cb 0.38 -5.58 -0.05 0.00 -0.02 0.00 0.00 35.03 29.77 1vam n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1vam s SER 31 N -2.26 -0.30 0.21 4.39 0.15 -1.26 -4.97 113.70 109.66 1vam s SER 31 Ca 0.07 0.34 0.26 0.00 0.70 0.00 0.00 55.95 57.32 1vam s SER 31 Cb -0.03 0.26 0.85 0.00 -1.71 0.00 0.00 66.02 65.39 1vam s SER 31 CO 0.09 -0.27 1.77 0.55 1.20 0.00 0.00 173.24 176.58 1vam n VAL 32 N 0.73 0.62 -2.79 4.45 3.14 -1.26 -4.48 118.33 118.74 1vam n VAL 32 Ca -0.08 -0.19 -0.43 0.00 -2.96 0.00 0.00 64.34 60.68 1vam n VAL 32 Cb 0.58 -0.68 -0.03 0.00 -1.06 0.00 0.00 33.84 32.64 1vam n VAL 32 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1vam s ARG 33 N -3.14 3.22 0.20 1.45 3.00 -1.26 -4.98 118.95 117.44 1vam s ARG 33 Ca 0.10 -0.85 -0.31 0.00 0.00 0.00 0.00 55.73 54.66 1vam s ARG 33 Cb 0.12 -4.38 -0.15 0.00 0.00 0.00 0.00 34.95 30.54 1vam s ARG 33 CO 0.56 -1.90 1.08 0.43 0.00 0.00 0.00 175.30 175.46 1vam n SER 34 N 7.97 1.14 0.19 0.23 7.64 -1.26 -4.77 113.62 124.77 1vam n SER 34 Ca 0.03 1.15 0.07 0.00 1.01 0.00 0.00 58.87 61.13 1vam n SER 34 Cb 0.47 -1.21 0.35 0.00 -1.01 0.00 0.00 64.21 62.80 1vam n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1vam h LYS 35 N 2.83 0.00 -2.77 1.43 1.79 -1.15 -3.45 116.57 115.25 1vam h LYS 35 Ca -0.41 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 57.98 1vam h LYS 35 Cb 1.35 0.00 -0.18 0.00 -1.58 0.00 0.00 32.23 31.82 1vam h LYS 35 CO 0.66 0.33 -0.05 0.15 -1.08 0.00 0.00 179.45 179.47 1vam s LYS 36 N -3.56 0.92 0.33 3.15 1.02 -1.24 -5.02 119.74 115.34 1vam s LYS 36 Ca 0.01 -0.17 -0.02 0.00 0.02 0.00 0.00 55.97 55.80 1vam s LYS 36 Cb 0.10 0.42 -0.00 0.00 -0.52 0.00 0.00 37.83 37.83 1vam s LYS 36 CO 0.68 -0.30 0.45 0.95 -0.92 0.00 0.00 175.35 176.20 1vam s THR 37 N -1.97 0.00 -0.28 2.17 -4.23 -1.26 -1.16 115.64 108.91 1vam s THR 37 Ca -0.08 -1.63 -0.16 0.00 -1.18 0.00 0.00 61.69 58.64 1vam s THR 37 Cb -0.02 -2.60 0.10 0.00 1.34 0.00 0.00 72.50 71.32 1vam s THR 37 CO 0.02 0.00 0.79 0.00 -0.54 0.00 0.00 174.62 174.88 1vam s ALA 38 N -3.16 -2.00 0.34 3.99 0.00 -0.41 -4.97 121.76 115.55 1vam s ALA 38 Ca 0.31 2.34 -0.27 0.00 0.00 0.00 0.00 51.96 54.34 1vam s ALA 38 Cb 0.00 -1.51 -0.13 0.00 0.00 0.00 0.00 23.12 21.48 1vam s ALA 38 CO 0.20 -0.37 1.04 1.17 0.00 0.00 0.00 175.76 177.80 1vam n LYS 39 N 4.05 1.45 -4.11 0.00 4.81 -1.26 -1.93 118.16 121.17 1vam n LYS 39 Ca -0.19 0.51 -0.22 0.00 -0.87 0.00 0.00 58.31 57.55 1vam n LYS 39 Cb 0.58 -1.97 -0.17 0.00 0.02 0.00 0.00 35.03 33.50 1vam n LYS 39 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 1vam s TRP 40 N -1.14 0.87 -1.22 5.64 -0.00 -0.65 -4.76 118.94 117.68 1vam s TRP 40 Ca 0.59 -0.28 -0.10 0.00 -0.00 0.00 0.00 56.10 56.32 1vam s TRP 40 Cb -0.64 -0.78 0.20 0.00 -0.00 0.00 0.00 33.47 32.26 1vam s TRP 40 CO 0.59 -0.25 1.63 -1.71 -0.00 0.00 0.00 176.95 177.21 1vam n ASN 41 N 4.30 5.38 -4.61 5.86 5.15 -1.26 -4.32 115.26 125.76 1vam n ASN 41 Ca -0.20 -3.12 -0.40 0.00 -0.60 0.00 0.00 54.58 50.26 1vam n ASN 41 Cb 0.51 -1.46 0.03 0.00 -0.53 0.00 0.00 39.78 38.32 1vam n ASN 41 CO 0.00 0.00 0.00 1.15 1.40 0.00 0.00 177.26 179.81 1vam n MET 42 N 3.84 1.21 -3.91 1.20 0.00 -1.26 -4.96 117.12 113.25 1vam n MET 42 Ca 0.35 0.44 -0.29 0.00 0.00 0.00 0.00 57.70 58.20 1vam n MET 42 Cb 0.38 -2.10 -0.13 0.00 0.00 0.00 0.00 33.22 31.37 1vam n MET 42 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 1vam s GLN 43 N -2.28 2.06 -0.25 3.17 -0.21 -1.26 -5.08 119.66 115.81 1vam s GLN 43 Ca 0.67 -2.79 -0.42 0.00 0.02 0.00 0.00 55.36 52.84 1vam s GLN 43 Cb -0.50 -3.25 -0.19 0.00 1.00 0.00 0.00 33.01 30.07 1vam s GLN 43 CO 0.54 -1.17 1.46 -1.71 -2.12 0.00 0.00 175.29 172.29 1vam n ASN 44 N 2.80 1.21 0.00 5.90 2.85 -1.26 -2.37 115.26 124.39 1vam n ASN 44 Ca 0.10 1.15 0.00 0.00 -0.11 0.00 0.00 54.58 55.72 1vam n ASN 44 Cb 0.33 -0.99 0.00 0.00 1.24 0.00 0.00 39.78 40.36 1vam n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1vam n GLY 45 N 3.21 3.07 3.89 8.20 0.00 -0.49 -4.99 105.19 118.08 1vam n GLY 45 Ca 0.26 -0.89 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 1vam n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vam s LYS 46 N 0.00 3.73 0.24 1.61 -2.85 -1.00 -4.77 119.74 116.70 1vam s LYS 46 Ca 0.00 0.18 -0.30 0.00 -1.00 0.00 0.00 55.97 54.84 1vam s LYS 46 Cb 0.00 -2.64 -0.10 0.00 -2.06 0.00 0.00 37.83 33.03 1vam s LYS 46 CO 0.00 0.26 1.45 0.08 0.10 0.00 0.00 175.35 177.24 1vam s VAL 47 N -1.95 2.66 0.47 1.79 1.01 -1.26 -4.58 120.40 118.54 1vam s VAL 47 Ca 0.46 0.54 0.02 0.00 0.00 0.00 0.00 61.98 63.01 1vam s VAL 47 Cb -0.11 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1vam s VAL 47 CO 0.25 0.08 0.05 -0.83 0.00 0.00 0.00 175.10 174.65 1vam s GLY 48 N 0.44 2.87 -0.09 4.51 0.00 -0.02 -4.59 107.32 110.45 1vam s GLY 48 Ca 0.60 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 44.55 1vam s GLY 48 CO 0.42 -2.07 0.21 -1.59 0.00 0.00 0.00 173.10 170.07 1vam s THR 49 N -2.99 -0.03 0.08 0.90 2.01 -0.64 -1.97 115.64 113.01 1vam s THR 49 Ca 0.13 0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.30 1vam s THR 49 Cb 0.02 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 1vam s THR 49 CO 0.07 0.04 -0.17 0.00 -0.69 0.00 0.00 174.62 173.88 1vam s ALA 50 N 0.80 2.69 -0.16 7.40 0.00 -0.59 -1.23 121.76 130.67 1vam s ALA 50 Ca -0.06 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 1vam s ALA 50 Cb -0.07 -0.73 0.06 0.00 0.00 0.00 0.00 23.12 22.37 1vam s ALA 50 CO -0.05 0.59 0.09 -1.58 0.00 0.00 0.00 175.76 174.81 1vam s HIS 51 N -1.05 0.18 0.04 0.00 5.04 -0.32 -2.47 115.29 116.71 1vam s HIS 51 Ca 0.17 -0.28 -0.09 0.00 -1.54 0.00 0.00 55.06 53.32 1vam s HIS 51 Cb -0.11 -0.68 -0.05 0.00 0.04 0.00 0.00 32.58 31.78 1vam s HIS 51 CO 0.08 -0.49 0.34 0.42 -2.34 0.00 0.00 174.74 172.75 1vam s ILE 52 N 2.14 5.18 -0.01 0.89 1.09 -0.06 -1.99 121.20 128.45 1vam s ILE 52 Ca 0.02 0.36 -0.03 0.00 -1.10 0.00 0.00 60.65 59.90 1vam s ILE 52 Cb -0.16 -3.61 -0.00 0.00 -1.06 0.00 0.00 42.46 37.63 1vam s ILE 52 CO -0.09 0.35 0.06 -0.63 -0.10 0.00 0.00 174.94 174.53 1vam s ILE 53 N -1.32 0.05 -0.20 2.92 1.01 -0.07 -1.52 121.20 122.07 1vam s ILE 53 Ca 0.30 -0.44 -0.27 0.00 0.00 0.00 0.00 60.65 60.23 1vam s ILE 53 Cb -0.14 -0.24 0.08 0.00 0.01 0.00 0.00 42.46 42.18 1vam s ILE 53 CO 0.17 -0.24 0.78 -0.47 0.00 0.00 0.00 174.94 175.18 1vam s TYR 54 N -0.76 -0.67 0.02 3.97 6.14 -0.81 -1.36 117.35 123.88 1vam s TYR 54 Ca -0.08 1.47 -0.14 0.00 0.64 0.00 0.00 57.07 58.95 1vam s TYR 54 Cb -0.05 0.34 0.02 0.00 0.42 0.00 0.00 41.96 42.69 1vam s TYR 54 CO 0.00 -0.42 0.31 0.54 0.64 0.00 0.00 175.55 176.63 1vam s ASN 55 N -0.21 -0.16 0.04 4.32 2.20 -1.26 -1.91 114.94 117.96 1vam s ASN 55 Ca -0.03 -0.08 0.28 0.00 -0.94 0.00 0.00 52.86 52.09 1vam s ASN 55 Cb -0.03 0.35 1.13 0.00 -2.00 0.00 0.00 41.25 40.69 1vam s ASN 55 CO 0.02 -0.56 1.88 -1.54 -2.94 0.00 0.00 177.10 173.97 1vam n SER 56 N 0.82 0.16 0.15 3.54 3.41 0.12 -1.91 113.62 119.91 1vam n SER 56 Ca -0.20 0.52 -0.12 0.00 -0.26 0.00 0.00 58.87 58.81 1vam n SER 56 Cb 0.58 -0.56 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 1vam n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1vam h VAL 57 N 0.00 0.62 -0.46 -3.33 2.07 -1.89 -3.30 116.25 109.97 1vam h VAL 57 Ca 0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1vam h VAL 57 Cb 0.53 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1vam h VAL 57 CO 0.00 0.12 0.00 -0.90 0.02 0.00 0.00 177.57 176.81 1vam n ASP 58 N -5.11 3.54 -4.05 0.57 5.68 -1.25 -4.99 116.55 110.94 1vam n ASP 58 Ca -0.09 -1.98 -0.32 0.00 -0.50 0.00 0.00 54.79 51.89 1vam n ASP 58 Cb 0.27 -0.30 -0.04 0.00 -1.14 0.00 0.00 41.12 39.91 1vam n ASP 58 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1vam n LYS 59 N 1.48 -0.70 -3.91 0.11 5.02 -0.80 -4.87 118.16 114.50 1vam n LYS 59 Ca 0.20 0.03 -0.27 0.00 -2.02 0.00 0.00 58.31 56.25 1vam n LYS 59 Cb 0.60 -2.61 -0.17 0.00 -0.02 0.00 0.00 35.03 32.83 1vam n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1vam s ARG 60 N -6.91 1.54 -0.28 1.97 3.52 -1.25 -0.38 118.95 117.16 1vam s ARG 60 Ca 0.17 -0.26 -0.18 0.00 -0.13 0.00 0.00 55.73 55.32 1vam s ARG 60 Cb -0.09 -1.61 -0.02 0.00 -1.56 0.00 0.00 34.95 31.67 1vam s ARG 60 CO 0.85 -0.27 0.54 -1.17 -0.81 0.00 0.00 175.30 174.44 1vam s LEU 61 N 1.70 4.12 0.17 -0.88 2.96 0.23 -4.17 118.68 122.81 1vam s LEU 61 Ca 0.05 0.42 0.08 0.00 -0.22 0.00 0.00 54.13 54.46 1vam s LEU 61 Cb -0.13 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 1vam s LEU 61 CO -0.08 -0.36 -0.17 -0.44 -1.32 0.00 0.00 176.35 173.98 1vam s SER 62 N 1.60 2.57 0.03 3.68 0.01 -0.46 -1.43 113.70 119.69 1vam s SER 62 Ca 0.22 -0.89 -0.11 0.00 1.31 0.00 0.00 55.95 56.48 1vam s SER 62 Cb -0.15 -0.14 0.01 0.00 0.21 0.00 0.00 66.02 65.94 1vam s SER 62 CO 0.10 -0.08 0.23 0.00 0.41 0.00 0.00 173.24 173.90 1vam s ALA 63 N -2.26 -0.49 -0.02 1.44 0.00 0.71 -0.89 121.76 120.24 1vam s ALA 63 Ca 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.02 1vam s ALA 63 Cb -0.05 0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.33 1vam s ALA 63 CO 0.06 -0.33 0.04 0.08 0.00 0.00 0.00 175.76 175.61 1vam s VAL 64 N -2.16 -0.05 -0.07 0.00 1.01 -0.84 -1.52 120.40 116.76 1vam s VAL 64 Ca -0.08 0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.15 1vam s VAL 64 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 36.25 1vam s VAL 64 CO -0.01 0.08 -0.23 -0.69 0.00 0.00 0.00 175.10 174.24 1vam s VAL 65 N 0.99 1.94 0.15 2.92 1.01 -0.49 -1.18 120.40 125.75 1vam s VAL 65 Ca -0.08 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 1vam s VAL 65 Cb -0.12 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.60 1vam s VAL 65 CO -0.03 0.54 0.31 -0.94 0.00 0.00 0.00 175.10 174.98 1vam s SER 66 N 0.06 -0.01 0.15 3.32 1.04 -0.37 -0.96 113.70 116.92 1vam s SER 66 Ca -0.09 -0.71 0.06 0.00 0.48 0.00 0.00 55.95 55.69 1vam s SER 66 Cb -0.15 0.44 -0.04 0.00 0.10 0.00 0.00 66.02 66.37 1vam s SER 66 CO 0.05 -0.88 -0.14 -0.31 0.98 0.00 0.00 173.24 172.95 1vam s TYR 67 N -3.91 1.46 0.44 5.02 2.02 -1.26 -1.61 117.35 119.50 1vam s TYR 67 Ca 0.12 -0.59 -0.25 0.00 -0.37 0.00 0.00 57.07 55.97 1vam s TYR 67 Cb 0.03 -0.74 -0.09 0.00 -0.40 0.00 0.00 41.96 40.76 1vam s TYR 67 CO -0.04 0.19 1.38 -2.30 -1.57 0.00 0.00 175.55 173.20 1vam n PRO 68 N 0.20 2.14 -4.05 -1.71 -0.02 -1.26 -2.97 135.00 127.33 1vam n PRO 68 Ca -0.13 0.76 -0.38 0.00 -2.02 0.00 0.00 63.50 61.73 1vam n PRO 68 Cb 0.58 -2.54 -0.01 0.00 -0.02 0.00 0.00 33.50 31.52 1vam n PRO 68 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1vam n ASN 69 N -0.03 -2.57 -3.82 2.55 6.94 -1.26 -4.93 115.26 112.14 1vam n ASN 69 Ca 0.06 -1.13 -0.07 0.00 -0.02 0.00 0.00 54.58 53.41 1vam n ASN 69 Cb 0.41 -1.36 -0.02 0.00 -2.36 0.00 0.00 39.78 36.45 1vam n ASN 69 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vam s ALA 70 N -3.84 -1.27 0.23 -2.53 0.00 -1.16 -5.14 121.76 108.05 1vam s ALA 70 Ca 0.34 -0.22 -0.32 0.00 0.00 0.00 0.00 51.96 51.76 1vam s ALA 70 Cb -0.19 0.85 -0.12 0.00 0.00 0.00 0.00 23.12 23.66 1vam s ALA 70 CO 0.85 -1.01 1.70 -0.25 0.00 0.00 0.00 175.76 177.04 1vam n ASP 71 N -0.45 3.98 -4.46 0.00 9.92 -1.26 -4.57 116.55 119.70 1vam n ASP 71 Ca -0.05 1.08 -0.36 0.00 -0.53 0.00 0.00 54.79 54.93 1vam n ASP 71 Cb 0.60 -1.58 -0.12 0.00 -0.64 0.00 0.00 41.12 39.37 1vam n ASP 71 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1vam s SER 72 N 1.01 5.08 0.33 -2.24 1.04 -1.26 -4.44 113.70 113.22 1vam s SER 72 Ca 0.72 -0.18 -0.19 0.00 0.48 0.00 0.00 55.95 56.78 1vam s SER 72 Cb -0.50 -1.90 -0.09 0.00 0.10 0.00 0.00 66.02 63.63 1vam s SER 72 CO 0.36 0.02 0.82 0.00 0.98 0.00 0.00 173.24 175.41 1vam s ALA 73 N 1.30 3.26 0.02 5.32 0.00 -0.14 -4.88 121.76 126.64 1vam s ALA 73 Ca 0.05 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.26 1vam s ALA 73 Cb -0.15 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 1vam s ALA 73 CO 0.03 0.26 -0.08 0.99 0.00 0.00 0.00 175.76 176.96 1vam s THR 74 N -1.87 0.59 -0.08 0.00 2.01 -1.26 -1.39 115.64 113.63 1vam s THR 74 Ca 0.53 -0.69 -0.09 0.00 0.31 0.00 0.00 61.69 61.74 1vam s THR 74 Cb -0.13 -0.57 0.02 0.00 0.01 0.00 0.00 72.50 71.84 1vam s THR 74 CO 0.18 -0.09 0.25 0.54 -0.69 0.00 0.00 174.62 174.81 1vam s VAL 75 N -0.74 0.01 0.05 3.82 0.11 -0.57 -4.74 120.40 118.34 1vam s VAL 75 Ca -0.03 -0.10 -0.05 0.00 -2.93 0.00 0.00 61.98 58.88 1vam s VAL 75 Cb -0.06 -0.39 -0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1vam s VAL 75 CO 0.00 -0.05 0.08 -0.55 -3.33 0.00 0.00 175.10 171.24 1vam s SER 76 N -0.12 0.24 -0.28 3.54 0.15 -1.26 -0.21 113.70 115.77 1vam s SER 76 Ca -0.02 -0.66 -0.20 0.00 0.70 0.00 0.00 55.95 55.77 1vam s SER 76 Cb -0.03 0.23 0.10 0.00 -1.71 0.00 0.00 66.02 64.61 1vam s SER 76 CO 0.01 -0.55 0.82 -0.47 1.20 0.00 0.00 173.24 174.24 1vam s TYR 77 N -3.04 -0.78 -0.24 3.44 5.04 -0.51 -4.98 117.35 116.27 1vam s TYR 77 Ca -0.01 1.70 -0.26 0.00 -2.44 0.00 0.00 57.07 56.06 1vam s TYR 77 Cb 0.01 0.43 -0.00 0.00 0.35 0.00 0.00 41.96 42.75 1vam s TYR 77 CO -0.07 -0.38 0.88 0.34 -1.34 0.00 0.00 175.55 174.98 1vam s ASP 78 N 0.95 6.89 -0.20 4.32 -1.08 -1.26 -0.60 116.67 125.68 1vam s ASP 78 Ca -0.04 1.10 -0.14 0.00 -0.52 0.00 0.00 52.55 52.95 1vam s ASP 78 Cb -0.05 -2.46 0.06 0.00 -1.46 0.00 0.00 42.92 39.02 1vam s ASP 78 CO -0.10 -0.55 0.51 0.54 0.52 0.00 0.00 175.17 176.08 1vam s VAL 79 N 2.93 -0.01 -0.89 1.11 0.11 0.49 -4.97 120.40 119.17 1vam s VAL 79 Ca 0.37 0.04 -0.16 0.00 -2.93 0.00 0.00 61.98 59.30 1vam s VAL 79 Cb -0.15 -0.74 0.18 0.00 -1.53 0.00 0.00 36.38 34.13 1vam s VAL 79 CO 0.07 0.02 0.96 -0.62 -3.33 0.00 0.00 175.10 172.20 1vam s ASP 80 N 1.13 6.71 0.48 3.54 2.15 -1.26 -4.39 116.67 125.03 1vam s ASP 80 Ca -0.07 -2.39 0.25 0.00 0.43 0.00 0.00 52.55 50.77 1vam s ASP 80 Cb -0.06 -2.31 1.30 0.00 -0.30 0.00 0.00 42.92 41.55 1vam s ASP 80 CO -0.11 -0.81 1.88 -0.07 -0.17 0.00 0.00 175.17 175.89 1vam h LEU 81 N 9.08 0.18 -2.65 -1.34 3.38 -1.98 0.11 115.31 122.09 1vam h LEU 81 Ca 0.14 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1vam h LEU 81 Cb 1.03 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1vam h LEU 81 CO 0.94 0.07 0.00 -0.78 0.09 0.00 0.00 178.44 178.75 1vam h ASP 82 N 0.18 0.00 -0.55 -0.43 3.58 -1.90 0.13 116.42 117.43 1vam h ASP 82 Ca 0.44 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.81 1vam h ASP 82 Cb 1.44 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.44 1vam h ASP 82 CO -0.09 0.00 0.08 0.59 -2.88 0.00 0.00 179.24 176.95 1vam n ASN 83 N -3.06 4.93 0.00 2.28 3.02 0.38 -4.46 115.26 118.36 1vam n ASN 83 Ca -0.02 -3.09 0.00 0.00 -0.03 0.00 0.00 54.58 51.44 1vam n ASN 83 Cb 0.12 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 1vam n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1vam n VAL 84 N 0.05 0.00 -4.51 2.41 0.31 0.26 -5.06 118.33 111.78 1vam n VAL 84 Ca 0.31 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.39 1vam n VAL 84 Cb 1.19 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 34.02 1vam n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1vam s LEU 85 N -0.92 2.67 1.00 7.52 1.43 -0.13 -4.98 118.68 125.28 1vam s LEU 85 Ca 0.00 -1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 51.83 1vam s LEU 85 Cb 0.00 -1.02 0.19 0.00 0.03 0.00 0.00 46.19 45.39 1vam s LEU 85 CO 0.00 -0.12 1.12 -2.84 0.23 0.00 0.00 176.35 174.74 1vam s PRO 86 N -3.58 0.38 0.33 1.29 0.02 -1.26 -4.80 135.00 127.38 1vam s PRO 86 Ca 0.31 0.29 0.14 0.00 0.02 0.00 0.00 61.00 61.77 1vam s PRO 86 Cb -0.00 -1.75 0.55 0.00 0.02 0.00 0.00 34.50 33.31 1vam s PRO 86 CO 0.16 -2.71 1.70 0.93 -0.33 0.00 0.00 177.00 176.74 1vam h GLU 87 N -1.87 0.00 -5.62 5.54 5.08 -1.94 -3.42 114.58 112.35 1vam h GLU 87 Ca -0.52 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.17 1vam h GLU 87 Cb 1.32 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.29 1vam h GLU 87 CO 0.55 0.49 -0.80 -1.58 -1.00 0.00 0.00 179.01 176.66 1vam s TRP 88 N -3.71 2.69 0.00 4.33 0.52 -1.26 0.22 118.94 121.73 1vam s TRP 88 Ca -0.01 -0.63 0.00 0.00 0.02 0.00 0.00 56.10 55.48 1vam s TRP 88 Cb 0.12 -1.74 -0.00 0.00 -1.15 0.00 0.00 33.47 30.70 1vam s TRP 88 CO 0.73 -0.17 0.00 1.33 0.02 0.00 0.00 176.95 178.86 1vam n VAL 89 N 3.21 0.00 -3.96 4.03 0.24 0.66 -4.53 118.33 117.98 1vam n VAL 89 Ca -0.18 -0.02 -0.14 0.00 -2.04 0.00 0.00 64.34 61.96 1vam n VAL 89 Cb 0.53 0.01 -0.14 0.00 -1.47 0.00 0.00 33.84 32.76 1vam n VAL 89 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1vam s ARG 90 N -2.01 0.15 -0.07 7.34 0.52 -0.44 -0.15 118.95 124.29 1vam s ARG 90 Ca 0.00 -0.05 0.01 0.00 -0.52 0.00 0.00 55.73 55.18 1vam s ARG 90 Cb 0.00 -0.16 -0.03 0.00 0.52 0.00 0.00 34.95 35.28 1vam s ARG 90 CO 0.00 0.02 -0.08 0.14 0.02 0.00 0.00 175.30 175.40 1vam s VAL 91 N 0.05 3.59 0.33 3.52 -7.23 -1.26 -1.76 120.40 117.64 1vam s VAL 91 Ca -0.00 -0.52 -0.12 0.00 -1.81 0.00 0.00 61.98 59.52 1vam s VAL 91 Cb -0.02 -2.46 0.05 0.00 0.56 0.00 0.00 36.38 34.51 1vam s VAL 91 CO -0.00 0.60 0.66 0.61 -0.31 0.00 0.00 175.10 176.66 1vam n GLY 92 N 2.24 1.16 3.62 2.32 0.00 -0.45 -2.03 105.19 112.05 1vam n GLY 92 Ca -0.18 -1.22 -0.25 0.00 0.00 0.00 0.00 46.02 44.37 1vam n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vam s LEU 93 N 0.00 3.14 -0.13 0.99 1.43 0.34 -0.88 118.68 123.56 1vam s LEU 93 Ca 0.13 -0.58 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 1vam s LEU 93 Cb -0.04 -1.74 0.05 0.00 0.03 0.00 0.00 46.19 44.49 1vam s LEU 93 CO 0.10 0.05 0.55 -0.55 0.23 0.00 0.00 176.35 176.73 1vam s SER 94 N -3.25 -0.53 0.20 2.29 0.15 -0.29 -1.80 113.70 110.47 1vam s SER 94 Ca 0.28 0.84 -0.11 0.00 0.70 0.00 0.00 55.95 57.67 1vam s SER 94 Cb -0.08 0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 65.07 1vam s SER 94 CO 0.18 -0.35 0.37 0.00 1.20 0.00 0.00 173.24 174.64 1vam s ALA 95 N -0.39 -0.09 0.15 5.45 0.00 -1.19 -0.14 121.76 125.57 1vam s ALA 95 Ca -0.05 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 50.77 1vam s ALA 95 Cb -0.03 0.99 0.06 0.00 0.00 0.00 0.00 23.12 24.14 1vam s ALA 95 CO 0.04 -0.74 0.89 -1.54 0.00 0.00 0.00 175.76 174.41 1vam s SER 96 N -3.00 -0.23 0.25 0.00 1.04 -1.18 -3.10 113.70 107.48 1vam s SER 96 Ca 0.20 -0.36 0.01 0.00 0.48 0.00 0.00 55.95 56.28 1vam s SER 96 Cb 0.02 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 1vam s SER 96 CO 0.04 -0.94 0.21 0.42 0.98 0.00 0.00 173.24 173.96 1vam s THR 97 N -3.39 0.00 0.00 2.02 -4.23 -0.48 -0.93 115.64 108.62 1vam s THR 97 Ca 0.11 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 1vam s THR 97 Cb -0.02 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.33 1vam s THR 97 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 1vam n GLY 98 N -0.41 3.98 0.37 3.99 0.00 -1.26 -1.05 105.19 110.82 1vam n GLY 98 Ca 0.04 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1vam n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1vam h LEU 99 N 0.00 0.68 -9.48 0.99 5.85 -1.97 -3.00 115.31 108.39 1vam h LEU 99 Ca 0.00 0.05 -0.65 0.00 0.84 0.00 0.00 57.88 58.12 1vam h LEU 99 Cb 0.00 -0.09 -0.12 0.00 0.37 0.00 0.00 40.66 40.82 1vam h LEU 99 CO 0.00 0.34 -0.66 -0.31 -0.34 0.00 0.00 178.44 177.47 1vam s TYR 100 N -5.71 2.99 0.34 1.25 2.02 -1.26 -4.94 117.35 112.04 1vam s TYR 100 Ca -0.10 -0.03 0.04 0.00 -0.37 0.00 0.00 57.07 56.61 1vam s TYR 100 Cb 0.22 -1.53 -0.03 0.00 -0.40 0.00 0.00 41.96 40.22 1vam s TYR 100 CO 0.79 0.48 0.15 -1.59 -1.57 0.00 0.00 175.55 173.82 1vam s LYS 101 N -2.35 1.73 0.23 -0.62 0.00 -1.25 -4.48 119.74 112.99 1vam s LYS 101 Ca 0.26 -2.01 -0.22 0.00 0.00 0.00 0.00 55.97 54.00 1vam s LYS 101 Cb -0.12 -0.29 0.06 0.00 0.00 0.00 0.00 37.83 37.48 1vam s LYS 101 CO 0.18 -0.46 0.90 -1.83 0.00 0.00 0.00 175.35 174.14 1vam s GLU 102 N -3.75 1.53 -0.12 1.78 -1.05 -1.15 -3.74 118.70 112.21 1vam s GLU 102 Ca 0.32 -0.91 -0.14 0.00 -0.15 0.00 0.00 54.97 54.10 1vam s GLU 102 Cb 0.04 0.48 -0.05 0.00 -0.44 0.00 0.00 34.13 34.17 1vam s GLU 102 CO 0.17 -0.71 0.32 0.95 0.95 0.00 0.00 175.26 176.94 1vam s THR 103 N -3.01 5.26 -0.71 1.83 -4.23 -0.79 -4.73 115.64 109.25 1vam s THR 103 Ca 0.15 0.61 0.04 0.00 -1.18 0.00 0.00 61.69 61.31 1vam s THR 103 Cb -0.03 -3.64 0.26 0.00 1.34 0.00 0.00 72.50 70.43 1vam s THR 103 CO 0.06 0.44 0.88 0.59 -0.54 0.00 0.00 174.62 176.05 1vam n ASN 104 N 3.07 4.24 -4.69 3.99 5.03 -1.26 -3.74 115.26 121.91 1vam n ASN 104 Ca -0.13 -3.45 -0.39 0.00 0.87 0.00 0.00 54.58 51.48 1vam n ASN 104 Cb 0.52 -0.77 -0.06 0.00 -1.02 0.00 0.00 39.78 38.46 1vam n ASN 104 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1vam s THR 105 N -2.59 5.10 -0.23 3.41 2.01 -0.80 -2.62 115.64 119.92 1vam s THR 105 Ca 0.39 1.07 -0.07 0.00 0.31 0.00 0.00 61.69 63.39 1vam s THR 105 Cb 0.14 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1vam s THR 105 CO 0.01 0.21 0.06 -0.63 -0.69 0.00 0.00 174.62 173.58 1vam s ILE 106 N 1.32 4.39 -0.13 1.82 -1.09 0.12 -1.23 121.20 126.41 1vam s ILE 106 Ca 0.27 -0.15 0.18 0.00 -2.23 0.00 0.00 60.65 58.72 1vam s ILE 106 Cb -0.16 -3.03 -0.19 0.00 -1.58 0.00 0.00 42.46 37.50 1vam s ILE 106 CO 0.11 0.37 0.61 0.18 -1.23 0.00 0.00 174.94 174.98 1vam n LEU 107 N 4.56 0.54 -3.47 2.97 4.32 0.00 -0.96 117.00 124.96 1vam n LEU 107 Ca -0.16 0.23 -0.13 0.00 -0.02 0.00 0.00 56.01 55.93 1vam n LEU 107 Cb 0.52 0.15 -0.03 0.00 -1.62 0.00 0.00 43.42 42.43 1vam n LEU 107 CO 0.32 0.19 0.37 -0.94 -1.22 0.00 0.00 177.39 176.11 1vam s SER 108 N -5.50 -0.54 -0.19 -1.43 1.04 -1.23 -4.56 113.70 101.29 1vam s SER 108 Ca -0.05 0.09 -0.16 0.00 0.48 0.00 0.00 55.95 56.31 1vam s SER 108 Cb 0.09 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.83 1vam s SER 108 CO 0.83 -0.88 0.50 0.86 0.98 0.00 0.00 173.24 175.53 1vam s TRP 109 N -3.26 -0.60 0.01 5.02 -0.00 -0.71 -2.64 118.94 116.77 1vam s TRP 109 Ca -0.01 1.40 -0.07 0.00 -0.00 0.00 0.00 56.10 57.43 1vam s TRP 109 Cb -0.01 0.23 -0.00 0.00 -0.00 0.00 0.00 33.47 33.70 1vam s TRP 109 CO -0.08 -0.30 0.12 -1.54 -0.00 0.00 0.00 176.95 175.15 1vam s SER 110 N 0.54 0.07 0.09 5.86 1.04 0.28 0.06 113.70 121.64 1vam s SER 110 Ca -0.02 -0.29 -0.10 0.00 0.48 0.00 0.00 55.95 56.02 1vam s SER 110 Cb -0.04 0.20 0.01 0.00 0.10 0.00 0.00 66.02 66.28 1vam s SER 110 CO -0.03 -0.39 0.23 0.12 0.98 0.00 0.00 173.24 174.15 1vam s PHE 111 N -1.63 0.08 -0.28 5.02 5.36 -0.86 -1.24 117.98 124.43 1vam s PHE 111 Ca -0.13 -0.48 -0.19 0.00 -0.96 0.00 0.00 56.93 55.17 1vam s PHE 111 Cb -0.07 0.01 0.09 0.00 -0.34 0.00 0.00 43.02 42.71 1vam s PHE 111 CO 0.00 -0.57 0.76 0.99 -1.46 0.00 0.00 175.22 174.93 1vam s THR 112 N -3.82 0.00 0.00 0.12 2.01 -0.88 -2.61 115.64 110.46 1vam s THR 112 Ca 0.04 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.05 1vam s THR 112 Cb 0.04 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.55 1vam s THR 112 CO -0.11 0.00 -0.03 -0.94 -0.69 0.00 0.00 174.62 172.85 1vam s SER 113 N 1.12 0.37 -0.02 3.53 1.04 -0.45 -1.58 113.70 117.71 1vam s SER 113 Ca -0.06 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.27 1vam s SER 113 Cb -0.05 -0.02 0.01 0.00 0.10 0.00 0.00 66.02 66.05 1vam s SER 113 CO -0.12 -0.01 -0.05 -0.54 0.98 0.00 0.00 173.24 173.51 1vam s LYS 114 N -0.27 0.53 -0.30 4.02 1.02 -0.39 -2.21 119.74 122.14 1vam s LYS 114 Ca -0.01 -0.15 0.03 0.00 0.02 0.00 0.00 55.97 55.86 1vam s LYS 114 Cb -0.02 -0.55 0.08 0.00 -0.52 0.00 0.00 37.83 36.82 1vam s LYS 114 CO -0.00 0.04 -0.03 -0.51 -0.92 0.00 0.00 175.35 173.94 1vam s LEU 115 N 0.26 4.07 -0.05 3.17 1.43 0.03 -2.13 118.68 125.45 1vam s LEU 115 Ca -0.03 -1.71 -0.14 0.00 -1.03 0.00 0.00 54.13 51.22 1vam s LEU 115 Cb -0.07 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 1vam s LEU 115 CO -0.00 -0.28 0.36 -0.54 0.23 0.00 0.00 176.35 176.12 1vam s LYS 116 N 1.04 3.95 0.29 1.70 -0.14 -0.02 -1.36 119.74 125.19 1vam s LYS 116 Ca -0.00 0.30 0.09 0.00 -1.36 0.00 0.00 55.97 55.00 1vam s LYS 116 Cb -0.20 -3.27 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 1vam s LYS 116 CO -0.06 0.59 0.05 0.45 -0.76 0.00 0.00 175.35 175.62 1vam s SER 117 N -0.69 4.64 0.40 2.83 0.15 -1.24 -0.54 113.70 119.25 1vam s SER 117 Ca 0.22 -0.66 0.07 0.00 0.70 0.00 0.00 55.95 56.28 1vam s SER 117 Cb -0.15 -0.85 0.83 0.00 -1.71 0.00 0.00 66.02 64.14 1vam s SER 117 CO 0.11 -0.09 2.03 -0.55 1.20 0.00 0.00 173.24 175.94 1vam h ASN 118 N 1.76 0.45 -3.25 5.45 7.08 -1.91 -3.38 115.58 121.78 1vam h ASN 118 Ca -0.44 -0.02 -0.57 0.00 -3.08 0.00 0.00 56.30 52.18 1vam h ASN 118 Cb 1.25 -0.11 -0.05 0.00 -2.08 0.00 0.00 38.32 37.32 1vam h ASN 118 CO 0.61 0.36 1.05 -0.94 -2.08 0.00 0.00 177.43 176.43 1vam s SER 119 N -6.71 6.42 0.45 6.14 1.04 -1.26 -4.96 113.70 114.82 1vam s SER 119 Ca -0.08 0.91 -0.24 0.00 0.48 0.00 0.00 55.95 57.02 1vam s SER 119 Cb 0.17 -2.54 -0.09 0.00 0.10 0.00 0.00 66.02 63.66 1vam s SER 119 CO 0.73 -1.35 1.24 1.07 0.98 0.00 0.00 173.24 175.92 1vam n THR 120 N 6.86 2.77 -1.74 2.02 5.66 -1.26 -2.81 114.28 125.79 1vam n THR 120 Ca 0.16 -0.50 -0.17 0.00 -3.05 0.00 0.00 64.05 60.49 1vam n THR 120 Cb 0.48 -1.52 -0.05 0.00 -1.55 0.00 0.00 70.33 67.68 1vam n THR 120 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1vam n HIS 121 N -0.42 -0.24 -3.21 1.09 8.25 -1.26 -4.94 115.22 114.48 1vam n HIS 121 Ca 0.08 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.26 1vam n HIS 121 Cb 0.41 -3.06 -0.06 0.00 1.12 0.00 0.00 29.99 28.40 1vam n HIS 121 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1vam n GLU 122 N -2.54 2.96 -3.86 -0.41 -0.58 -1.12 -5.06 120.64 110.02 1vam n GLU 122 Ca -0.18 -4.74 -0.29 0.00 -0.42 0.00 0.00 57.16 51.53 1vam n GLU 122 Cb 0.58 -2.27 -0.04 0.00 -0.57 0.00 0.00 31.44 29.15 1vam n GLU 122 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1vam s THR 123 N -3.27 5.31 0.02 2.62 2.01 -1.26 -3.70 115.64 117.37 1vam s THR 123 Ca 0.43 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.05 1vam s THR 123 Cb 0.19 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 1vam s THR 123 CO -0.06 -0.01 -0.15 0.20 -0.69 0.00 0.00 174.62 173.92 1vam s ASN 124 N -2.86 1.73 -0.02 3.53 0.01 -0.46 -4.98 114.94 111.89 1vam s ASN 124 Ca 0.36 -0.40 -0.23 0.00 -0.71 0.00 0.00 52.86 51.88 1vam s ASN 124 Cb -0.12 -0.14 0.05 0.00 0.41 0.00 0.00 41.25 41.45 1vam s ASN 124 CO 0.28 0.09 0.51 0.00 -1.51 0.00 0.00 177.10 176.46 1vam s ALA 125 N -0.68 -1.30 -0.04 0.60 0.00 -1.26 -0.79 121.76 118.29 1vam s ALA 125 Ca 0.03 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.80 1vam s ALA 125 Cb -0.07 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1vam s ALA 125 CO 0.01 -0.36 -0.09 -1.17 0.00 0.00 0.00 175.76 174.15 1vam s LEU 126 N -1.41 1.67 -0.13 0.00 2.96 -0.94 -5.00 118.68 115.82 1vam s LEU 126 Ca -0.11 -0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.55 1vam s LEU 126 Cb -0.02 -0.57 0.06 0.00 0.50 0.00 0.00 46.19 46.15 1vam s LEU 126 CO 0.05 0.04 0.31 -2.28 -1.32 0.00 0.00 176.35 173.15 1vam s HIS 127 N 0.41 -0.46 0.13 5.38 5.65 -1.26 -1.34 115.29 123.80 1vam s HIS 127 Ca -0.07 1.02 0.04 0.00 0.25 0.00 0.00 55.06 56.30 1vam s HIS 127 Cb -0.11 0.11 -0.04 0.00 -1.18 0.00 0.00 32.58 31.36 1vam s HIS 127 CO 0.01 -0.31 -0.10 -0.59 -0.65 0.00 0.00 174.74 173.10 1vam s PHE 128 N 1.65 1.23 -0.19 3.88 -0.12 -1.07 -5.02 117.98 118.34 1vam s PHE 128 Ca -0.07 -0.72 -0.09 0.00 -0.05 0.00 0.00 56.93 56.00 1vam s PHE 128 Cb -0.10 -0.64 0.07 0.00 -0.63 0.00 0.00 43.02 41.72 1vam s PHE 128 CO -0.10 0.07 0.43 1.41 -0.05 0.00 0.00 175.22 176.98 1vam s MET 129 N -3.46 0.39 -0.24 1.99 1.75 -1.26 -2.02 119.30 116.44 1vam s MET 129 Ca 0.14 0.90 0.00 0.00 -1.25 0.00 0.00 55.69 55.48 1vam s MET 129 Cb 0.01 0.12 0.04 0.00 2.84 0.00 0.00 34.83 37.83 1vam s MET 129 CO 0.01 -0.19 -0.10 -0.06 -0.65 0.00 0.00 175.02 174.03 1vam s PHE 130 N 1.85 3.08 -0.95 4.11 0.08 0.11 -4.94 117.98 121.31 1vam s PHE 130 Ca -0.07 -1.81 0.12 0.00 0.12 0.00 0.00 56.93 55.29 1vam s PHE 130 Cb -0.10 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.32 1vam s PHE 130 CO -0.13 -0.79 0.65 0.09 -0.10 0.00 0.00 175.22 174.93 1vam n ASN 131 N 4.59 1.15 -3.66 1.36 3.02 -1.26 -1.73 115.26 118.73 1vam n ASN 131 Ca -0.16 -1.07 -0.06 0.00 -0.03 0.00 0.00 54.58 53.25 1vam n ASN 131 Cb 0.46 0.60 -0.08 0.00 -0.61 0.00 0.00 39.78 40.15 1vam n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1vam s GLN 132 N -1.65 0.45 0.05 3.52 2.00 -1.26 -4.86 119.66 117.90 1vam s GLN 132 Ca 0.08 1.16 -0.14 0.00 -2.00 0.00 0.00 55.36 54.47 1vam s GLN 132 Cb 0.09 0.45 -0.06 0.00 0.80 0.00 0.00 33.01 34.30 1vam s GLN 132 CO 0.34 -0.22 0.44 -0.06 -0.50 0.00 0.00 175.29 175.29 1vam s PHE 133 N 2.49 3.68 0.27 1.67 0.08 -0.28 -5.05 117.98 120.84 1vam s PHE 133 Ca -0.05 0.98 0.06 0.00 0.12 0.00 0.00 56.93 58.04 1vam s PHE 133 Cb -0.11 -2.29 -0.03 0.00 -0.57 0.00 0.00 43.02 40.02 1vam s PHE 133 CO -0.15 0.58 0.29 -1.12 -0.10 0.00 0.00 175.22 174.72 1vam s SER 134 N -1.35 5.81 0.57 1.36 0.01 -1.26 -4.16 113.70 114.68 1vam s SER 134 Ca 0.29 -0.17 0.34 0.00 1.31 0.00 0.00 55.95 57.72 1vam s SER 134 Cb -0.16 -1.48 1.66 0.00 0.21 0.00 0.00 66.02 66.25 1vam s SER 134 CO 0.16 -0.13 2.11 0.50 0.41 0.00 0.00 173.24 176.29 1vam h LYS 135 N 1.28 0.00 -2.09 12.44 3.64 -1.86 -3.14 116.57 126.84 1vam h LYS 135 Ca -0.49 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.34 1vam h LYS 135 Cb 1.24 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.66 1vam h LYS 135 CO 0.60 0.05 -0.95 -3.47 -2.27 0.00 0.00 179.45 173.41 1vam n ASP 136 N -3.30 1.79 -4.56 4.20 2.03 -1.26 -4.78 116.55 110.67 1vam n ASP 136 Ca -0.01 -3.10 -0.36 0.00 0.52 0.00 0.00 54.79 51.84 1vam n ASP 136 Cb 0.22 -0.63 -0.04 0.00 -0.72 0.00 0.00 41.12 39.96 1vam n ASP 136 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1vam s GLN 137 N -2.16 3.24 0.57 -0.67 2.00 -1.20 -4.85 119.66 116.59 1vam s GLN 137 Ca 0.40 -0.86 0.30 0.00 -2.00 0.00 0.00 55.36 53.20 1vam s GLN 137 Cb 0.23 -5.26 1.72 0.00 0.80 0.00 0.00 33.01 30.50 1vam s GLN 137 CO -0.09 -2.62 2.19 0.87 -0.50 0.00 0.00 175.29 175.14 1vam h LYS 138 N 10.26 0.00 -0.41 1.67 1.57 -1.96 -2.71 116.57 124.99 1vam h LYS 138 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1vam h LYS 138 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1vam h LYS 138 CO 1.36 0.05 0.00 -0.40 -0.57 0.00 0.00 179.45 179.88 1vam n ASP 139 N -3.68 1.95 -4.21 0.86 5.68 -1.26 -4.80 116.55 111.10 1vam n ASP 139 Ca -0.02 -2.07 -0.31 0.00 -0.50 0.00 0.00 54.79 51.89 1vam n ASP 139 Cb 0.15 -0.28 -0.17 0.00 -1.14 0.00 0.00 41.12 39.68 1vam n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1vam s LEU 140 N -1.03 2.03 -0.50 -2.12 1.43 -1.02 -0.87 118.68 116.59 1vam s LEU 140 Ca 0.22 -0.52 -0.21 0.00 -1.03 0.00 0.00 54.13 52.60 1vam s LEU 140 Cb 0.12 -1.32 0.05 0.00 0.03 0.00 0.00 46.19 45.07 1vam s LEU 140 CO 0.13 0.16 0.70 -0.63 0.23 0.00 0.00 176.35 176.95 1vam s ILE 141 N 0.27 4.75 -0.17 -0.59 1.01 0.25 -4.88 121.20 121.84 1vam s ILE 141 Ca -0.15 -0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 1vam s ILE 141 Cb -0.17 -4.33 -0.04 0.00 0.01 0.00 0.00 42.46 37.93 1vam s ILE 141 CO 0.07 -0.83 0.42 -0.76 0.00 0.00 0.00 174.94 173.84 1vam s LEU 142 N 2.97 4.21 0.28 2.97 1.02 -1.26 -1.80 118.68 127.07 1vam s LEU 142 Ca 0.20 0.63 0.09 0.00 0.02 0.00 0.00 54.13 55.08 1vam s LEU 142 Cb -0.17 -2.58 -0.06 0.00 0.02 0.00 0.00 46.19 43.41 1vam s LEU 142 CO 0.15 -0.04 -0.12 -1.10 0.02 0.00 0.00 176.35 175.26 1vam s GLN 143 N 1.00 1.61 7.97 1.70 -0.21 -0.73 -4.98 119.66 126.02 1vam s GLN 143 Ca 0.22 -1.78 0.00 0.00 0.02 0.00 0.00 55.36 53.82 1vam s GLN 143 Cb -0.15 -1.45 0.00 0.00 1.00 0.00 0.00 33.01 32.41 1vam s GLN 143 CO 0.08 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.84 1vam n GLY 144 N -0.61 3.69 0.63 3.09 0.00 -1.26 -0.92 105.19 109.81 1vam n GLY 144 Ca -0.06 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 45.99 1vam n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vam n ASP 145 N 8.86 2.30 -4.71 1.61 9.92 0.13 -4.89 116.55 129.77 1vam n ASP 145 Ca 0.00 -1.65 -0.42 0.00 -0.53 0.00 0.00 54.79 52.19 1vam n ASP 145 Cb 0.00 0.01 -0.01 0.00 -0.64 0.00 0.00 41.12 40.48 1vam n ASP 145 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vam n ALA 146 N 0.87 1.44 -3.12 2.24 0.00 -1.07 -4.38 120.51 116.49 1vam n ALA 146 Ca 0.09 0.36 -0.12 0.00 0.00 0.00 0.00 53.44 53.77 1vam n ALA 146 Cb 0.39 -2.28 -0.07 0.00 0.00 0.00 0.00 19.45 17.50 1vam n ALA 146 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1vam s THR 147 N -1.01 0.06 0.17 0.00 -4.23 0.17 -4.75 115.64 106.05 1vam s THR 147 Ca 0.56 -0.52 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 1vam s THR 147 Cb -0.56 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.35 1vam s THR 147 CO 0.61 -0.29 0.02 0.35 -0.54 0.00 0.00 174.62 174.78 1vam n THR 148 N 0.58 0.00 0.00 3.99 -2.24 -1.26 -0.60 114.28 114.75 1vam n THR 148 Ca -0.19 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.81 1vam n THR 148 Cb 0.59 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1vam n THR 148 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vam n GLY 149 N 2.95 1.96 3.54 3.38 0.00 -1.08 -4.71 105.19 111.24 1vam n GLY 149 Ca -0.06 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1vam n GLY 149 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1vam n THR 150 N 0.00 -0.02 -1.44 2.61 -1.04 -1.24 -1.11 114.28 112.05 1vam n THR 150 Ca 0.00 -0.64 -0.15 0.00 -2.04 0.00 0.00 64.05 61.22 1vam n THR 150 Cb 0.00 -2.42 -0.06 0.00 -1.82 0.00 0.00 70.33 66.02 1vam n THR 150 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1vam n ASP 151 N 14.53 -5.33 0.00 8.00 8.00 -1.26 -1.28 116.55 139.21 1vam n ASP 151 Ca 0.40 0.37 0.00 0.00 0.71 0.00 0.00 54.79 56.27 1vam n ASP 151 Cb 0.45 -4.15 0.00 0.00 -0.02 0.00 0.00 41.12 37.41 1vam n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vam n GLY 152 N -0.44 0.59 3.92 0.44 0.00 -0.26 -5.01 105.19 104.43 1vam n GLY 152 Ca -0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 1vam n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vam s ASN 153 N -2.03 5.09 -0.22 1.61 0.01 -0.40 -1.12 114.94 117.88 1vam s ASN 153 Ca 0.00 -0.78 -0.04 0.00 -0.71 0.00 0.00 52.86 51.33 1vam s ASN 153 Cb 0.00 -0.34 -0.01 0.00 0.41 0.00 0.00 41.25 41.32 1vam s ASN 153 CO 0.00 -0.82 -0.04 -0.22 -1.51 0.00 0.00 177.10 174.51 1vam s LEU 154 N -4.25 2.90 -0.45 0.60 2.96 -0.13 -2.63 118.68 117.67 1vam s LEU 154 Ca 0.49 -0.38 -0.14 0.00 -0.22 0.00 0.00 54.13 53.88 1vam s LEU 154 Cb -0.04 -1.74 0.07 0.00 0.50 0.00 0.00 46.19 44.98 1vam s LEU 154 CO 0.29 -0.01 0.35 -1.61 -1.32 0.00 0.00 176.35 174.05 1vam s GLU 155 N 1.43 2.88 0.39 1.98 0.41 0.24 -0.70 118.70 125.32 1vam s GLU 155 Ca 0.05 -1.36 0.14 0.00 -0.41 0.00 0.00 54.97 53.39 1vam s GLU 155 Cb -0.14 -4.02 0.79 0.00 -1.78 0.00 0.00 34.13 28.98 1vam s GLU 155 CO -0.03 -0.99 1.86 -0.07 -0.49 0.00 0.00 175.26 175.55 1vam h LEU 156 N 8.65 0.00 -9.18 1.80 3.38 -1.74 0.51 115.31 118.72 1vam h LEU 156 Ca -0.27 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.24 1vam h LEU 156 Cb 1.10 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.71 1vam h LEU 156 CO 0.83 0.33 -0.60 0.42 0.09 0.00 0.00 178.44 179.52 1vam s THR 157 N -4.25 0.97 0.03 0.22 -4.23 -1.26 -2.34 115.64 104.77 1vam s THR 157 Ca -0.03 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.18 1vam s THR 157 Cb 0.14 -2.70 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 1vam s THR 157 CO 0.72 0.00 1.32 -0.60 -0.54 0.00 0.00 174.62 175.52 1vam s ARG 158 N -3.90 4.33 0.01 3.99 3.52 -1.26 -4.86 118.95 120.79 1vam s ARG 158 Ca 0.35 1.90 0.07 0.00 -0.13 0.00 0.00 55.73 57.91 1vam s ARG 158 Cb 0.08 -3.46 -0.02 0.00 -1.56 0.00 0.00 34.95 29.99 1vam s ARG 158 CO 0.15 -0.46 -0.20 0.14 -0.81 0.00 0.00 175.30 174.12 1vam s VAL 159 N 1.83 1.59 0.94 7.11 -7.23 -1.26 -0.80 120.40 122.58 1vam s VAL 159 Ca 0.62 -0.99 -0.12 0.00 -1.81 0.00 0.00 61.98 59.67 1vam s VAL 159 Cb -0.31 -1.35 0.16 0.00 0.56 0.00 0.00 36.38 35.44 1vam s VAL 159 CO 0.27 0.33 1.10 -0.94 -0.31 0.00 0.00 175.10 175.55 1vam s SER 160 N -0.78 3.11 0.41 4.85 1.04 0.43 -4.87 113.70 117.90 1vam s SER 160 Ca 0.07 1.24 0.10 0.00 0.48 0.00 0.00 55.95 57.84 1vam s SER 160 Cb -0.08 -1.90 0.92 0.00 0.10 0.00 0.00 66.02 65.06 1vam s SER 160 CO 0.00 -2.84 2.01 0.77 0.98 0.00 0.00 173.24 174.17 1vam h SER 161 N -1.69 0.45 1.74 7.02 4.64 -2.01 0.42 113.55 124.12 1vam h SER 161 Ca -0.52 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1vam h SER 161 Cb 1.31 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1vam h SER 161 CO 0.58 0.30 0.00 -0.55 -0.87 0.00 0.00 176.83 176.28 1vam h ASN 162 N 0.52 0.00 0.00 4.97 -1.07 -2.06 -3.47 115.58 114.46 1vam h ASN 162 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.59 1vam h ASN 162 Cb 0.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.48 1vam h ASN 162 CO -0.06 0.00 0.00 0.61 0.07 0.00 0.00 177.43 178.05 1vam n GLY 163 N 1.03 2.19 3.70 9.14 0.00 0.14 -5.09 105.19 116.30 1vam n GLY 163 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1vam n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vam s SER 164 N -1.94 6.50 0.53 1.61 0.01 -1.26 -4.50 113.70 114.64 1vam s SER 164 Ca 0.00 2.67 -0.20 0.00 1.31 0.00 0.00 55.95 59.73 1vam s SER 164 Cb 0.00 -2.58 -0.07 0.00 0.21 0.00 0.00 66.02 63.59 1vam s SER 164 CO 0.00 -0.93 1.10 -2.16 0.41 0.00 0.00 173.24 171.66 1vam s PRO 165 N 2.18 3.49 -0.12 12.44 0.04 -1.26 -0.43 135.00 151.35 1vam s PRO 165 Ca 0.76 1.54 -0.03 0.00 0.04 0.00 0.00 61.00 63.31 1vam s PRO 165 Cb -0.44 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 1vam s PRO 165 CO 0.34 -0.72 -0.01 -0.65 0.04 0.00 0.00 177.00 175.99 1vam s GLN 166 N -3.27 3.30 0.84 4.56 1.11 0.02 -4.87 119.66 121.35 1vam s GLN 166 Ca 0.71 -0.45 -0.12 0.00 0.01 0.00 0.00 55.36 55.52 1vam s GLN 166 Cb -0.22 -2.87 0.09 0.00 -1.01 0.00 0.00 33.01 29.01 1vam s GLN 166 CO 0.25 0.50 1.12 0.20 0.01 0.00 0.00 175.29 177.37 1vam s GLY 167 N -0.33 1.60 -1.48 3.09 0.00 -1.26 -4.09 107.32 104.85 1vam s GLY 167 Ca 0.06 -0.36 -0.11 0.00 0.00 0.00 0.00 44.72 44.32 1vam s GLY 167 CO 0.02 0.12 0.89 1.44 0.00 0.00 0.00 173.10 175.57 1vam n SER 168 N -3.54 -5.12 -4.50 1.64 7.64 -1.13 -4.82 113.62 103.79 1vam n SER 168 Ca 0.07 -0.61 -0.28 0.00 1.01 0.00 0.00 58.87 59.06 1vam n SER 168 Cb 0.58 -4.10 -0.11 0.00 -1.01 0.00 0.00 64.21 59.57 1vam n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1vam s SER 169 N -3.13 3.90 -0.21 6.43 0.15 -1.25 -4.96 113.70 114.63 1vam s SER 169 Ca 0.57 -0.66 -0.16 0.00 0.70 0.00 0.00 55.95 56.39 1vam s SER 169 Cb -0.28 -0.53 0.06 0.00 -1.71 0.00 0.00 66.02 63.57 1vam s SER 169 CO 0.70 0.13 0.54 0.54 1.20 0.00 0.00 173.24 176.35 1vam s VAL 170 N -1.54 -0.01 0.22 4.45 0.11 -1.26 -1.39 120.40 120.99 1vam s VAL 170 Ca 0.22 0.02 -0.09 0.00 -2.93 0.00 0.00 61.98 59.20 1vam s VAL 170 Cb -0.09 -0.77 -0.02 0.00 -1.53 0.00 0.00 36.38 33.98 1vam s VAL 170 CO 0.12 0.01 0.35 -0.83 -3.33 0.00 0.00 175.10 171.42 1vam s GLY 171 N 0.80 0.78 0.20 6.54 0.00 -0.99 0.17 107.32 114.82 1vam s GLY 171 Ca -0.04 -1.11 -0.10 0.00 0.00 0.00 0.00 44.72 43.47 1vam s GLY 171 CO -0.06 -0.88 0.35 0.50 0.00 0.00 0.00 173.10 173.01 1vam s ARG 172 N -4.05 1.30 -0.12 2.90 0.52 -0.09 -3.14 118.95 116.27 1vam s ARG 172 Ca 0.26 -1.22 -0.05 0.00 -0.52 0.00 0.00 55.73 54.20 1vam s ARG 172 Cb 0.02 0.41 0.05 0.00 0.52 0.00 0.00 34.95 35.95 1vam s ARG 172 CO 0.08 -0.50 0.26 0.00 0.02 0.00 0.00 175.30 175.16 1vam s ALA 173 N -4.00 -0.59 -0.01 2.13 0.00 -0.75 -1.77 121.76 116.78 1vam s ALA 173 Ca 0.20 1.01 0.04 0.00 0.00 0.00 0.00 51.96 53.22 1vam s ALA 173 Cb 0.02 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1vam s ALA 173 CO 0.04 -0.34 -0.13 -0.51 0.00 0.00 0.00 175.76 174.82 1vam s LEU 174 N 1.63 2.02 0.30 0.00 1.02 -0.74 -0.51 118.68 122.40 1vam s LEU 174 Ca -0.06 -0.24 -0.29 0.00 0.02 0.00 0.00 54.13 53.56 1vam s LEU 174 Cb -0.11 -0.67 -0.10 0.00 0.02 0.00 0.00 46.19 45.33 1vam s LEU 174 CO -0.09 0.16 1.37 0.12 0.02 0.00 0.00 176.35 177.94 1vam s PHE 175 N -0.29 2.99 0.24 0.29 5.36 -0.86 -0.58 117.98 125.12 1vam s PHE 175 Ca 0.05 1.25 -0.05 0.00 -0.96 0.00 0.00 56.93 57.21 1vam s PHE 175 Cb -0.05 -3.77 0.39 0.00 -0.34 0.00 0.00 43.02 39.25 1vam s PHE 175 CO -0.00 -2.27 1.79 -0.92 -1.46 0.00 0.00 175.22 172.35 1vam h TYR 176 N 3.96 0.74 -3.33 10.12 3.20 -1.35 -3.43 116.97 126.88 1vam h TYR 176 Ca -0.48 0.03 -0.56 0.00 3.14 0.00 0.00 58.73 60.86 1vam h TYR 176 Cb 1.22 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 39.23 1vam h TYR 176 CO 0.57 0.27 0.03 0.00 -1.64 0.00 0.00 178.16 177.39 1vam s ALA 177 N -6.04 3.45 0.59 1.82 0.00 -1.26 -5.01 121.76 115.32 1vam s ALA 177 Ca -0.12 0.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.72 1vam s ALA 177 Cb 0.19 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 1vam s ALA 177 CO 0.77 0.13 1.31 -2.14 0.00 0.00 0.00 175.76 175.83 1vam s PRO 178 N -0.10 2.88 -0.15 0.00 0.02 -1.26 -4.85 135.00 131.54 1vam s PRO 178 Ca 0.33 2.10 -0.02 0.00 0.02 0.00 0.00 61.00 63.43 1vam s PRO 178 Cb -0.19 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 32.27 1vam s PRO 178 CO 0.18 -1.35 -0.08 0.08 -0.33 0.00 0.00 177.00 175.51 1vam s VAL 179 N -1.38 3.48 -1.18 3.83 1.01 0.79 -4.93 120.40 122.02 1vam s VAL 179 Ca 0.77 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 62.07 1vam s VAL 179 Cb -0.38 -2.51 0.10 0.00 0.00 0.00 0.00 36.38 33.60 1vam s VAL 179 CO 0.42 0.50 1.53 -2.28 0.00 0.00 0.00 175.10 175.27 1vam s HIS 180 N 0.49 2.98 -0.89 5.22 2.46 -1.26 -0.24 115.29 124.05 1vam s HIS 180 Ca -0.06 -1.61 0.09 0.00 0.47 0.00 0.00 55.06 53.96 1vam s HIS 180 Cb -0.15 -4.57 0.42 0.00 -0.13 0.00 0.00 32.58 28.16 1vam s HIS 180 CO 0.03 -1.68 1.30 1.51 -2.47 0.00 0.00 174.74 173.43 1vam n ILE 181 N 5.87 1.43 0.00 0.89 0.13 0.13 -4.77 119.36 123.05 1vam n ILE 181 Ca 0.40 0.40 0.00 0.00 -1.10 0.00 0.00 62.75 62.45 1vam n ILE 181 Cb 0.46 -1.30 0.00 0.00 -0.84 0.00 0.00 39.64 37.96 1vam n ILE 181 CO 0.00 0.00 0.00 -2.67 2.80 0.00 0.00 176.55 176.68 1vam n TRP 182 N -1.63 0.00 -5.19 9.51 4.27 -1.16 -4.89 117.44 118.35 1vam n TRP 182 Ca 0.01 0.00 -0.31 0.00 -3.89 0.00 0.00 57.50 53.32 1vam n TRP 182 Cb 0.09 0.00 -0.16 0.00 -1.36 0.00 0.00 31.31 29.88 1vam n TRP 182 CO 0.00 0.00 0.00 -1.83 -2.29 0.00 0.00 177.69 173.57 1vam s GLU 183 N -0.91 2.06 0.50 -2.67 -1.05 -1.26 -4.53 118.70 110.84 1vam s GLU 183 Ca 0.00 -0.96 0.45 0.00 -0.15 0.00 0.00 54.97 54.31 1vam s GLU 183 Cb 0.00 -2.05 1.58 0.00 -0.44 0.00 0.00 34.13 33.23 1vam s GLU 183 CO 0.00 0.55 1.44 0.43 0.95 0.00 0.00 175.26 178.63 1vam n SER 184 N 2.28 0.02 -1.52 0.83 7.64 -1.26 -1.86 113.62 119.74 1vam n SER 184 Ca -0.16 0.95 -0.05 0.00 1.01 0.00 0.00 58.87 60.61 1vam n SER 184 Cb 0.51 -0.47 0.10 0.00 -1.01 0.00 0.00 64.21 63.33 1vam n SER 184 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1vam n SER 185 N -3.84 2.66 -4.76 6.43 7.64 -1.26 -5.06 113.62 115.43 1vam n SER 185 Ca 0.41 -3.30 -0.40 0.00 1.01 0.00 0.00 58.87 56.59 1vam n SER 185 Cb 1.83 -0.42 -0.06 0.00 -1.01 0.00 0.00 64.21 64.55 1vam n SER 185 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vam s ALA 186 N -2.94 3.40 0.08 -0.43 0.00 -0.78 -4.20 121.76 116.90 1vam s ALA 186 Ca 0.40 0.47 0.05 0.00 0.00 0.00 0.00 51.96 52.88 1vam s ALA 186 Cb 0.38 -3.06 -0.23 0.00 0.00 0.00 0.00 23.12 20.20 1vam s ALA 186 CO -0.04 0.25 1.14 -0.24 0.00 0.00 0.00 175.76 176.87 1vam h VAL 187 N 3.28 1.52 -3.31 0.00 3.04 -1.10 -3.46 116.25 116.22 1vam h VAL 187 Ca -0.46 -3.22 -0.18 0.00 -1.01 0.00 0.00 66.70 61.83 1vam h VAL 187 Cb 1.20 2.81 -0.26 0.00 -2.01 0.00 0.00 31.29 33.03 1vam h VAL 187 CO 0.67 0.89 -0.50 -0.69 -1.01 0.00 0.00 177.57 176.92 1vam s VAL 188 N -2.68 0.01 -0.02 1.51 1.01 -0.98 -4.86 120.40 114.39 1vam s VAL 188 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1vam s VAL 188 Cb 0.09 -0.27 0.03 0.00 0.00 0.00 0.00 36.38 36.23 1vam s VAL 188 CO 0.84 -0.03 0.02 0.00 0.00 0.00 0.00 175.10 175.93 1vam s ALA 189 N -0.00 0.13 -0.12 5.51 0.00 -1.26 -0.84 121.76 125.18 1vam s ALA 189 Ca -0.01 0.26 -0.28 0.00 0.00 0.00 0.00 51.96 51.93 1vam s ALA 189 Cb -0.02 -0.25 0.07 0.00 0.00 0.00 0.00 23.12 22.92 1vam s ALA 189 CO 0.00 -0.09 0.66 -1.54 0.00 0.00 0.00 175.76 174.80 1vam s SER 190 N 0.99 -0.66 0.13 0.00 1.04 -0.90 -0.71 113.70 113.60 1vam s SER 190 Ca -0.09 0.92 0.01 0.00 0.48 0.00 0.00 55.95 57.27 1vam s SER 190 Cb -0.12 0.82 -0.04 0.00 0.10 0.00 0.00 66.02 66.78 1vam s SER 190 CO -0.03 -0.48 -0.02 0.72 0.98 0.00 0.00 173.24 174.42 1vam s PHE 191 N -0.67 1.02 -0.13 5.02 -0.12 -0.80 -1.27 117.98 121.04 1vam s PHE 191 Ca -0.07 -0.99 -0.06 0.00 -0.05 0.00 0.00 56.93 55.75 1vam s PHE 191 Cb -0.02 -0.59 0.05 0.00 -0.63 0.00 0.00 43.02 41.84 1vam s PHE 191 CO 0.07 -0.22 0.29 -2.00 -0.05 0.00 0.00 175.22 173.31 1vam s GLU 192 N -3.89 0.24 0.05 1.99 2.12 -0.62 -1.93 118.70 116.66 1vam s GLU 192 Ca 0.18 0.65 0.08 0.00 0.36 0.00 0.00 54.97 56.24 1vam s GLU 192 Cb 0.06 -0.06 -0.03 0.00 0.26 0.00 0.00 34.13 34.36 1vam s GLU 192 CO -0.00 -0.19 -0.23 0.00 -0.54 0.00 0.00 175.26 174.29 1vam s ALA 193 N 1.58 2.00 -0.06 6.30 0.00 -0.58 -2.08 121.76 128.92 1vam s ALA 193 Ca -0.07 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 50.69 1vam s ALA 193 Cb -0.10 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.64 1vam s ALA 193 CO -0.10 0.46 0.13 0.99 0.00 0.00 0.00 175.76 177.25 1vam s THR 194 N -0.81 -0.02 -0.07 0.00 2.01 -0.38 -0.88 115.64 115.49 1vam s THR 194 Ca 0.10 0.09 -0.19 0.00 0.31 0.00 0.00 61.69 61.99 1vam s THR 194 Cb -0.09 -0.21 0.04 0.00 0.01 0.00 0.00 72.50 72.25 1vam s THR 194 CO 0.02 0.04 0.45 0.72 -0.69 0.00 0.00 174.62 175.15 1vam s PHE 195 N 0.60 -0.39 -0.08 4.92 -0.71 -1.03 -0.56 117.98 120.73 1vam s PHE 195 Ca -0.04 0.75 0.01 0.00 -1.04 0.00 0.00 56.93 56.61 1vam s PHE 195 Cb -0.06 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.92 1vam s PHE 195 CO -0.03 -0.41 -0.11 0.95 -1.34 0.00 0.00 175.22 174.29 1vam s THR 196 N -0.87 3.36 0.13 -4.49 -4.23 -1.08 -1.54 115.64 106.92 1vam s THR 196 Ca -0.09 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 59.84 1vam s THR 196 Cb -0.03 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.39 1vam s THR 196 CO 0.05 0.57 -0.02 0.72 -0.54 0.00 0.00 174.62 175.40 1vam s PHE 197 N -0.46 0.99 -0.12 3.99 -0.71 -0.83 -0.82 117.98 120.02 1vam s PHE 197 Ca 0.06 -1.01 -0.01 0.00 -1.04 0.00 0.00 56.93 54.93 1vam s PHE 197 Cb -0.12 -0.57 0.04 0.00 -1.21 0.00 0.00 43.02 41.15 1vam s PHE 197 CO 0.02 -0.23 -0.01 -1.17 -1.34 0.00 0.00 175.22 172.48 1vam s LEU 198 N -3.09 0.97 -0.17 -1.99 0.20 -0.36 -0.84 118.68 113.40 1vam s LEU 198 Ca 0.18 -0.37 0.00 0.00 0.69 0.00 0.00 54.13 54.63 1vam s LEU 198 Cb 0.06 -0.61 0.03 0.00 -0.43 0.00 0.00 46.19 45.24 1vam s LEU 198 CO -0.01 -0.21 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.10 1vam s ILE 199 N 1.85 1.52 -0.11 6.68 1.01 -1.25 -1.90 121.20 129.00 1vam s ILE 199 Ca 0.03 -0.75 -0.09 0.00 0.00 0.00 0.00 60.65 59.84 1vam s ILE 199 Cb -0.14 -1.52 0.03 0.00 0.01 0.00 0.00 42.46 40.84 1vam s ILE 199 CO -0.07 0.31 0.28 -1.59 0.00 0.00 0.00 174.94 173.87 1vam s LYS 200 N 1.48 0.31 -0.08 2.79 -2.85 -1.25 -1.39 119.74 118.75 1vam s LYS 200 Ca 0.02 0.42 0.03 0.00 -1.00 0.00 0.00 55.97 55.43 1vam s LYS 200 Cb -0.14 0.11 0.01 0.00 -2.06 0.00 0.00 37.83 35.75 1vam s LYS 200 CO -0.09 -0.06 -0.16 -1.54 0.10 0.00 0.00 175.35 173.60 1vam s SER 201 N 0.33 2.21 -0.55 0.03 1.04 -1.26 -1.89 113.70 113.61 1vam s SER 201 Ca -0.02 -0.38 -0.06 0.00 0.48 0.00 0.00 55.95 55.97 1vam s SER 201 Cb -0.03 -1.02 -0.15 0.00 0.10 0.00 0.00 66.02 64.92 1vam s SER 201 CO -0.01 0.07 2.82 -2.65 0.98 0.00 0.00 173.24 174.44 1vam n PRO 202 N 3.77 2.17 0.00 4.02 -0.02 -1.26 -4.64 135.00 139.04 1vam n PRO 202 Ca -0.21 -1.25 0.00 0.00 -2.02 0.00 0.00 63.50 60.02 1vam n PRO 202 Cb 0.52 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1vam n PRO 202 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1vam n ASP 203 N 3.14 0.00 -0.89 2.55 5.75 -1.26 -5.02 116.55 120.81 1vam n ASP 203 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.24 1vam n ASP 203 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 1vam n ASP 203 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1vam n SER 204 N 0.00 1.62 -3.38 -1.12 7.64 -1.26 -4.49 113.62 112.63 1vam n SER 204 Ca 0.00 -1.27 -0.27 0.00 1.01 0.00 0.00 58.87 58.35 1vam n SER 204 Cb 0.00 -0.32 -0.10 0.00 -1.01 0.00 0.00 64.21 62.79 1vam n SER 204 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1vam n HIS 205 N 0.57 -0.87 -2.43 1.43 8.25 -1.26 -5.13 115.22 115.79 1vam n HIS 205 Ca 0.00 -3.33 -0.31 0.00 -0.26 0.00 0.00 57.72 53.82 1vam n HIS 205 Cb 0.28 0.22 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 1vam n HIS 205 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1vam s PRO 206 N -0.05 3.86 0.00 -0.41 0.04 -1.26 -3.94 135.00 133.24 1vam s PRO 206 Ca 0.33 0.81 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1vam s PRO 206 Cb 0.05 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1vam s PRO 206 CO -0.19 -0.26 0.00 0.00 0.04 0.00 0.00 177.00 176.59 1vam n ALA 207 N -1.69 0.00 0.02 8.56 0.00 -1.25 -4.43 120.51 121.73 1vam n ALA 207 Ca 0.05 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.53 1vam n ALA 207 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.94 1vam n ALA 207 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1vam n ASP 208 N 0.00 3.32 0.00 0.00 8.00 -0.11 -2.91 116.55 124.85 1vam n ASP 208 Ca 0.00 -0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1vam n ASP 208 Cb 0.00 1.26 0.00 0.00 -0.02 0.00 0.00 41.12 42.36 1vam n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vam n GLY 209 N 2.07 1.56 3.23 0.44 0.00 -1.24 -2.69 105.19 108.55 1vam n GLY 209 Ca -0.01 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 43.95 1vam n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vam s ILE 210 N -1.32 1.39 -0.16 -0.61 1.01 -0.81 -3.10 121.20 117.61 1vam s ILE 210 Ca 0.00 -1.48 -0.16 0.00 0.00 0.00 0.00 60.65 59.01 1vam s ILE 210 Cb 0.00 -1.35 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1vam s ILE 210 CO 0.00 -0.20 0.44 0.00 0.00 0.00 0.00 174.94 175.18 1vam s ALA 211 N -1.41 -1.10 -0.21 9.38 0.00 0.80 -0.56 121.76 128.67 1vam s ALA 211 Ca 0.03 1.21 -0.16 0.00 0.00 0.00 0.00 51.96 53.04 1vam s ALA 211 Cb -0.09 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1vam s ALA 211 CO 0.03 -0.22 0.43 0.12 0.00 0.00 0.00 175.76 176.12 1vam s PHE 212 N 0.12 3.35 0.12 0.00 5.36 -0.77 -1.13 117.98 125.02 1vam s PHE 212 Ca -0.01 0.63 0.07 0.00 -0.96 0.00 0.00 56.93 56.66 1vam s PHE 212 Cb -0.03 -2.58 -0.04 0.00 -0.34 0.00 0.00 43.02 40.04 1vam s PHE 212 CO 0.01 -0.07 -0.18 -0.59 -1.46 0.00 0.00 175.22 172.93 1vam s PHE 213 N 1.53 1.64 -0.12 10.12 -0.12 -0.06 -1.19 117.98 129.79 1vam s PHE 213 Ca 0.20 -0.46 0.03 0.00 -0.05 0.00 0.00 56.93 56.64 1vam s PHE 213 Cb -0.15 -0.87 0.01 0.00 -0.63 0.00 0.00 43.02 41.38 1vam s PHE 213 CO 0.09 0.20 -0.19 0.42 -0.05 0.00 0.00 175.22 175.68 1vam s ILE 214 N -1.56 1.79 0.35 -4.49 1.01 -0.37 -1.35 121.20 116.58 1vam s ILE 214 Ca 0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 1vam s ILE 214 Cb -0.08 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.80 1vam s ILE 214 CO 0.04 0.50 0.46 -1.54 0.00 0.00 0.00 174.94 174.40 1vam n SER 215 N 3.99 -1.28 -4.77 3.58 3.41 -0.72 -2.11 113.62 115.72 1vam n SER 215 Ca -0.20 -2.91 -0.36 0.00 -0.26 0.00 0.00 58.87 55.14 1vam n SER 215 Cb 0.52 2.43 -0.00 0.00 -0.26 0.00 0.00 64.21 66.89 1vam n SER 215 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1vam s ASN 216 N -3.17 5.85 0.28 4.04 4.22 -1.24 -1.33 114.94 123.60 1vam s ASN 216 Ca 0.30 2.21 0.01 0.00 -2.14 0.00 0.00 52.86 53.23 1vam s ASN 216 Cb -0.01 -2.59 0.68 0.00 1.28 0.00 0.00 41.25 40.61 1vam s ASN 216 CO 0.21 -1.13 1.64 0.40 -2.04 0.00 0.00 177.10 176.19 1vam h ILE 217 N 1.38 0.31 -0.15 0.54 2.04 -1.83 -1.59 117.51 118.21 1vam h ILE 217 Ca -0.50 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 1vam h ILE 217 Cb 1.26 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1vam h ILE 217 CO 0.58 0.03 0.05 -0.90 0.00 0.00 0.00 178.15 177.91 1vam n ASP 218 N -5.25 2.40 -4.74 1.72 5.75 -1.26 -4.89 116.55 110.29 1vam n ASP 218 Ca 0.20 -2.24 -0.41 0.00 -0.01 0.00 0.00 54.79 52.33 1vam n ASP 218 Cb 0.66 -0.55 -0.03 0.00 -1.03 0.00 0.00 41.12 40.17 1vam n ASP 218 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1vam s SER 219 N 0.11 6.78 0.02 -1.12 0.15 -0.60 -5.03 113.70 114.01 1vam s SER 219 Ca 0.11 2.49 0.01 0.00 0.70 0.00 0.00 55.95 59.26 1vam s SER 219 Cb 0.09 -2.61 -0.02 0.00 -1.71 0.00 0.00 66.02 61.77 1vam s SER 219 CO 0.03 -0.63 -0.04 -0.94 1.20 0.00 0.00 173.24 172.86 1vam s SER 220 N 0.52 0.38 -0.23 5.45 1.04 -1.26 -5.09 113.70 114.51 1vam s SER 220 Ca 0.60 -0.39 -0.39 0.00 0.48 0.00 0.00 55.95 56.24 1vam s SER 220 Cb -0.39 0.05 -0.15 0.00 0.10 0.00 0.00 66.02 65.63 1vam s SER 220 CO 0.38 -0.20 1.71 -0.38 0.98 0.00 0.00 173.24 175.74 1vam n ILE 221 N 1.93 0.29 -2.19 -1.02 5.41 -1.26 -4.91 119.36 117.61 1vam n ILE 221 Ca -0.21 -0.05 -0.35 0.00 1.00 0.00 0.00 62.75 63.14 1vam n ILE 221 Cb 0.56 -1.23 0.01 0.00 -0.71 0.00 0.00 39.64 38.26 1vam n ILE 221 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1vam s PRO 222 N 3.27 3.28 0.25 0.38 0.02 -1.26 -4.97 135.00 135.97 1vam s PRO 222 Ca 0.96 1.59 -0.30 0.00 0.02 0.00 0.00 61.00 63.28 1vam s PRO 222 Cb -1.03 -2.00 -0.09 0.00 0.02 0.00 0.00 34.50 31.40 1vam s PRO 222 CO 0.63 -0.91 1.24 -1.12 -0.33 0.00 0.00 177.00 176.51 1vam s SER 223 N -1.86 6.99 -1.23 2.53 0.01 -1.26 -2.92 113.70 115.96 1vam s SER 223 Ca 0.72 2.42 0.00 0.00 1.31 0.00 0.00 55.95 60.40 1vam s SER 223 Cb -0.24 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.37 1vam s SER 223 CO 0.29 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 174.15 1vam n GLY 224 N 1.61 1.27 0.07 3.44 0.00 -1.26 -4.88 105.19 105.44 1vam n GLY 224 Ca 0.02 -0.47 0.05 0.00 0.00 0.00 0.00 46.02 45.63 1vam n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vam n SER 225 N 0.08 0.20 -3.15 1.61 3.41 -1.15 -4.89 113.62 109.72 1vam n SER 225 Ca -0.12 -1.71 -0.19 0.00 -0.26 0.00 0.00 58.87 56.60 1vam n SER 225 Cb 0.39 -0.02 0.17 0.00 -0.26 0.00 0.00 64.21 64.49 1vam n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1vam n THR 226 N -0.54 0.00 -0.42 6.66 -2.24 -1.26 -0.88 114.28 115.60 1vam n THR 226 Ca 0.08 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1vam n THR 226 Cb 0.07 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.37 1vam n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vam n GLY 227 N -2.72 2.92 0.45 3.38 0.00 -0.21 -2.33 105.19 106.68 1vam n GLY 227 Ca 0.09 -0.09 0.23 0.00 0.00 0.00 0.00 46.02 46.25 1vam n GLY 227 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1vam h ARG 228 N 0.00 0.00 -0.01 1.61 0.11 -1.88 -0.44 114.38 113.76 1vam h ARG 228 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1vam h ARG 228 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1vam h ARG 228 CO 0.00 0.00 -0.02 1.28 0.10 0.00 0.00 179.97 181.33 1vam n LEU 229 N -3.36 1.46 -1.04 0.08 4.77 -0.98 -4.96 117.00 112.97 1vam n LEU 229 Ca 0.14 -0.48 -0.09 0.00 -0.03 0.00 0.00 56.01 55.55 1vam n LEU 229 Cb 1.07 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 42.11 1vam n LEU 229 CO 0.23 0.25 -0.09 0.18 -1.33 0.00 0.00 177.39 176.63 1vam n LEU 230 N 0.11 -0.54 -0.24 2.23 4.77 -0.18 -1.28 117.00 121.87 1vam n LEU 230 Ca 0.18 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.36 1vam n LEU 230 Cb 0.35 -1.79 -0.01 0.00 -2.33 0.00 0.00 43.42 39.64 1vam n LEU 230 CO 0.17 -0.61 -0.03 0.61 -1.33 0.00 0.00 177.39 176.21 1vam n GLY 231 N -0.04 0.63 0.44 -0.72 0.00 -0.06 -4.17 105.19 101.25 1vam n GLY 231 Ca -0.09 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 1vam n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vam n LEU 232 N -0.36 1.55 -4.71 0.99 4.77 -0.41 -4.55 117.00 114.28 1vam n LEU 232 Ca -0.03 0.08 -0.27 0.00 -0.03 0.00 0.00 56.01 55.76 1vam n LEU 232 Cb 0.14 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 1vam n LEU 232 CO 0.05 0.40 -0.30 -0.36 -1.33 0.00 0.00 177.39 175.85 1vam s PHE 233 N -2.23 2.97 -0.89 -1.77 0.08 -1.18 -4.76 117.98 110.21 1vam s PHE 233 Ca -0.17 -0.07 0.28 0.00 0.12 0.00 0.00 56.93 57.09 1vam s PHE 233 Cb 0.06 -1.46 1.03 0.00 -0.57 0.00 0.00 43.02 42.08 1vam s PHE 233 CO 0.23 0.51 1.84 -0.35 -0.10 0.00 0.00 175.22 177.35 1vam n PRO 234 N -0.03 0.11 -3.77 0.24 -0.04 -1.26 -4.54 135.00 125.71 1vam n PRO 234 Ca -0.09 0.09 -0.03 0.00 -0.04 0.00 0.00 63.50 63.42 1vam n PRO 234 Cb 0.54 -1.62 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 1vam n PRO 234 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1vam s ASP 235 N -3.62 -0.13 -0.71 3.54 1.47 -1.26 -4.90 116.67 111.06 1vam s ASP 235 Ca 0.12 -0.46 -0.03 0.00 1.18 0.00 0.00 52.55 53.37 1vam s ASP 235 Cb 0.16 0.48 0.25 0.00 -0.34 0.00 0.00 42.92 43.47 1vam s ASP 235 CO 0.56 -0.90 2.29 0.00 0.68 0.00 0.00 175.17 177.80 1vam n ALA 236 N -0.52 6.49 1.12 2.11 0.00 -1.26 -4.64 120.51 123.81 1vam n ALA 236 Ca -0.06 -3.72 0.12 0.00 0.00 0.00 0.00 53.44 49.79 1vam n ALA 236 Cb 0.61 -2.04 0.20 0.00 0.00 0.00 0.00 19.45 18.21 1vam n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59