#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tei s ASP 2 N 0.00 6.56 -0.34 0.00 1.01 -1.26 -5.05 116.67 117.59 1tei s ASP 2 Ca 0.00 1.04 -0.12 0.00 0.71 0.00 0.00 52.55 54.18 1tei s ASP 2 Cb 0.00 -2.28 -0.01 0.00 1.01 0.00 0.00 42.92 41.64 1tei s ASP 2 CO 0.00 -0.28 0.22 -0.89 0.21 0.00 0.00 175.17 174.43 1tei s THR 3 N -2.17 5.07 -0.07 -1.27 2.01 -1.26 -5.03 115.64 112.92 1tei s THR 3 Ca 0.50 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 62.21 1tei s THR 3 Cb -0.10 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 1tei s THR 3 CO 0.27 -0.03 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.31 1tei s ILE 4 N 1.68 2.19 -0.13 1.82 -1.09 -1.26 -3.53 121.20 120.88 1tei s ILE 4 Ca 0.05 -1.01 -0.00 0.00 -2.23 0.00 0.00 60.65 57.46 1tei s ILE 4 Cb -0.18 -1.81 0.03 0.00 -1.58 0.00 0.00 42.46 38.92 1tei s ILE 4 CO 0.09 0.57 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.59 1tei s VAL 5 N -0.11 1.20 0.07 2.92 1.01 -0.90 0.09 120.40 124.68 1tei s VAL 5 Ca -0.05 -0.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1tei s VAL 5 Cb -0.14 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1tei s VAL 5 CO 0.04 0.37 0.02 0.00 0.00 0.00 0.00 175.10 175.52 1tei s ALA 6 N 1.63 0.48 -0.25 5.51 0.00 -0.09 -0.82 121.76 128.22 1tei s ALA 6 Ca 0.04 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.84 1tei s ALA 6 Cb -0.13 0.41 0.06 0.00 0.00 0.00 0.00 23.12 23.47 1tei s ALA 6 CO -0.09 -0.41 -0.06 0.08 0.00 0.00 0.00 175.76 175.28 1tei s VAL 7 N -3.94 1.76 -0.08 0.00 1.01 -0.29 -0.52 120.40 118.34 1tei s VAL 7 Ca 0.10 -1.44 -0.06 0.00 0.00 0.00 0.00 61.98 60.59 1tei s VAL 7 Cb 0.07 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1tei s VAL 7 CO -0.08 -0.13 0.16 -1.83 0.00 0.00 0.00 175.10 173.22 1tei s GLU 8 N 1.28 3.45 -0.85 2.72 -1.05 -0.08 -1.16 118.70 123.01 1tei s GLU 8 Ca -0.05 -0.18 -0.02 0.00 -0.15 0.00 0.00 54.97 54.57 1tei s GLU 8 Cb -0.19 -3.16 0.21 0.00 -0.44 0.00 0.00 34.13 30.55 1tei s GLU 8 CO -0.07 0.75 0.73 -0.51 0.95 0.00 0.00 175.26 177.11 1tei s LEU 9 N -1.31 5.54 -0.53 1.83 1.02 0.12 -0.91 118.68 124.43 1tei s LEU 9 Ca 0.19 -3.55 -0.28 0.00 0.02 0.00 0.00 54.13 50.51 1tei s LEU 9 Cb -0.12 -1.91 0.03 0.00 0.02 0.00 0.00 46.19 44.20 1tei s LEU 9 CO 0.09 -0.23 1.21 -0.62 0.02 0.00 0.00 176.35 176.83 1tei s ASP 10 N 0.07 6.47 0.30 2.29 -1.08 0.53 -1.84 116.67 123.41 1tei s ASP 10 Ca 0.25 0.30 0.23 0.00 -0.52 0.00 0.00 52.55 52.81 1tei s ASP 10 Cb -0.10 -2.55 0.18 0.00 -1.46 0.00 0.00 42.92 39.00 1tei s ASP 10 CO -0.11 -1.43 1.32 0.71 0.52 0.00 0.00 175.17 176.19 1tei h THR 11 N 6.23 0.00 -3.13 1.71 1.35 -1.66 -1.26 112.91 116.16 1tei h THR 11 Ca -0.25 -0.96 -0.66 0.00 -0.55 0.00 0.00 66.41 63.99 1tei h THR 11 Cb 1.06 1.70 -0.35 0.00 -1.73 0.00 0.00 68.15 68.83 1tei h THR 11 CO 1.16 0.00 -0.86 -0.47 -0.25 0.00 0.00 175.52 175.10 1tei s TYR 12 N -3.28 2.61 -0.23 4.73 5.04 -1.22 -4.59 117.35 120.41 1tei s TYR 12 Ca 0.03 -1.44 -0.29 0.00 -2.44 0.00 0.00 57.07 52.93 1tei s TYR 12 Cb 0.08 -1.81 -0.00 0.00 0.35 0.00 0.00 41.96 40.58 1tei s TYR 12 CO 0.73 -0.70 1.20 -1.25 -1.34 0.00 0.00 175.55 174.19 1tei s PRO 13 N 1.13 4.14 -0.83 4.97 0.04 -1.26 -4.93 135.00 138.25 1tei s PRO 13 Ca 0.00 1.42 0.01 0.00 0.04 0.00 0.00 61.00 62.47 1tei s PRO 13 Cb -0.14 -3.76 0.25 0.00 0.04 0.00 0.00 34.50 30.89 1tei s PRO 13 CO -0.08 -0.82 0.92 0.09 0.04 0.00 0.00 177.00 177.15 1tei n ASN 14 N 6.84 4.51 0.28 6.66 4.13 -1.26 -4.90 115.26 131.50 1tei n ASN 14 Ca 0.13 -3.33 0.18 0.00 1.68 0.00 0.00 54.58 53.25 1tei n ASN 14 Cb 0.46 -0.94 0.91 0.00 -1.54 0.00 0.00 39.78 38.67 1tei n ASN 14 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1tei h THR 15 N 3.58 0.18 0.00 3.41 1.35 -1.83 -0.97 112.91 118.62 1tei h THR 15 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.05 1tei h THR 15 Cb 0.70 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 1tei h THR 15 CO 0.96 0.00 0.00 -2.24 -0.25 0.00 0.00 175.52 173.99 1tei h ASP 16 N 0.00 0.00 -0.18 5.36 2.03 -1.90 -2.50 116.42 119.23 1tei h ASP 16 Ca 0.04 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.32 1tei h ASP 16 Cb 0.48 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.97 1tei h ASP 16 CO -0.00 0.00 -0.03 2.30 -1.03 0.00 0.00 179.24 180.48 1tei n ILE 17 N -3.07 2.20 0.00 4.15 -5.35 -0.39 -4.97 119.36 111.93 1tei n ILE 17 Ca -0.01 -2.18 0.00 0.00 -0.27 0.00 0.00 62.75 60.29 1tei n ILE 17 Cb 0.21 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.85 1tei n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tei n GLY 18 N -0.92 0.19 3.75 3.28 0.00 -0.94 -4.73 105.19 105.82 1tei n GLY 18 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 1tei n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tei s ASP 19 N -2.25 5.08 0.81 1.61 1.11 -1.11 -4.94 116.67 116.97 1tei s ASP 19 Ca 0.00 2.47 -0.11 0.00 0.18 0.00 0.00 52.55 55.08 1tei s ASP 19 Cb 0.00 -2.61 0.08 0.00 1.07 0.00 0.00 42.92 41.46 1tei s ASP 19 CO 0.00 -1.68 1.09 -2.84 1.18 0.00 0.00 175.17 172.92 1tei s PRO 20 N -3.30 1.97 -0.04 8.23 0.02 -1.26 -4.20 135.00 136.41 1tei s PRO 20 Ca 0.78 0.82 -0.00 0.00 0.02 0.00 0.00 61.00 62.62 1tei s PRO 20 Cb -0.33 -1.89 0.03 0.00 0.02 0.00 0.00 34.50 32.33 1tei s PRO 20 CO 0.35 -1.75 1.77 -1.13 -0.33 0.00 0.00 177.00 175.92 1tei n SER 21 N -3.55 4.90 -3.53 2.53 3.41 -1.26 -4.60 113.62 111.52 1tei n SER 21 Ca 0.07 -2.40 -0.09 0.00 -0.26 0.00 0.00 58.87 56.20 1tei n SER 21 Cb 0.55 -0.98 -0.02 0.00 -0.26 0.00 0.00 64.21 63.51 1tei n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1tei s TYR 22 N -0.22 -0.39 0.41 7.33 -0.85 -1.26 -4.99 117.35 117.38 1tei s TYR 22 Ca 0.04 0.17 -0.26 0.00 -0.52 0.00 0.00 57.07 56.50 1tei s TYR 22 Cb 0.03 0.58 -0.10 0.00 0.38 0.00 0.00 41.96 42.85 1tei s TYR 22 CO 0.00 -0.78 1.29 -2.30 -1.52 0.00 0.00 175.55 172.23 1tei n PRO 23 N -0.35 1.99 -3.92 -3.49 -0.02 -1.26 -4.62 135.00 123.33 1tei n PRO 23 Ca -0.12 0.71 -0.09 0.00 -2.02 0.00 0.00 63.50 61.98 1tei n PRO 23 Cb 0.63 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1tei n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1tei s HIS 24 N -1.19 0.14 0.06 6.00 -3.43 -0.48 -1.40 115.29 115.00 1tei s HIS 24 Ca 0.60 -0.59 0.09 0.00 -0.80 0.00 0.00 55.06 54.36 1tei s HIS 24 Cb -0.51 0.49 -0.03 0.00 -1.43 0.00 0.00 32.58 31.10 1tei s HIS 24 CO 0.59 -1.20 -0.23 0.96 -2.00 0.00 0.00 174.74 172.86 1tei s ILE 25 N -3.64 2.44 0.17 -5.38 -4.36 -0.86 -0.35 121.20 109.22 1tei s ILE 25 Ca 0.17 -1.36 -0.12 0.00 -0.26 0.00 0.00 60.65 59.08 1tei s ILE 25 Cb -0.04 -2.00 0.00 0.00 1.25 0.00 0.00 42.46 41.67 1tei s ILE 25 CO 0.09 0.31 0.36 -0.83 0.24 0.00 0.00 174.94 175.11 1tei s GLY 26 N -1.46 0.26 -0.29 6.27 0.00 -0.09 -1.88 107.32 110.13 1tei s GLY 26 Ca 0.13 -0.64 -0.05 0.00 0.00 0.00 0.00 44.72 44.16 1tei s GLY 26 CO 0.04 -0.64 0.04 -0.42 0.00 0.00 0.00 173.10 172.12 1tei s ILE 27 N -3.93 3.55 -0.21 0.90 1.01 -0.46 -0.90 121.20 121.16 1tei s ILE 27 Ca 0.14 -0.93 -0.07 0.00 0.00 0.00 0.00 60.65 59.78 1tei s ILE 27 Cb 0.02 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 1tei s ILE 27 CO -0.02 0.04 0.06 -1.81 0.00 0.00 0.00 174.94 173.21 1tei s ASP 28 N 1.41 5.28 -0.37 3.58 1.01 0.32 -0.67 116.67 127.23 1tei s ASP 28 Ca 0.00 -0.09 0.01 0.00 0.71 0.00 0.00 52.55 53.18 1tei s ASP 28 Cb -0.18 -1.92 0.10 0.00 1.01 0.00 0.00 42.92 41.93 1tei s ASP 28 CO 0.00 0.06 0.12 -0.63 0.21 0.00 0.00 175.17 174.94 1tei s ILE 29 N 1.02 2.78 -0.20 0.77 -1.09 -1.26 -0.92 121.20 122.30 1tei s ILE 29 Ca 0.04 -2.18 0.00 0.00 -2.23 0.00 0.00 60.65 56.27 1tei s ILE 29 Cb -0.14 -2.96 0.00 0.00 -1.58 0.00 0.00 42.46 37.78 1tei s ILE 29 CO 0.03 -0.63 0.00 0.29 -1.23 0.00 0.00 174.94 173.40 1tei n LYS 30 N 4.43 -1.62 -3.59 2.79 5.02 0.11 -4.92 118.16 120.38 1tei n LYS 30 Ca 0.01 0.49 -0.16 0.00 -2.02 0.00 0.00 58.31 56.63 1tei n LYS 30 Cb 0.42 -4.74 -0.07 0.00 -0.02 0.00 0.00 35.03 30.61 1tei n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1tei s SER 31 N -2.09 -0.61 0.25 4.39 0.15 -1.26 -4.92 113.70 109.61 1tei s SER 31 Ca 0.00 0.81 0.23 0.00 0.70 0.00 0.00 55.95 57.70 1tei s SER 31 Cb 0.00 0.74 0.96 0.00 -1.71 0.00 0.00 66.02 66.01 1tei s SER 31 CO 0.00 -0.48 1.70 0.55 1.20 0.00 0.00 173.24 176.21 1tei n VAL 32 N 1.47 0.83 -2.76 4.45 3.14 -1.26 -4.28 118.33 119.92 1tei n VAL 32 Ca -0.18 0.23 -0.42 0.00 -2.96 0.00 0.00 64.34 61.00 1tei n VAL 32 Cb 0.56 -1.15 -0.03 0.00 -1.06 0.00 0.00 33.84 32.16 1tei n VAL 32 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1tei s ARG 33 N -3.30 3.43 0.14 1.45 0.52 -1.26 -4.98 118.95 114.94 1tei s ARG 33 Ca 0.04 -1.16 -0.33 0.00 -0.52 0.00 0.00 55.73 53.75 1tei s ARG 33 Cb 0.09 -4.79 -0.17 0.00 0.52 0.00 0.00 34.95 30.61 1tei s ARG 33 CO 0.39 -1.96 0.98 0.43 0.02 0.00 0.00 175.30 175.16 1tei n SER 34 N 7.85 0.37 0.24 0.23 7.64 -1.26 -4.81 113.62 123.89 1tei n SER 34 Ca 0.17 1.14 0.15 0.00 1.01 0.00 0.00 58.87 61.34 1tei n SER 34 Cb 0.49 -1.08 0.44 0.00 -1.01 0.00 0.00 64.21 63.05 1tei n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1tei h LYS 35 N 2.68 0.00 -1.96 1.43 1.79 -1.24 -3.45 116.57 115.83 1tei h LYS 35 Ca -0.42 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.02 1tei h LYS 35 Cb 1.39 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.83 1tei h LYS 35 CO 0.65 0.00 0.17 0.21 -1.08 0.00 0.00 179.45 179.41 1tei s LYS 36 N -3.44 0.85 0.24 3.15 2.47 -1.24 -5.02 119.74 116.75 1tei s LYS 36 Ca 0.04 0.82 0.01 0.00 -1.56 0.00 0.00 55.97 55.28 1tei s LYS 36 Cb 0.07 0.41 -0.04 0.00 -1.46 0.00 0.00 37.83 36.82 1tei s LYS 36 CO 0.60 -0.14 0.19 0.95 0.16 0.00 0.00 175.35 177.11 1tei s THR 37 N 0.06 0.00 -0.17 3.43 -4.23 -1.26 -1.35 115.64 112.12 1tei s THR 37 Ca -0.02 -1.98 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 1tei s THR 37 Cb -0.04 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.35 1tei s THR 37 CO 0.02 0.00 0.47 0.00 -0.54 0.00 0.00 174.62 174.57 1tei s ALA 38 N -3.92 -1.17 0.30 3.99 0.00 -0.79 -4.98 121.76 115.19 1tei s ALA 38 Ca 0.39 1.30 -0.30 0.00 0.00 0.00 0.00 51.96 53.35 1tei s ALA 38 Cb 0.05 -0.74 -0.12 0.00 0.00 0.00 0.00 23.12 22.32 1tei s ALA 38 CO 0.17 -0.23 1.56 1.17 0.00 0.00 0.00 175.76 178.44 1tei n LYS 39 N 2.74 2.62 -3.95 0.00 4.81 -1.26 -2.02 118.16 121.10 1tei n LYS 39 Ca -0.14 0.93 -0.29 0.00 -0.87 0.00 0.00 58.31 57.95 1tei n LYS 39 Cb 0.57 -2.70 -0.16 0.00 0.02 0.00 0.00 35.03 32.76 1tei n LYS 39 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 1tei s TRP 40 N -0.12 1.92 -1.32 5.64 -0.00 -0.49 -4.78 118.94 119.79 1tei s TRP 40 Ca 0.63 -1.13 -0.14 0.00 -0.00 0.00 0.00 56.10 55.47 1tei s TRP 40 Cb -0.51 -1.44 0.11 0.00 -0.00 0.00 0.00 33.47 31.63 1tei s TRP 40 CO 0.50 -0.63 1.85 0.09 -0.00 0.00 0.00 176.95 178.76 1tei n ASN 41 N 4.83 4.73 -4.69 5.86 3.02 -1.26 -4.43 115.26 123.31 1tei n ASN 41 Ca -0.14 -2.96 -0.44 0.00 -0.03 0.00 0.00 54.58 51.01 1tei n ASN 41 Cb 0.49 -1.62 -0.03 0.00 -0.61 0.00 0.00 39.78 38.01 1tei n ASN 41 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1tei n MET 42 N 6.00 2.32 -3.75 3.52 0.00 -1.26 -4.97 117.12 118.98 1tei n MET 42 Ca 0.45 0.83 -0.36 0.00 -0.00 0.00 0.00 57.70 58.62 1tei n MET 42 Cb 0.41 -2.58 -0.11 0.00 0.00 0.00 0.00 33.22 30.94 1tei n MET 42 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 1tei s GLN 43 N 0.21 2.20 -0.15 2.12 -0.21 -1.26 -5.07 119.66 117.51 1tei s GLN 43 Ca 0.72 -2.05 -0.39 0.00 0.02 0.00 0.00 55.36 53.66 1tei s GLN 43 Cb -0.61 -3.64 -0.16 0.00 1.00 0.00 0.00 33.01 29.60 1tei s GLN 43 CO 0.43 -1.11 1.63 -1.71 -2.12 0.00 0.00 175.29 172.41 1tei n ASN 44 N 4.24 2.25 0.00 5.90 2.85 -1.26 -1.55 115.26 127.69 1tei n ASN 44 Ca 0.01 1.08 0.00 0.00 -0.11 0.00 0.00 54.58 55.56 1tei n ASN 44 Cb 0.40 -1.18 0.00 0.00 1.24 0.00 0.00 39.78 40.24 1tei n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1tei n GLY 45 N 3.69 1.06 3.62 8.20 0.00 -0.15 -4.99 105.19 116.63 1tei n GLY 45 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1tei n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tei s LYS 46 N -0.40 2.40 -0.16 1.61 1.02 -0.60 -4.95 119.74 118.67 1tei s LYS 46 Ca 0.00 -0.87 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 1tei s LYS 46 Cb 0.00 -2.45 -0.01 0.00 -0.52 0.00 0.00 37.83 34.86 1tei s LYS 46 CO 0.00 0.55 1.11 0.08 -0.92 0.00 0.00 175.35 176.17 1tei s VAL 47 N -1.18 4.55 0.44 3.17 1.01 -1.26 -4.24 120.40 122.90 1tei s VAL 47 Ca 0.21 1.86 0.06 0.00 0.00 0.00 0.00 61.98 64.12 1tei s VAL 47 Cb -0.11 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 1tei s VAL 47 CO 0.13 -0.10 0.18 -0.83 0.00 0.00 0.00 175.10 174.49 1tei s GLY 48 N 1.39 2.43 -0.04 4.51 0.00 -0.30 -4.63 107.32 110.69 1tei s GLY 48 Ca 0.49 -1.80 0.02 0.00 0.00 0.00 0.00 44.72 43.44 1tei s GLY 48 CO 0.13 -1.96 -0.09 -1.59 0.00 0.00 0.00 173.10 169.59 1tei s THR 49 N -2.66 0.82 -0.05 0.90 2.01 -0.25 -1.75 115.64 114.66 1tei s THR 49 Ca 0.36 -0.36 0.05 0.00 0.31 0.00 0.00 61.69 62.05 1tei s THR 49 Cb 0.03 -0.75 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 1tei s THR 49 CO 0.20 0.27 -0.18 0.00 -0.69 0.00 0.00 174.62 174.21 1tei s ALA 50 N 0.37 2.47 -0.12 7.40 0.00 -0.20 -1.44 121.76 130.24 1tei s ALA 50 Ca -0.06 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 1tei s ALA 50 Cb -0.11 -0.85 0.04 0.00 0.00 0.00 0.00 23.12 22.20 1tei s ALA 50 CO 0.01 0.50 0.01 -1.58 0.00 0.00 0.00 175.76 174.70 1tei s HIS 51 N -0.51 0.87 -0.07 0.00 5.04 0.23 -1.94 115.29 118.90 1tei s HIS 51 Ca 0.07 -0.46 0.01 0.00 -1.54 0.00 0.00 55.06 53.14 1tei s HIS 51 Cb -0.11 -0.92 -0.03 0.00 0.04 0.00 0.00 32.58 31.56 1tei s HIS 51 CO 0.01 -0.44 -0.07 0.42 -2.34 0.00 0.00 174.74 172.32 1tei s ILE 52 N 1.91 3.69 0.02 0.89 1.09 0.44 -1.08 121.20 128.16 1tei s ILE 52 Ca 0.03 -0.48 -0.05 0.00 -1.10 0.00 0.00 60.65 59.05 1tei s ILE 52 Cb -0.14 -2.51 -0.01 0.00 -1.06 0.00 0.00 42.46 38.74 1tei s ILE 52 CO -0.06 0.59 0.07 0.27 -0.10 0.00 0.00 174.94 175.71 1tei s ILE 53 N -0.73 0.11 -0.16 2.92 -4.36 -0.16 -0.89 121.20 117.93 1tei s ILE 53 Ca 0.11 -0.90 -0.28 0.00 -0.26 0.00 0.00 60.65 59.31 1tei s ILE 53 Cb -0.11 -0.55 0.07 0.00 1.25 0.00 0.00 42.46 43.12 1tei s ILE 53 CO 0.02 -0.50 0.72 -0.47 0.24 0.00 0.00 174.94 174.95 1tei s TYR 54 N -1.84 -0.70 -0.07 1.37 5.04 -0.97 -1.58 117.35 118.61 1tei s TYR 54 Ca -0.12 1.45 -0.10 0.00 -2.44 0.00 0.00 57.07 55.86 1tei s TYR 54 Cb -0.06 0.35 0.02 0.00 0.35 0.00 0.00 41.96 42.62 1tei s TYR 54 CO -0.01 -0.49 0.25 0.54 -1.34 0.00 0.00 175.55 174.50 1tei s ASN 55 N -0.47 -0.21 0.12 4.32 2.20 -1.26 -1.48 114.94 118.15 1tei s ASN 55 Ca -0.05 0.33 0.17 0.00 -0.94 0.00 0.00 52.86 52.37 1tei s ASN 55 Cb -0.02 0.44 0.72 0.00 -2.00 0.00 0.00 41.25 40.39 1tei s ASN 55 CO 0.05 -0.19 1.51 -1.54 -2.94 0.00 0.00 177.10 173.99 1tei n SER 56 N 2.43 0.28 0.02 3.54 3.41 0.12 -0.84 113.62 122.58 1tei n SER 56 Ca -0.16 0.58 -0.10 0.00 -0.26 0.00 0.00 58.87 58.93 1tei n SER 56 Cb 0.57 -0.63 -0.07 0.00 -0.26 0.00 0.00 64.21 63.82 1tei n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1tei h VAL 57 N 0.00 0.89 0.00 -3.33 2.07 -1.90 -3.34 116.25 110.64 1tei h VAL 57 Ca 0.00 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 1tei h VAL 57 Cb 0.24 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1tei h VAL 57 CO 0.00 0.25 -0.50 0.44 0.02 0.00 0.00 177.57 177.79 1tei h ASP 58 N -0.90 0.00 -6.32 0.57 3.32 -1.97 -3.47 116.42 107.64 1tei h ASP 58 Ca -0.02 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.57 1tei h ASP 58 Cb 0.53 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1tei h ASP 58 CO 0.03 0.13 -0.86 0.29 -1.72 0.00 0.00 179.24 177.10 1tei n LYS 59 N -2.98 -4.00 -4.15 3.56 5.02 -0.02 -4.89 118.16 110.70 1tei n LYS 59 Ca 0.01 0.50 -0.24 0.00 -2.02 0.00 0.00 58.31 56.56 1tei n LYS 59 Cb 0.60 -4.82 -0.17 0.00 -0.02 0.00 0.00 35.03 30.62 1tei n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1tei s ARG 60 N -6.31 1.32 -0.26 1.97 3.52 -1.25 -1.46 118.95 116.48 1tei s ARG 60 Ca 0.01 -0.23 -0.11 0.00 -0.13 0.00 0.00 55.73 55.27 1tei s ARG 60 Cb -0.01 -1.30 -0.05 0.00 -1.56 0.00 0.00 34.95 32.03 1tei s ARG 60 CO 0.86 -0.14 0.20 -1.17 -0.81 0.00 0.00 175.30 174.23 1tei s LEU 61 N 1.25 4.06 0.13 -0.88 2.96 -0.45 -4.06 118.68 121.69 1tei s LEU 61 Ca -0.04 0.08 0.06 0.00 -0.22 0.00 0.00 54.13 54.01 1tei s LEU 61 Cb -0.14 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1tei s LEU 61 CO -0.02 -0.02 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.41 1tei s SER 62 N 1.45 2.06 -0.00 3.68 0.01 -0.62 -1.38 113.70 118.91 1tei s SER 62 Ca 0.08 -0.82 -0.05 0.00 1.31 0.00 0.00 55.95 56.47 1tei s SER 62 Cb -0.15 -0.08 -0.00 0.00 0.21 0.00 0.00 66.02 66.00 1tei s SER 62 CO 0.08 -0.14 0.09 0.00 0.41 0.00 0.00 173.24 173.68 1tei s ALA 63 N -2.18 -0.20 -0.03 1.44 0.00 -0.33 -0.99 121.76 119.47 1tei s ALA 63 Ca 0.10 -0.14 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1tei s ALA 63 Cb -0.05 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.14 1tei s ALA 63 CO 0.03 -0.16 -0.03 0.08 0.00 0.00 0.00 175.76 175.68 1tei s VAL 64 N -1.05 0.40 -0.04 0.00 1.01 -0.24 -2.10 120.40 118.39 1tei s VAL 64 Ca -0.11 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.81 1tei s VAL 64 Cb -0.07 -0.42 -0.00 0.00 0.00 0.00 0.00 36.38 35.89 1tei s VAL 64 CO 0.01 0.17 -0.16 -0.69 0.00 0.00 0.00 175.10 174.42 1tei s VAL 65 N 0.62 1.35 0.17 2.92 1.01 -0.67 -0.60 120.40 125.20 1tei s VAL 65 Ca -0.07 -0.69 -0.21 0.00 0.00 0.00 0.00 61.98 61.01 1tei s VAL 65 Cb -0.11 -1.16 0.05 0.00 0.00 0.00 0.00 36.38 35.17 1tei s VAL 65 CO -0.00 0.39 0.57 -0.94 0.00 0.00 0.00 175.10 175.12 1tei s SER 66 N -0.04 -0.45 0.18 3.32 1.04 -0.52 -0.80 113.70 116.43 1tei s SER 66 Ca -0.02 -0.17 0.09 0.00 0.48 0.00 0.00 55.95 56.34 1tei s SER 66 Cb -0.10 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1tei s SER 66 CO 0.01 -1.00 -0.18 -0.31 0.98 0.00 0.00 173.24 172.74 1tei s TYR 67 N -3.79 1.90 0.52 5.02 2.02 -1.26 -1.09 117.35 120.66 1tei s TYR 67 Ca 0.03 -0.46 -0.23 0.00 -0.37 0.00 0.00 57.07 56.04 1tei s TYR 67 Cb -0.01 -0.92 -0.06 0.00 -0.40 0.00 0.00 41.96 40.57 1tei s TYR 67 CO -0.10 0.39 1.40 -2.14 -1.57 0.00 0.00 175.55 173.53 1tei s PRO 68 N -2.96 3.31 -1.47 -1.71 0.02 -1.26 -2.91 135.00 128.01 1tei s PRO 68 Ca 0.18 2.33 -0.06 0.00 0.02 0.00 0.00 61.00 63.47 1tei s PRO 68 Cb -0.05 -2.40 0.05 0.00 0.02 0.00 0.00 34.50 32.12 1tei s PRO 68 CO 0.08 -1.09 0.63 0.09 -0.33 0.00 0.00 177.00 176.38 1tei n ASN 69 N -0.75 -1.80 -3.63 2.53 5.03 -1.26 -4.96 115.26 110.41 1tei n ASN 69 Ca 0.09 -0.94 -0.13 0.00 0.87 0.00 0.00 54.58 54.47 1tei n ASN 69 Cb 0.44 -3.29 -0.06 0.00 -1.02 0.00 0.00 39.78 35.85 1tei n ASN 69 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1tei s ALA 70 N -3.67 -1.09 0.54 5.41 0.00 -1.15 -5.16 121.76 116.65 1tei s ALA 70 Ca 0.27 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.37 1tei s ALA 70 Cb -0.14 0.41 -0.06 0.00 0.00 0.00 0.00 23.12 23.33 1tei s ALA 70 CO 0.88 -0.50 1.14 -0.51 0.00 0.00 0.00 175.76 176.77 1tei s ASP 71 N -2.12 5.70 0.05 0.00 1.01 -1.26 -4.61 116.67 115.44 1tei s ASP 71 Ca -0.04 2.22 0.01 0.00 0.71 0.00 0.00 52.55 55.45 1tei s ASP 71 Cb -0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1tei s ASP 71 CO -0.04 -1.24 0.12 -0.94 0.21 0.00 0.00 175.17 173.29 1tei s SER 72 N -1.70 5.83 -0.07 0.27 1.04 -1.26 -4.55 113.70 113.25 1tei s SER 72 Ca 0.72 0.12 -0.13 0.00 0.48 0.00 0.00 55.95 57.15 1tei s SER 72 Cb -0.25 -1.67 -0.05 0.00 0.10 0.00 0.00 66.02 64.14 1tei s SER 72 CO 0.28 0.21 0.33 0.00 0.98 0.00 0.00 173.24 175.03 1tei s ALA 73 N -1.36 3.71 0.04 5.32 0.00 0.02 -4.94 121.76 124.55 1tei s ALA 73 Ca 0.29 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 51.93 1tei s ALA 73 Cb -0.12 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.67 1tei s ALA 73 CO 0.21 0.41 -0.15 0.99 0.00 0.00 0.00 175.76 177.22 1tei s THR 74 N -0.66 1.16 -0.14 0.00 2.01 -1.26 -1.67 115.64 115.08 1tei s THR 74 Ca 0.20 -1.00 -0.10 0.00 0.31 0.00 0.00 61.69 61.10 1tei s THR 74 Cb -0.15 -1.04 0.04 0.00 0.01 0.00 0.00 72.50 71.36 1tei s THR 74 CO 0.09 0.03 0.34 0.54 -0.69 0.00 0.00 174.62 174.94 1tei s VAL 75 N -0.83 -0.01 0.07 3.82 0.11 -0.89 -4.72 120.40 117.95 1tei s VAL 75 Ca 0.02 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.14 1tei s VAL 75 Cb -0.08 -0.50 -0.03 0.00 -1.53 0.00 0.00 36.38 34.24 1tei s VAL 75 CO 0.01 0.02 -0.06 -0.44 -3.33 0.00 0.00 175.10 171.30 1tei s SER 76 N 0.70 0.94 -0.25 3.54 0.01 -1.26 -1.19 113.70 116.19 1tei s SER 76 Ca -0.04 -0.83 -0.19 0.00 1.31 0.00 0.00 55.95 56.20 1tei s SER 76 Cb -0.05 0.09 0.07 0.00 0.21 0.00 0.00 66.02 66.33 1tei s SER 76 CO -0.05 -0.39 0.64 -0.47 0.41 0.00 0.00 173.24 173.39 1tei s TYR 77 N -2.83 -0.85 -0.25 2.43 5.04 -0.48 -4.95 117.35 115.46 1tei s TYR 77 Ca 0.03 1.86 -0.28 0.00 -2.44 0.00 0.00 57.07 56.24 1tei s TYR 77 Cb -0.00 0.41 0.01 0.00 0.35 0.00 0.00 41.96 42.72 1tei s TYR 77 CO -0.03 -0.42 1.01 -0.51 -1.34 0.00 0.00 175.55 174.26 1tei s ASP 78 N 0.97 7.02 -0.19 4.32 1.01 -1.26 -1.34 116.67 127.20 1tei s ASP 78 Ca -0.05 1.25 -0.09 0.00 0.71 0.00 0.00 52.55 54.37 1tei s ASP 78 Cb -0.05 -2.52 0.07 0.00 1.01 0.00 0.00 42.92 41.43 1tei s ASP 78 CO -0.09 -0.69 0.43 0.54 0.21 0.00 0.00 175.17 175.57 1tei s VAL 79 N 3.24 -0.24 -0.66 -1.27 0.11 -0.54 -4.98 120.40 116.05 1tei s VAL 79 Ca 0.43 0.11 -0.22 0.00 -2.93 0.00 0.00 61.98 59.37 1tei s VAL 79 Cb -0.14 -0.66 0.07 0.00 -1.53 0.00 0.00 36.38 34.12 1tei s VAL 79 CO 0.08 0.05 0.95 -0.62 -3.33 0.00 0.00 175.10 172.23 1tei s ASP 80 N 1.83 6.19 0.64 3.54 -1.08 -1.26 -4.39 116.67 122.14 1tei s ASP 80 Ca -0.07 -1.05 0.36 0.00 -0.52 0.00 0.00 52.55 51.27 1tei s ASP 80 Cb -0.09 -2.41 2.02 0.00 -1.46 0.00 0.00 42.92 40.98 1tei s ASP 80 CO -0.13 -1.41 2.22 -0.07 0.52 0.00 0.00 175.17 176.30 1tei h LEU 81 N 11.23 0.00 -2.01 -1.34 3.38 -1.98 -1.27 115.31 123.33 1tei h LEU 81 Ca -0.28 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.70 1tei h LEU 81 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1tei h LEU 81 CO 1.18 0.00 0.02 0.44 0.09 0.00 0.00 178.44 180.17 1tei h ASP 82 N 0.00 0.00 -0.31 -0.43 3.32 -1.90 -0.11 116.42 116.98 1tei h ASP 82 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1tei h ASP 82 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1tei h ASP 82 CO -0.00 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.11 1tei n ASN 83 N -4.52 2.80 0.00 6.45 3.02 -0.48 -4.52 115.26 118.01 1tei n ASN 83 Ca -0.02 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1tei n ASN 83 Cb 0.12 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1tei n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1tei n VAL 84 N 1.06 0.00 -4.03 2.41 0.31 -0.17 -5.08 118.33 112.83 1tei n VAL 84 Ca 0.18 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.22 1tei n VAL 84 Cb 0.50 -0.56 -0.06 0.00 -0.91 0.00 0.00 33.84 32.81 1tei n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1tei s LEU 85 N -4.99 3.91 0.87 7.52 1.43 -0.49 -4.96 118.68 121.97 1tei s LEU 85 Ca 0.00 0.00 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 1tei s LEU 85 Cb 0.00 -2.55 0.11 0.00 0.03 0.00 0.00 46.19 43.78 1tei s LEU 85 CO 0.00 0.13 1.10 -2.16 0.23 0.00 0.00 176.35 175.65 1tei s PRO 86 N -2.68 1.46 0.29 1.29 0.04 -1.26 -4.77 135.00 129.37 1tei s PRO 86 Ca 0.31 0.71 0.01 0.00 0.04 0.00 0.00 61.00 62.06 1tei s PRO 86 Cb -0.12 -1.84 0.53 0.00 0.04 0.00 0.00 34.50 33.11 1tei s PRO 86 CO 0.24 -2.07 1.87 1.49 0.04 0.00 0.00 177.00 178.57 1tei h GLU 87 N -1.42 1.00 -5.70 4.56 4.81 -1.95 -3.41 114.58 112.48 1tei h GLU 87 Ca -0.49 -0.06 -0.67 0.00 -0.13 0.00 0.00 59.36 58.01 1tei h GLU 87 Cb 1.28 -0.23 -0.23 0.00 0.63 0.00 0.00 28.75 30.21 1tei h GLU 87 CO 0.57 0.66 -0.73 -1.58 -0.73 0.00 0.00 179.01 177.20 1tei s TRP 88 N -5.94 2.87 0.34 0.92 0.52 -1.26 -1.75 118.94 114.64 1tei s TRP 88 Ca -0.12 -0.32 0.04 0.00 0.02 0.00 0.00 56.10 55.72 1tei s TRP 88 Cb 0.21 -1.80 -0.02 0.00 -1.15 0.00 0.00 33.47 30.72 1tei s TRP 88 CO 0.81 0.03 0.36 0.14 0.02 0.00 0.00 176.95 178.31 1tei s VAL 89 N -0.13 0.00 0.04 4.03 -7.23 -0.10 -4.28 120.40 112.74 1tei s VAL 89 Ca 0.00 -1.84 0.06 0.00 -1.81 0.00 0.00 61.98 58.40 1tei s VAL 89 Cb -0.13 -2.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.22 1tei s VAL 89 CO 0.03 0.00 -0.18 -0.13 -0.31 0.00 0.00 175.10 174.51 1tei s ARG 90 N -3.26 1.19 0.12 4.82 0.52 -0.11 0.48 118.95 122.71 1tei s ARG 90 Ca 0.37 -0.86 0.08 0.00 -0.52 0.00 0.00 55.73 54.79 1tei s ARG 90 Cb 0.01 -1.27 -0.04 0.00 0.52 0.00 0.00 34.95 34.18 1tei s ARG 90 CO 0.25 0.32 -0.11 0.14 0.02 0.00 0.00 175.30 175.92 1tei s VAL 91 N -0.82 3.27 0.09 3.52 -7.23 -1.26 -1.08 120.40 116.89 1tei s VAL 91 Ca 0.05 -1.38 -0.10 0.00 -1.81 0.00 0.00 61.98 58.74 1tei s VAL 91 Cb -0.08 -2.54 0.03 0.00 0.56 0.00 0.00 36.38 34.35 1tei s VAL 91 CO 0.02 0.06 0.47 0.61 -0.31 0.00 0.00 175.10 175.95 1tei n GLY 92 N 0.58 1.00 3.26 2.32 0.00 0.58 -1.79 105.19 111.14 1tei n GLY 92 Ca -0.13 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 1tei n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tei s LEU 93 N 0.00 2.16 0.07 0.99 1.43 0.03 -0.51 118.68 122.85 1tei s LEU 93 Ca 0.10 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1tei s LEU 93 Cb -0.01 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 1tei s LEU 93 CO 0.03 0.17 -0.08 -0.55 0.23 0.00 0.00 176.35 176.16 1tei s SER 94 N -1.14 1.03 0.11 2.29 0.15 0.73 -1.49 113.70 115.38 1tei s SER 94 Ca 0.08 -0.77 -0.22 0.00 0.70 0.00 0.00 55.95 55.74 1tei s SER 94 Cb -0.09 0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.34 1tei s SER 94 CO 0.02 -0.32 0.55 0.00 1.20 0.00 0.00 173.24 174.69 1tei s ALA 95 N -2.43 -1.43 0.19 5.45 0.00 -0.67 -0.07 121.76 122.80 1tei s ALA 95 Ca 0.01 0.48 -0.22 0.00 0.00 0.00 0.00 51.96 52.23 1tei s ALA 95 Cb -0.03 0.66 0.05 0.00 0.00 0.00 0.00 23.12 23.81 1tei s ALA 95 CO -0.02 -0.65 0.63 -1.54 0.00 0.00 0.00 175.76 174.18 1tei s SER 96 N -2.46 -0.47 0.11 0.00 1.04 -1.12 -2.13 113.70 108.68 1tei s SER 96 Ca -0.01 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.24 1tei s SER 96 Cb -0.00 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1tei s SER 96 CO -0.08 -1.08 -0.02 0.42 0.98 0.00 0.00 173.24 173.46 1tei s THR 97 N -3.80 0.48 0.00 2.02 -4.23 -0.40 -0.55 115.64 109.16 1tei s THR 97 Ca 0.04 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 1tei s THR 97 Cb -0.02 -1.84 0.00 0.00 1.34 0.00 0.00 72.50 71.98 1tei s THR 97 CO -0.07 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 173.91 1tei n GLY 98 N -0.08 3.71 0.20 3.99 0.00 -1.26 -0.53 105.19 111.22 1tei n GLY 98 Ca -0.10 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1tei n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tei h LEU 99 N 0.00 0.63 -9.91 0.99 5.85 -1.97 -0.72 115.31 110.18 1tei h LEU 99 Ca 0.00 -0.30 -0.60 0.00 0.84 0.00 0.00 57.88 57.82 1tei h LEU 99 Cb 0.00 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1tei h LEU 99 CO 0.00 0.77 -0.41 -0.31 -0.34 0.00 0.00 178.44 178.15 1tei s TYR 100 N -5.04 3.51 0.48 1.25 2.02 -1.26 -4.82 117.35 113.48 1tei s TYR 100 Ca -0.13 0.41 0.02 0.00 -0.37 0.00 0.00 57.07 57.00 1tei s TYR 100 Cb 0.10 -1.88 -0.01 0.00 -0.40 0.00 0.00 41.96 39.76 1tei s TYR 100 CO 0.78 0.53 0.06 -1.59 -1.57 0.00 0.00 175.55 173.76 1tei s LYS 101 N -2.49 2.11 -0.22 -0.62 0.00 -1.25 -4.37 119.74 112.90 1tei s LYS 101 Ca 0.37 -2.34 -0.34 0.00 0.00 0.00 0.00 55.97 53.65 1tei s LYS 101 Cb -0.13 -1.10 0.15 0.00 0.00 0.00 0.00 37.83 36.75 1tei s LYS 101 CO 0.25 -0.45 1.25 -1.83 0.00 0.00 0.00 175.35 174.57 1tei s GLU 102 N -3.79 0.24 0.22 1.78 -1.05 -1.15 -3.38 118.70 111.57 1tei s GLU 102 Ca 0.11 -0.06 -0.19 0.00 -0.15 0.00 0.00 54.97 54.69 1tei s GLU 102 Cb 0.01 0.11 -0.08 0.00 -0.44 0.00 0.00 34.13 33.73 1tei s GLU 102 CO 0.07 -0.10 0.71 0.95 0.95 0.00 0.00 175.26 177.85 1tei s THR 103 N -2.01 4.59 -0.58 1.83 -4.23 0.78 -4.76 115.64 111.25 1tei s THR 103 Ca 0.09 1.24 0.06 0.00 -1.18 0.00 0.00 61.69 61.90 1tei s THR 103 Cb -0.01 -3.84 0.29 0.00 1.34 0.00 0.00 72.50 70.28 1tei s THR 103 CO -0.04 0.19 0.79 0.59 -0.54 0.00 0.00 174.62 175.61 1tei n ASN 104 N 0.68 3.52 -4.71 3.99 5.03 -1.26 -3.50 115.26 119.01 1tei n ASN 104 Ca -0.02 -3.43 -0.40 0.00 0.87 0.00 0.00 54.58 51.59 1tei n ASN 104 Cb 0.51 -0.63 -0.04 0.00 -1.02 0.00 0.00 39.78 38.60 1tei n ASN 104 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1tei s THR 105 N -3.02 4.99 -0.28 3.41 2.01 -1.08 -2.27 115.64 119.41 1tei s THR 105 Ca 0.43 1.56 -0.07 0.00 0.31 0.00 0.00 61.69 63.92 1tei s THR 105 Cb 0.21 -4.09 0.00 0.00 0.01 0.00 0.00 72.50 68.62 1tei s THR 105 CO -0.07 0.20 0.07 -0.63 -0.69 0.00 0.00 174.62 173.50 1tei s ILE 106 N 1.07 3.95 -0.22 1.82 -1.09 -0.26 -0.43 121.20 126.04 1tei s ILE 106 Ca 0.40 -0.61 0.21 0.00 -2.23 0.00 0.00 60.65 58.42 1tei s ILE 106 Cb -0.18 -2.99 -0.01 0.00 -1.58 0.00 0.00 42.46 37.70 1tei s ILE 106 CO 0.19 0.15 1.04 -0.07 -1.23 0.00 0.00 174.94 175.02 1tei h LEU 107 N 8.22 0.00 -7.00 2.97 4.07 -0.99 -2.11 115.31 120.47 1tei h LEU 107 Ca -0.33 0.00 0.04 0.00 0.08 0.00 0.00 57.88 57.67 1tei h LEU 107 Cb 1.14 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 42.71 1tei h LEU 107 CO 0.60 0.16 0.38 -0.94 -1.08 0.00 0.00 178.44 177.55 1tei s SER 108 N -5.56 -0.47 -0.28 -0.43 1.04 -1.23 -4.44 113.70 102.33 1tei s SER 108 Ca -0.00 0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.48 1tei s SER 108 Cb 0.09 0.45 0.09 0.00 0.10 0.00 0.00 66.02 66.75 1tei s SER 108 CO 0.79 -0.65 0.68 0.86 0.98 0.00 0.00 173.24 175.89 1tei s TRP 109 N -2.54 -1.09 0.05 5.02 -0.00 -0.23 -1.98 118.94 118.17 1tei s TRP 109 Ca -0.00 2.14 0.02 0.00 -0.00 0.00 0.00 56.10 58.26 1tei s TRP 109 Cb -0.01 0.65 -0.03 0.00 -0.00 0.00 0.00 33.47 34.08 1tei s TRP 109 CO -0.04 -0.54 -0.07 -1.54 -0.00 0.00 0.00 176.95 174.75 1tei s SER 110 N 1.80 0.88 -0.11 5.86 1.04 0.30 -0.47 113.70 123.01 1tei s SER 110 Ca -0.09 -0.64 -0.10 0.00 0.48 0.00 0.00 55.95 55.60 1tei s SER 110 Cb -0.06 0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.14 1tei s SER 110 CO -0.20 -0.26 0.29 0.12 0.98 0.00 0.00 173.24 174.17 1tei s PHE 111 N -1.83 -0.32 -0.05 5.02 5.36 -0.49 -1.67 117.98 123.99 1tei s PHE 111 Ca -0.06 0.78 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 1tei s PHE 111 Cb -0.07 0.11 0.02 0.00 -0.34 0.00 0.00 43.02 42.74 1tei s PHE 111 CO -0.01 -0.16 -0.02 0.99 -1.46 0.00 0.00 175.22 174.56 1tei s THR 112 N 0.27 0.41 -0.06 0.12 2.01 -0.25 -1.87 115.64 116.27 1tei s THR 112 Ca -0.01 -0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.01 1tei s THR 112 Cb -0.03 -0.48 0.01 0.00 0.01 0.00 0.00 72.50 72.01 1tei s THR 112 CO -0.01 0.21 -0.14 -0.55 -0.69 0.00 0.00 174.62 173.45 1tei s SER 113 N 1.19 1.92 -0.02 3.53 0.15 0.01 -0.73 113.70 119.75 1tei s SER 113 Ca -0.07 -0.32 0.03 0.00 0.70 0.00 0.00 55.95 56.28 1tei s SER 113 Cb -0.14 -0.82 0.00 0.00 -1.71 0.00 0.00 66.02 63.35 1tei s SER 113 CO -0.02 0.06 -0.10 -0.54 1.20 0.00 0.00 173.24 173.85 1tei s LYS 114 N 0.52 0.98 -0.12 5.44 1.02 -0.03 -1.27 119.74 126.27 1tei s LYS 114 Ca -0.13 -0.33 0.00 0.00 0.02 0.00 0.00 55.97 55.54 1tei s LYS 114 Cb -0.15 -0.92 0.02 0.00 -0.52 0.00 0.00 37.83 36.26 1tei s LYS 114 CO 0.04 0.14 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.98 1tei s LEU 115 N 0.11 1.50 -0.30 3.17 1.43 0.27 -1.22 118.68 123.65 1tei s LEU 115 Ca -0.02 -0.39 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1tei s LEU 115 Cb -0.08 -1.01 0.04 0.00 0.03 0.00 0.00 46.19 45.17 1tei s LEU 115 CO 0.00 -0.06 0.02 -0.75 0.23 0.00 0.00 176.35 175.79 1tei s LYS 116 N 1.42 2.63 0.62 1.70 2.20 0.59 -0.54 119.74 128.37 1tei s LYS 116 Ca 0.02 -1.14 -0.04 0.00 -0.36 0.00 0.00 55.97 54.44 1tei s LYS 116 Cb -0.13 -3.22 0.13 0.00 -1.51 0.00 0.00 37.83 33.10 1tei s LYS 116 CO -0.07 -0.56 0.85 0.45 -0.36 0.00 0.00 175.35 175.65 1tei n SER 117 N 4.70 0.73 -3.78 1.43 2.88 -1.01 0.12 113.62 118.69 1tei n SER 117 Ca -0.14 -1.71 -0.42 0.00 -1.33 0.00 0.00 58.87 55.27 1tei n SER 117 Cb 0.45 -0.59 -0.03 0.00 -0.75 0.00 0.00 64.21 63.30 1tei n SER 117 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1tei n ASN 118 N -3.16 3.33 -3.58 -3.46 4.13 -1.16 -4.57 115.26 106.78 1tei n ASN 118 Ca 0.13 -2.77 -0.07 0.00 1.68 0.00 0.00 54.58 53.54 1tei n ASN 118 Cb 0.45 -1.44 -0.02 0.00 -1.54 0.00 0.00 39.78 37.23 1tei n ASN 118 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1tei s SER 119 N 4.17 -0.34 -0.27 6.41 0.01 -1.26 -5.09 113.70 117.34 1tei s SER 119 Ca 0.53 -0.15 -0.28 0.00 1.31 0.00 0.00 55.95 57.35 1tei s SER 119 Cb 0.13 0.47 -0.03 0.00 0.21 0.00 0.00 66.02 66.80 1tei s SER 119 CO 0.02 -0.80 1.88 0.42 0.41 0.00 0.00 173.24 175.17 1tei s THR 120 N -3.31 3.37 -0.10 1.44 -4.23 -1.26 -3.12 115.64 108.43 1tei s THR 120 Ca 0.07 0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.97 1tei s THR 120 Cb -0.01 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.36 1tei s THR 120 CO -0.05 -0.28 0.00 1.57 -0.54 0.00 0.00 174.62 175.32 1tei n HIS 121 N 10.23 -0.01 -2.39 3.99 -0.00 -1.26 -4.84 115.22 120.94 1tei n HIS 121 Ca 0.24 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.59 1tei n HIS 121 Cb 0.46 -1.78 -0.03 0.00 -0.00 0.00 0.00 29.99 28.64 1tei n HIS 121 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1tei s GLU 122 N -1.71 3.33 -0.08 1.57 2.02 -1.18 -4.90 118.70 117.74 1tei s GLU 122 Ca 0.00 -1.24 0.03 0.00 0.02 0.00 0.00 54.97 53.78 1tei s GLU 122 Cb 0.00 -5.34 -0.02 0.00 0.10 0.00 0.00 34.13 28.87 1tei s GLU 122 CO 0.00 -2.74 -0.17 0.99 0.02 0.00 0.00 175.26 173.35 1tei s THR 123 N 6.73 2.73 -0.09 3.63 2.01 -1.26 -2.42 115.64 126.97 1tei s THR 123 Ca 0.57 -0.81 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 1tei s THR 123 Cb -0.00 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 1tei s THR 123 CO 0.01 0.56 -0.02 0.20 -0.69 0.00 0.00 174.62 174.68 1tei s ASN 124 N -0.17 4.99 0.07 3.53 -0.87 0.30 -4.95 114.94 117.85 1tei s ASN 124 Ca -0.01 0.05 -0.07 0.00 -1.57 0.00 0.00 52.86 51.25 1tei s ASN 124 Cb -0.14 -1.44 -0.01 0.00 -0.02 0.00 0.00 41.25 39.64 1tei s ASN 124 CO 0.03 0.33 0.14 0.00 -2.57 0.00 0.00 177.10 175.04 1tei s ALA 125 N -0.63 -0.09 -0.06 0.60 0.00 -1.26 -0.56 121.76 119.77 1tei s ALA 125 Ca 0.10 -0.69 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 1tei s ALA 125 Cb -0.12 0.40 0.02 0.00 0.00 0.00 0.00 23.12 23.43 1tei s ALA 125 CO 0.02 -0.45 0.14 -1.17 0.00 0.00 0.00 175.76 174.29 1tei s LEU 126 N -2.73 1.17 -0.17 0.00 2.96 -0.40 -5.00 118.68 114.51 1tei s LEU 126 Ca 0.03 0.28 -0.13 0.00 -0.22 0.00 0.00 54.13 54.09 1tei s LEU 126 Cb 0.04 0.40 0.05 0.00 0.50 0.00 0.00 46.19 47.19 1tei s LEU 126 CO -0.10 -0.09 0.43 -2.28 -1.32 0.00 0.00 176.35 172.99 1tei s HIS 127 N 0.55 -0.53 -0.01 5.38 5.65 -1.26 -0.81 115.29 124.27 1tei s HIS 127 Ca -0.04 1.22 -0.02 0.00 0.25 0.00 0.00 55.06 56.46 1tei s HIS 127 Cb -0.06 0.21 -0.00 0.00 -1.18 0.00 0.00 32.58 31.55 1tei s HIS 127 CO -0.03 -0.27 0.05 -0.59 -0.65 0.00 0.00 174.74 173.25 1tei s PHE 128 N 0.68 0.03 -0.04 3.88 -0.12 -0.78 -5.01 117.98 116.61 1tei s PHE 128 Ca -0.04 -0.05 -0.01 0.00 -0.05 0.00 0.00 56.93 56.78 1tei s PHE 128 Cb -0.05 -0.04 0.03 0.00 -0.63 0.00 0.00 43.02 42.33 1tei s PHE 128 CO -0.05 -0.11 0.04 1.41 -0.05 0.00 0.00 175.22 176.46 1tei s MET 129 N -0.55 0.06 -0.25 1.99 1.75 -1.26 -1.40 119.30 119.64 1tei s MET 129 Ca -0.06 0.27 -0.01 0.00 -1.25 0.00 0.00 55.69 54.63 1tei s MET 129 Cb -0.04 -0.51 0.03 0.00 2.84 0.00 0.00 34.83 37.16 1tei s MET 129 CO 0.00 -0.27 -0.07 -0.06 -0.65 0.00 0.00 175.02 173.98 1tei s PHE 130 N 1.76 3.09 -1.13 4.11 0.08 0.38 -4.93 117.98 121.35 1tei s PHE 130 Ca 0.00 -1.67 0.12 0.00 0.12 0.00 0.00 56.93 55.50 1tei s PHE 130 Cb -0.12 -2.05 0.01 0.00 -0.57 0.00 0.00 43.02 40.29 1tei s PHE 130 CO -0.03 -0.76 0.72 0.09 -0.10 0.00 0.00 175.22 175.14 1tei n ASN 131 N 4.64 1.41 -3.64 1.36 3.02 -1.26 -1.07 115.26 119.72 1tei n ASN 131 Ca -0.16 -1.21 -0.09 0.00 -0.03 0.00 0.00 54.58 53.09 1tei n ASN 131 Cb 0.46 0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 39.98 1tei n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1tei s GLN 132 N -1.45 0.73 -0.06 3.52 0.74 -1.26 -4.80 119.66 117.09 1tei s GLN 132 Ca 0.10 1.13 -0.01 0.00 0.05 0.00 0.00 55.36 56.63 1tei s GLN 132 Cb 0.10 0.22 -0.04 0.00 1.10 0.00 0.00 33.01 34.39 1tei s GLN 132 CO 0.28 -0.13 0.03 -0.06 -0.55 0.00 0.00 175.29 174.86 1tei s PHE 133 N 1.23 3.20 0.33 1.67 0.08 0.17 -5.03 117.98 119.64 1tei s PHE 133 Ca -0.07 0.20 0.07 0.00 0.12 0.00 0.00 56.93 57.25 1tei s PHE 133 Cb -0.05 -1.77 -0.02 0.00 -0.57 0.00 0.00 43.02 40.61 1tei s PHE 133 CO -0.13 0.51 0.37 -1.54 -0.10 0.00 0.00 175.22 174.33 1tei s SER 134 N -1.20 5.64 0.35 1.36 1.04 -1.26 -4.17 113.70 115.46 1tei s SER 134 Ca 0.17 -0.33 0.05 0.00 0.48 0.00 0.00 55.95 56.32 1tei s SER 134 Cb -0.12 -1.14 0.69 0.00 0.10 0.00 0.00 66.02 65.56 1tei s SER 134 CO 0.06 -0.37 1.95 0.50 0.98 0.00 0.00 173.24 176.36 1tei h LYS 135 N 1.09 0.79 -3.23 4.02 3.64 -1.87 -3.22 116.57 117.80 1tei h LYS 135 Ca -0.46 -0.05 -0.65 0.00 -1.27 0.00 0.00 60.65 58.22 1tei h LYS 135 Cb 1.25 -0.18 -0.39 0.00 -0.41 0.00 0.00 32.23 32.50 1tei h LYS 135 CO 0.56 0.53 -0.42 0.34 -2.27 0.00 0.00 179.45 178.18 1tei s ASP 136 N -6.15 5.14 -1.21 4.20 2.15 -1.26 -4.76 116.67 114.78 1tei s ASP 136 Ca -0.10 -3.64 -0.13 0.00 0.43 0.00 0.00 52.55 49.11 1tei s ASP 136 Cb 0.19 -1.74 0.18 0.00 -0.30 0.00 0.00 42.92 41.26 1tei s ASP 136 CO 0.78 -0.15 1.46 1.67 -0.17 0.00 0.00 175.17 178.76 1tei n GLN 137 N 2.33 3.41 0.15 4.34 -0.06 -1.22 -4.89 117.38 121.44 1tei n GLN 137 Ca 0.18 -3.86 0.09 0.00 -2.00 0.00 0.00 57.00 51.41 1tei n GLN 137 Cb 0.35 -3.00 0.48 0.00 -4.06 0.00 0.00 30.24 24.01 1tei n GLN 137 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1tei n LYS 138 N 5.30 0.11 -0.14 3.69 5.02 -1.26 -1.79 118.16 129.09 1tei n LYS 138 Ca 0.36 0.60 0.11 0.00 -2.02 0.00 0.00 58.31 57.37 1tei n LYS 138 Cb 0.42 -1.97 0.27 0.00 -0.02 0.00 0.00 35.03 33.73 1tei n LYS 138 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1tei n ASP 139 N -2.14 2.74 -4.40 4.39 5.68 -1.26 -4.89 116.55 116.67 1tei n ASP 139 Ca -0.01 -1.89 -0.32 0.00 -0.50 0.00 0.00 54.79 52.07 1tei n ASP 139 Cb 0.12 -0.19 -0.14 0.00 -1.14 0.00 0.00 41.12 39.77 1tei n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1tei s LEU 140 N -1.52 2.41 -0.41 -2.12 1.43 -0.74 -0.11 118.68 117.62 1tei s LEU 140 Ca 0.36 -0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 1tei s LEU 140 Cb 0.20 -1.45 0.05 0.00 0.03 0.00 0.00 46.19 45.03 1tei s LEU 140 CO 0.29 0.32 0.26 -0.63 0.23 0.00 0.00 176.35 176.83 1tei s ILE 141 N -0.70 4.60 -0.08 -0.59 1.01 0.46 -4.85 121.20 121.04 1tei s ILE 141 Ca 0.11 -1.08 -0.20 0.00 0.00 0.00 0.00 60.65 59.48 1tei s ILE 141 Cb -0.10 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1tei s ILE 141 CO 0.00 -0.40 0.55 -0.76 0.00 0.00 0.00 174.94 174.34 1tei s LEU 142 N 1.53 4.32 0.17 2.97 1.43 -1.26 -1.40 118.68 126.43 1tei s LEU 142 Ca 0.03 0.97 0.10 0.00 -1.03 0.00 0.00 54.13 54.20 1tei s LEU 142 Cb -0.21 -2.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1tei s LEU 142 CO 0.05 -0.00 -0.21 -1.10 0.23 0.00 0.00 176.35 175.31 1tei s GLN 143 N 0.48 1.38 6.07 1.70 -0.21 -0.09 -4.99 119.66 124.00 1tei s GLN 143 Ca 0.30 -1.44 0.00 0.00 0.02 0.00 0.00 55.36 54.23 1tei s GLN 143 Cb -0.16 -1.60 0.00 0.00 1.00 0.00 0.00 33.01 32.25 1tei s GLN 143 CO 0.14 0.34 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 1tei n GLY 144 N 0.36 2.56 0.54 3.09 0.00 -1.26 -1.82 105.19 108.65 1tei n GLY 144 Ca -0.13 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.54 1tei n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tei n ASP 145 N 2.59 1.58 -4.74 1.61 8.00 0.15 -4.93 116.55 120.82 1tei n ASP 145 Ca 0.00 -1.82 -0.41 0.00 0.71 0.00 0.00 54.79 53.26 1tei n ASP 145 Cb 0.00 -0.15 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 1tei n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tei s ALA 146 N -1.71 3.67 0.05 2.24 0.00 -1.07 -4.21 121.76 120.74 1tei s ALA 146 Ca 0.27 1.38 -0.05 0.00 0.00 0.00 0.00 51.96 53.55 1tei s ALA 146 Cb 0.14 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1tei s ALA 146 CO 0.21 -0.79 0.09 0.95 0.00 0.00 0.00 175.76 176.22 1tei s THR 147 N 0.15 0.15 0.37 0.00 -4.23 -0.28 -4.75 115.64 107.06 1tei s THR 147 Ca 0.61 -1.27 0.05 0.00 -1.18 0.00 0.00 61.69 59.90 1tei s THR 147 Cb -0.43 -1.16 -0.06 0.00 1.34 0.00 0.00 72.50 72.19 1tei s THR 147 CO 0.42 -0.70 0.04 0.42 -0.54 0.00 0.00 174.62 174.26 1tei s THR 148 N -3.25 1.42 0.00 3.99 -4.23 -1.26 -0.38 115.64 111.94 1tei s THR 148 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1tei s THR 148 Cb 0.03 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1tei s THR 148 CO -0.08 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 1tei n GLY 149 N -0.82 2.93 3.56 3.99 0.00 -1.05 -4.54 105.19 109.26 1tei n GLY 149 Ca -0.04 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 1tei n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tei s THR 150 N -2.13 3.14 -1.21 2.61 2.01 -1.25 -2.26 115.64 116.54 1tei s THR 150 Ca 0.00 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1tei s THR 150 Cb 0.00 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.19 1tei s THR 150 CO 0.00 -0.31 0.00 0.47 -0.69 0.00 0.00 174.62 174.09 1tei n ASP 151 N 16.23 -4.37 0.00 3.53 8.00 -1.26 -2.42 116.55 136.27 1tei n ASP 151 Ca 0.39 0.28 0.00 0.00 0.71 0.00 0.00 54.79 56.17 1tei n ASP 151 Cb 0.48 -2.89 0.00 0.00 -0.02 0.00 0.00 41.12 38.69 1tei n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tei n GLY 152 N -1.56 0.45 3.84 0.44 0.00 -0.96 -4.98 105.19 102.42 1tei n GLY 152 Ca -0.12 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 45.08 1tei n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tei s ASN 153 N -2.54 4.81 -0.26 1.61 0.01 -1.01 -0.66 114.94 116.90 1tei s ASN 153 Ca 0.00 -0.91 -0.03 0.00 -0.71 0.00 0.00 52.86 51.22 1tei s ASN 153 Cb 0.00 -0.42 0.02 0.00 0.41 0.00 0.00 41.25 41.26 1tei s ASN 153 CO 0.00 -0.68 -0.03 -0.22 -1.51 0.00 0.00 177.10 174.66 1tei s LEU 154 N -4.08 3.31 -0.52 0.60 2.96 -0.80 -2.51 118.68 117.64 1tei s LEU 154 Ca 0.44 -0.84 -0.17 0.00 -0.22 0.00 0.00 54.13 53.35 1tei s LEU 154 Cb -0.01 -1.71 0.10 0.00 0.50 0.00 0.00 46.19 45.07 1tei s LEU 154 CO 0.26 -0.14 0.52 -1.61 -1.32 0.00 0.00 176.35 174.06 1tei s GLU 155 N 1.36 3.02 0.19 1.98 0.41 0.49 -1.10 118.70 125.04 1tei s GLU 155 Ca 0.01 -1.41 -0.11 0.00 -0.41 0.00 0.00 54.97 53.05 1tei s GLU 155 Cb -0.17 -4.21 0.10 0.00 -1.78 0.00 0.00 34.13 28.07 1tei s GLU 155 CO -0.03 -1.26 1.76 -0.07 -0.49 0.00 0.00 175.26 175.17 1tei h LEU 156 N 9.17 0.88 -9.36 1.80 3.38 -1.71 -0.73 115.31 118.74 1tei h LEU 156 Ca -0.29 -0.14 -0.61 0.00 0.09 0.00 0.00 57.88 56.93 1tei h LEU 156 Cb 1.10 -0.23 -0.13 0.00 0.09 0.00 0.00 40.66 41.49 1tei h LEU 156 CO 0.99 0.78 -0.71 0.42 0.09 0.00 0.00 178.44 180.01 1tei s THR 157 N -5.65 3.17 0.14 0.22 -4.23 -1.26 -2.61 115.64 105.41 1tei s THR 157 Ca -0.13 -1.79 -0.34 0.00 -1.18 0.00 0.00 61.69 58.25 1tei s THR 157 Cb 0.14 -2.60 -0.14 0.00 1.34 0.00 0.00 72.50 71.23 1tei s THR 157 CO 0.80 -0.19 1.54 -1.14 -0.54 0.00 0.00 174.62 175.09 1tei n ARG 158 N -0.22 1.94 -4.37 3.99 0.63 -1.26 -4.75 116.66 112.62 1tei n ARG 158 Ca -0.09 0.70 -0.23 0.00 -0.92 0.00 0.00 57.85 57.30 1tei n ARG 158 Cb 0.57 -2.45 -0.17 0.00 0.45 0.00 0.00 32.46 30.86 1tei n ARG 158 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1tei s VAL 159 N 0.94 0.93 1.04 5.15 1.01 -1.26 -1.70 120.40 126.51 1tei s VAL 159 Ca 0.80 -0.34 -0.12 0.00 0.00 0.00 0.00 61.98 62.32 1tei s VAL 159 Cb -0.74 -0.89 0.21 0.00 0.00 0.00 0.00 36.38 34.97 1tei s VAL 159 CO 0.40 0.32 1.07 -0.94 0.00 0.00 0.00 175.10 175.95 1tei s SER 160 N 0.88 2.13 0.55 3.32 1.04 0.34 -4.88 113.70 117.07 1tei s SER 160 Ca -0.11 1.38 0.27 0.00 0.48 0.00 0.00 55.95 57.97 1tei s SER 160 Cb -0.15 -2.08 1.60 0.00 0.10 0.00 0.00 66.02 65.49 1tei s SER 160 CO 0.01 -3.47 2.16 0.77 0.98 0.00 0.00 173.24 173.70 1tei h SER 161 N -2.12 0.00 1.13 7.02 4.64 -2.01 -0.59 113.55 121.62 1tei h SER 161 Ca -0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 1tei h SER 161 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1tei h SER 161 CO 0.54 0.06 -0.27 -0.46 -0.87 0.00 0.00 176.83 175.82 1tei n ASN 162 N -3.84 0.68 0.00 4.97 0.23 -1.26 -4.93 115.26 111.10 1tei n ASN 162 Ca -0.03 0.34 0.00 0.00 -0.53 0.00 0.00 54.58 54.36 1tei n ASN 162 Cb 0.15 -0.33 0.00 0.00 -2.08 0.00 0.00 39.78 37.52 1tei n ASN 162 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1tei n GLY 163 N 1.35 0.82 3.74 4.83 0.00 -0.23 -5.11 105.19 110.58 1tei n GLY 163 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1tei n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tei s SER 164 N -1.38 7.41 0.52 1.61 1.04 -1.26 -4.71 113.70 116.93 1tei s SER 164 Ca 0.00 1.68 -0.21 0.00 0.48 0.00 0.00 55.95 57.90 1tei s SER 164 Cb 0.00 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.51 1tei s SER 164 CO 0.00 -0.02 1.20 -2.16 0.98 0.00 0.00 173.24 173.24 1tei s PRO 165 N -0.09 3.43 0.06 4.02 0.04 -1.26 -0.51 135.00 140.68 1tei s PRO 165 Ca 0.44 1.83 0.03 0.00 0.04 0.00 0.00 61.00 63.34 1tei s PRO 165 Cb -0.22 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 1tei s PRO 165 CO 0.28 -0.84 0.04 -0.65 0.04 0.00 0.00 177.00 175.87 1tei s GLN 166 N -2.96 2.79 0.93 4.56 -1.52 -0.69 -4.84 119.66 117.93 1tei s GLN 166 Ca 0.69 -0.69 -0.15 0.00 -1.95 0.00 0.00 55.36 53.26 1tei s GLN 166 Cb -0.30 -2.68 0.18 0.00 -0.22 0.00 0.00 33.01 29.99 1tei s GLN 166 CO 0.35 0.58 1.29 0.20 -0.25 0.00 0.00 175.29 177.46 1tei s GLY 167 N -2.14 1.75 -0.92 3.09 0.00 -1.26 -4.46 107.32 103.38 1tei s GLY 167 Ca 0.26 -1.14 -0.08 0.00 0.00 0.00 0.00 44.72 43.75 1tei s GLY 167 CO 0.18 -0.42 0.63 1.44 0.00 0.00 0.00 173.10 174.93 1tei n SER 168 N -3.66 -4.80 -3.87 1.64 7.64 -0.28 -4.87 113.62 105.41 1tei n SER 168 Ca 0.14 -1.02 -0.11 0.00 1.01 0.00 0.00 58.87 58.89 1tei n SER 168 Cb 0.60 -1.83 -0.12 0.00 -1.01 0.00 0.00 64.21 61.84 1tei n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1tei s SER 169 N -3.12 -0.00 0.00 6.43 0.15 -1.20 -4.97 113.70 110.99 1tei s SER 169 Ca 0.12 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.75 1tei s SER 169 Cb -0.07 0.14 -0.00 0.00 -1.71 0.00 0.00 66.02 64.38 1tei s SER 169 CO 0.91 -0.12 -0.01 0.68 1.20 0.00 0.00 173.24 175.90 1tei s VAL 170 N -0.41 0.05 -0.06 4.45 -7.23 -1.26 -1.27 120.40 114.66 1tei s VAL 170 Ca -0.05 -0.11 -0.23 0.00 -1.81 0.00 0.00 61.98 59.79 1tei s VAL 170 Cb -0.03 -0.06 0.05 0.00 0.56 0.00 0.00 36.38 36.89 1tei s VAL 170 CO 0.00 -0.04 0.51 -0.83 -0.31 0.00 0.00 175.10 174.43 1tei s GLY 171 N -0.16 -0.38 0.06 2.32 0.00 -0.90 0.34 107.32 108.59 1tei s GLY 171 Ca -0.01 0.96 -0.06 0.00 0.00 0.00 0.00 44.72 45.60 1tei s GLY 171 CO -0.00 0.68 0.11 0.50 0.00 0.00 0.00 173.10 174.40 1tei s ARG 172 N -1.00 0.69 -0.07 2.90 0.52 -0.75 -1.68 118.95 119.56 1tei s ARG 172 Ca -0.10 -0.91 -0.03 0.00 -0.52 0.00 0.00 55.73 54.17 1tei s ARG 172 Cb -0.03 0.27 0.04 0.00 0.52 0.00 0.00 34.95 35.76 1tei s ARG 172 CO 0.06 -0.19 0.14 0.00 0.02 0.00 0.00 175.30 175.33 1tei s ALA 173 N -3.30 -0.09 0.03 2.13 0.00 -0.56 -0.91 121.76 119.05 1tei s ALA 173 Ca 0.01 0.50 0.08 0.00 0.00 0.00 0.00 51.96 52.54 1tei s ALA 173 Cb 0.03 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1tei s ALA 173 CO -0.08 -0.49 -0.22 -0.51 0.00 0.00 0.00 175.76 174.46 1tei s LEU 174 N 2.09 2.37 0.25 0.00 1.02 -0.50 -0.79 118.68 123.13 1tei s LEU 174 Ca 0.02 -0.48 -0.30 0.00 0.02 0.00 0.00 54.13 53.39 1tei s LEU 174 Cb -0.12 -1.40 -0.09 0.00 0.02 0.00 0.00 46.19 44.59 1tei s LEU 174 CO -0.05 0.27 1.29 0.12 0.02 0.00 0.00 176.35 178.00 1tei s PHE 175 N -0.82 3.22 0.14 0.29 5.36 -0.74 -0.41 117.98 125.03 1tei s PHE 175 Ca 0.13 1.34 -0.24 0.00 -0.96 0.00 0.00 56.93 57.19 1tei s PHE 175 Cb -0.10 -3.59 0.00 0.00 -0.34 0.00 0.00 43.02 38.99 1tei s PHE 175 CO 0.03 -1.73 1.63 -0.92 -1.46 0.00 0.00 175.22 172.76 1tei h TYR 176 N 4.53 -0.70 -3.70 10.12 3.20 -0.85 -3.43 116.97 126.13 1tei h TYR 176 Ca -0.46 0.04 -0.51 0.00 3.14 0.00 0.00 58.73 60.93 1tei h TYR 176 Cb 1.22 0.33 0.01 0.00 1.54 0.00 0.00 36.73 39.83 1tei h TYR 176 CO 0.59 -0.34 0.48 0.00 -1.64 0.00 0.00 178.16 177.25 1tei s ALA 177 N -6.06 3.40 0.63 1.82 0.00 -1.26 -5.02 121.76 115.26 1tei s ALA 177 Ca -0.15 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 52.50 1tei s ALA 177 Cb 0.11 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1tei s ALA 177 CO 0.67 -0.17 1.17 -2.14 0.00 0.00 0.00 175.76 175.29 1tei s PRO 178 N -1.01 2.84 -0.09 0.00 0.02 -1.26 -4.83 135.00 130.67 1tei s PRO 178 Ca 0.46 1.66 0.03 0.00 0.02 0.00 0.00 61.00 63.17 1tei s PRO 178 Cb -0.31 -1.93 -0.01 0.00 0.02 0.00 0.00 34.50 32.26 1tei s PRO 178 CO 0.38 -1.27 -0.18 0.08 -0.33 0.00 0.00 177.00 175.69 1tei s VAL 179 N -1.90 2.70 -0.94 3.83 1.01 0.18 -4.94 120.40 120.34 1tei s VAL 179 Ca 0.73 -0.82 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 1tei s VAL 179 Cb -0.26 -2.07 0.11 0.00 0.00 0.00 0.00 36.38 34.16 1tei s VAL 179 CO 0.36 0.56 1.19 -2.28 0.00 0.00 0.00 175.10 174.93 1tei s HIS 180 N -0.04 2.98 0.34 5.22 2.46 -1.26 -0.92 115.29 124.07 1tei s HIS 180 Ca -0.05 -1.24 0.12 0.00 0.47 0.00 0.00 55.06 54.36 1tei s HIS 180 Cb -0.14 -4.37 0.62 0.00 -0.13 0.00 0.00 32.58 28.55 1tei s HIS 180 CO 0.04 -1.59 1.77 0.97 -2.47 0.00 0.00 174.74 173.46 1tei h ILE 181 N 6.04 1.31 -3.25 0.89 6.09 -1.65 -3.47 117.51 123.46 1tei h ILE 181 Ca 0.15 -1.47 -0.01 0.00 -1.37 0.00 0.00 64.86 62.16 1tei h ILE 181 Cb 1.02 1.78 -0.09 0.00 0.47 0.00 0.00 36.82 40.00 1tei h ILE 181 CO 1.18 0.42 0.07 -1.66 -3.07 0.00 0.00 178.15 175.09 1tei s TRP 182 N -4.07 -0.14 -0.23 2.19 1.48 -1.23 -4.79 118.94 112.15 1tei s TRP 182 Ca -0.03 -0.21 -0.17 0.00 -1.06 0.00 0.00 56.10 54.64 1tei s TRP 182 Cb 0.14 0.44 0.06 0.00 -1.16 0.00 0.00 33.47 32.95 1tei s TRP 182 CO 0.74 -0.96 0.58 -2.00 -4.06 0.00 0.00 176.95 171.25 1tei s GLU 183 N -3.88 0.63 0.54 3.25 2.12 -1.26 -4.80 118.70 115.30 1tei s GLU 183 Ca 0.09 0.93 0.27 0.00 0.36 0.00 0.00 54.97 56.62 1tei s GLU 183 Cb -0.02 0.20 1.44 0.00 0.26 0.00 0.00 34.13 36.01 1tei s GLU 183 CO -0.02 -0.12 1.98 0.66 -0.54 0.00 0.00 175.26 177.23 1tei h SER 184 N 6.17 0.00 -0.43 -1.70 4.64 -2.02 -1.22 113.55 118.99 1tei h SER 184 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1tei h SER 184 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1tei h SER 184 CO 0.18 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.94 1tei n SER 185 N -4.24 3.34 -4.67 4.97 7.64 -1.26 -4.92 113.62 114.48 1tei n SER 185 Ca 0.10 -2.30 -0.39 0.00 1.01 0.00 0.00 58.87 57.29 1tei n SER 185 Cb 0.63 -0.47 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 1tei n SER 185 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tei s ALA 186 N -1.75 3.54 0.06 -0.43 0.00 -0.46 -2.99 121.76 119.73 1tei s ALA 186 Ca 0.34 -0.38 -0.19 0.00 0.00 0.00 0.00 51.96 51.74 1tei s ALA 186 Cb 0.22 -2.80 -0.12 0.00 0.00 0.00 0.00 23.12 20.43 1tei s ALA 186 CO 0.16 -0.39 1.40 0.28 0.00 0.00 0.00 175.76 177.20 1tei h VAL 187 N 5.08 1.32 -3.55 0.00 2.07 0.67 -3.44 116.25 118.40 1tei h VAL 187 Ca -0.34 -1.25 -0.24 0.00 0.82 0.00 0.00 66.70 65.68 1tei h VAL 187 Cb 1.16 1.71 -0.30 0.00 -1.52 0.00 0.00 31.29 32.34 1tei h VAL 187 CO 0.74 0.38 -0.68 -0.69 0.02 0.00 0.00 177.57 177.34 1tei s VAL 188 N -4.46 -0.02 -0.02 2.57 1.01 -1.12 -4.87 120.40 113.50 1tei s VAL 188 Ca -0.14 0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.94 1tei s VAL 188 Cb 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 36.38 36.35 1tei s VAL 188 CO 0.77 0.03 -0.06 0.00 0.00 0.00 0.00 175.10 175.84 1tei s ALA 189 N 0.45 0.58 0.09 5.51 0.00 -1.26 -0.30 121.76 126.83 1tei s ALA 189 Ca -0.04 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.46 1tei s ALA 189 Cb -0.05 -0.22 0.07 0.00 0.00 0.00 0.00 23.12 22.92 1tei s ALA 189 CO -0.02 0.10 0.60 -1.54 0.00 0.00 0.00 175.76 174.90 1tei s SER 190 N 0.14 -0.56 0.14 0.00 1.04 -0.36 0.13 113.70 114.23 1tei s SER 190 Ca -0.01 0.21 -0.04 0.00 0.48 0.00 0.00 55.95 56.59 1tei s SER 190 Cb -0.06 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 1tei s SER 190 CO -0.00 -0.83 0.14 0.72 0.98 0.00 0.00 173.24 174.24 1tei s PHE 191 N -2.87 0.70 -0.17 5.02 -0.12 -0.55 -0.85 117.98 119.13 1tei s PHE 191 Ca -0.03 -1.07 -0.12 0.00 -0.05 0.00 0.00 56.93 55.66 1tei s PHE 191 Cb -0.01 -0.33 0.05 0.00 -0.63 0.00 0.00 43.02 42.11 1tei s PHE 191 CO -0.05 -0.59 0.44 -2.00 -0.05 0.00 0.00 175.22 172.97 1tei s GLU 192 N -4.02 0.47 0.03 1.99 2.12 0.09 -2.28 118.70 117.09 1tei s GLU 192 Ca 0.22 0.73 0.03 0.00 0.36 0.00 0.00 54.97 56.31 1tei s GLU 192 Cb 0.06 0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.54 1tei s GLU 192 CO 0.01 -0.11 -0.10 0.00 -0.54 0.00 0.00 175.26 174.52 1tei s ALA 193 N 0.88 0.79 -0.09 6.30 0.00 -0.07 -1.09 121.76 128.49 1tei s ALA 193 Ca -0.05 -0.64 -0.08 0.00 0.00 0.00 0.00 51.96 51.19 1tei s ALA 193 Cb -0.06 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.99 1tei s ALA 193 CO -0.07 0.12 0.24 0.99 0.00 0.00 0.00 175.76 177.04 1tei s THR 194 N -0.79 -0.00 -0.10 0.00 2.01 -0.67 -0.42 115.64 115.67 1tei s THR 194 Ca -0.02 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 61.73 1tei s THR 194 Cb -0.07 -0.34 0.06 0.00 0.01 0.00 0.00 72.50 72.16 1tei s THR 194 CO 0.01 0.00 0.61 0.72 -0.69 0.00 0.00 174.62 175.26 1tei s PHE 195 N 0.14 -0.59 -0.08 4.92 -0.71 -0.82 -0.54 117.98 120.30 1tei s PHE 195 Ca -0.00 1.15 0.01 0.00 -1.04 0.00 0.00 56.93 57.05 1tei s PHE 195 Cb -0.02 0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 42.08 1tei s PHE 195 CO 0.00 -0.50 -0.11 0.95 -1.34 0.00 0.00 175.22 174.23 1tei s THR 196 N -0.78 3.35 0.31 -4.49 -4.23 -0.84 -1.04 115.64 107.92 1tei s THR 196 Ca -0.08 -0.60 0.03 0.00 -1.18 0.00 0.00 61.69 59.86 1tei s THR 196 Cb -0.02 -2.36 -0.06 0.00 1.34 0.00 0.00 72.50 71.40 1tei s THR 196 CO 0.06 0.58 0.07 0.72 -0.54 0.00 0.00 174.62 175.51 1tei s PHE 197 N -0.50 1.84 -0.23 3.99 -0.71 -0.72 -0.34 117.98 121.31 1tei s PHE 197 Ca 0.07 -1.03 -0.04 0.00 -1.04 0.00 0.00 56.93 54.89 1tei s PHE 197 Cb -0.12 -1.17 0.09 0.00 -1.21 0.00 0.00 43.02 40.61 1tei s PHE 197 CO 0.02 -0.10 0.16 -1.17 -1.34 0.00 0.00 175.22 172.79 1tei s LEU 198 N -3.44 0.22 -0.35 -1.99 2.96 0.42 -1.16 118.68 115.35 1tei s LEU 198 Ca 0.37 -0.76 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 1tei s LEU 198 Cb 0.08 -0.03 0.01 0.00 0.50 0.00 0.00 46.19 46.75 1tei s LEU 198 CO 0.15 -0.38 0.20 -0.63 -1.32 0.00 0.00 176.35 174.37 1tei s ILE 199 N 2.20 4.69 -0.07 6.68 1.01 -1.26 -2.62 121.20 131.83 1tei s ILE 199 Ca 0.06 -0.63 0.05 0.00 0.00 0.00 0.00 60.65 60.14 1tei s ILE 199 Cb -0.16 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.79 1tei s ILE 199 CO -0.22 -0.11 -0.25 -0.75 0.00 0.00 0.00 174.94 173.62 1tei s LYS 200 N 1.60 2.72 -0.06 2.79 2.20 -1.23 -0.97 119.74 126.79 1tei s LYS 200 Ca 0.04 -0.89 -0.02 0.00 -0.36 0.00 0.00 55.97 54.73 1tei s LYS 200 Cb -0.18 -2.21 0.04 0.00 -1.51 0.00 0.00 37.83 33.96 1tei s LYS 200 CO 0.07 0.32 0.11 0.45 -0.36 0.00 0.00 175.35 175.94 1tei s SER 201 N -0.00 0.31 0.15 1.43 0.15 -1.26 -0.16 113.70 114.32 1tei s SER 201 Ca -0.08 0.23 0.26 0.00 0.70 0.00 0.00 55.95 57.05 1tei s SER 201 Cb -0.15 0.11 0.77 0.00 -1.71 0.00 0.00 66.02 65.05 1tei s SER 201 CO 0.05 -0.18 1.69 -0.81 1.20 0.00 0.00 173.24 175.19 1tei n PRO 202 N 4.64 0.21 -3.66 5.44 -0.04 -1.26 -4.90 135.00 135.43 1tei n PRO 202 Ca -0.18 0.14 -0.20 0.00 -0.04 0.00 0.00 63.50 63.22 1tei n PRO 202 Cb 0.51 -1.72 -0.02 0.00 -0.04 0.00 0.00 33.50 32.23 1tei n PRO 202 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1tei s ASP 203 N -4.14 5.72 0.00 3.54 -4.77 -1.26 -5.05 116.67 110.71 1tei s ASP 203 Ca 0.10 -0.29 0.00 0.00 -3.30 0.00 0.00 52.55 49.07 1tei s ASP 203 Cb 0.14 -1.19 0.00 0.00 -1.09 0.00 0.00 42.92 40.78 1tei s ASP 203 CO 0.62 -0.36 0.31 -1.20 0.70 0.00 0.00 175.17 175.23 1tei n SER 204 N -1.50 0.00 -4.20 2.11 7.64 -1.26 -4.24 113.62 112.17 1tei n SER 204 Ca -0.02 0.31 -0.33 0.00 1.01 0.00 0.00 58.87 59.84 1tei n SER 204 Cb 0.59 -0.10 -0.16 0.00 -1.01 0.00 0.00 64.21 63.53 1tei n SER 204 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1tei s HIS 205 N -1.99 2.79 0.75 1.43 3.76 -1.26 -5.12 115.29 115.65 1tei s HIS 205 Ca 0.00 -1.32 -0.12 0.00 -0.15 0.00 0.00 55.06 53.47 1tei s HIS 205 Cb 0.00 -1.92 0.05 0.00 1.11 0.00 0.00 32.58 31.81 1tei s HIS 205 CO 0.00 -0.64 1.11 -2.14 -0.85 0.00 0.00 174.74 172.22 1tei s PRO 206 N 1.11 2.29 -0.08 8.40 0.02 -1.26 -4.68 135.00 140.79 1tei s PRO 206 Ca 0.00 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 62.06 1tei s PRO 206 Cb -0.14 -1.89 0.10 0.00 0.02 0.00 0.00 34.50 32.59 1tei s PRO 206 CO -0.06 -1.64 0.86 0.00 -0.33 0.00 0.00 177.00 175.83 1tei s ALA 207 N -2.62 -1.85 -0.03 -1.55 0.00 -1.22 -4.01 121.76 110.49 1tei s ALA 207 Ca 0.65 1.34 0.09 0.00 0.00 0.00 0.00 51.96 54.04 1tei s ALA 207 Cb -0.20 -0.21 -0.14 0.00 0.00 0.00 0.00 23.12 22.57 1tei s ALA 207 CO 0.51 -0.42 0.16 -0.25 0.00 0.00 0.00 175.76 175.76 1tei n ASP 208 N 0.55 2.82 0.00 0.00 8.00 0.29 -2.94 116.55 125.26 1tei n ASP 208 Ca -0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.37 1tei n ASP 208 Cb 0.59 1.24 0.00 0.00 -0.02 0.00 0.00 41.12 42.93 1tei n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tei n GLY 209 N 2.09 1.49 3.25 0.44 0.00 -1.21 -2.02 105.19 109.23 1tei n GLY 209 Ca -0.05 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 1tei n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tei s ILE 210 N -1.56 1.43 -0.08 -0.61 1.01 -0.77 -2.80 121.20 117.82 1tei s ILE 210 Ca 0.00 -1.64 -0.10 0.00 0.00 0.00 0.00 60.65 58.91 1tei s ILE 210 Cb 0.00 -1.50 0.02 0.00 0.01 0.00 0.00 42.46 41.00 1tei s ILE 210 CO 0.00 -0.30 0.27 0.00 0.00 0.00 0.00 174.94 174.91 1tei s ALA 211 N -1.79 -0.68 -0.17 9.38 0.00 0.89 0.10 121.76 129.50 1tei s ALA 211 Ca 0.07 0.64 -0.08 0.00 0.00 0.00 0.00 51.96 52.59 1tei s ALA 211 Cb -0.07 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 1tei s ALA 211 CO 0.04 -0.16 0.11 0.12 0.00 0.00 0.00 175.76 175.87 1tei s PHE 212 N -0.20 3.41 0.05 0.00 5.36 -0.31 -0.19 117.98 126.10 1tei s PHE 212 Ca -0.03 0.32 -0.02 0.00 -0.96 0.00 0.00 56.93 56.23 1tei s PHE 212 Cb -0.03 -2.08 -0.03 0.00 -0.34 0.00 0.00 43.02 40.54 1tei s PHE 212 CO 0.01 0.37 -0.00 -0.59 -1.46 0.00 0.00 175.22 173.55 1tei s PHE 213 N 0.00 0.45 -0.07 10.12 -0.71 0.33 -1.14 117.98 126.97 1tei s PHE 213 Ca 0.09 -0.95 0.04 0.00 -1.04 0.00 0.00 56.93 55.07 1tei s PHE 213 Cb -0.12 -0.33 0.00 0.00 -1.21 0.00 0.00 43.02 41.37 1tei s PHE 213 CO -0.00 -0.38 -0.19 0.42 -1.34 0.00 0.00 175.22 173.73 1tei s ILE 214 N -3.65 1.62 0.35 -4.49 1.01 0.00 -0.31 121.20 115.73 1tei s ILE 214 Ca 0.04 -0.79 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 1tei s ILE 214 Cb 0.06 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 41.13 1tei s ILE 214 CO -0.09 0.46 0.48 -0.94 0.00 0.00 0.00 174.94 174.85 1tei s SER 215 N 0.25 0.98 0.56 3.58 1.04 -0.24 -2.11 113.70 117.75 1tei s SER 215 Ca -0.11 -1.51 -0.20 0.00 0.48 0.00 0.00 55.95 54.61 1tei s SER 215 Cb -0.15 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.60 1tei s SER 215 CO 0.05 -1.31 1.23 0.54 0.98 0.00 0.00 173.24 174.72 1tei s ASN 216 N -3.25 5.41 0.29 7.02 4.22 -1.23 -0.93 114.94 126.47 1tei s ASN 216 Ca 0.31 2.45 0.02 0.00 -2.14 0.00 0.00 52.86 53.49 1tei s ASN 216 Cb -0.01 -2.61 0.71 0.00 1.28 0.00 0.00 41.25 40.62 1tei s ASN 216 CO 0.21 -1.45 1.64 0.40 -2.04 0.00 0.00 177.10 175.86 1tei h ILE 217 N 1.20 0.30 -0.26 0.54 2.04 -1.86 -2.55 117.51 116.93 1tei h ILE 217 Ca -0.50 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1tei h ILE 217 Cb 1.29 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1tei h ILE 217 CO 0.57 0.04 0.00 -0.90 0.00 0.00 0.00 178.15 177.85 1tei n ASP 218 N -5.24 2.76 -4.74 1.72 5.75 -1.26 -4.83 116.55 110.72 1tei n ASP 218 Ca 0.21 -2.32 -0.36 0.00 -0.01 0.00 0.00 54.79 52.31 1tei n ASP 218 Cb 0.68 -0.51 0.06 0.00 -1.03 0.00 0.00 41.12 40.32 1tei n ASP 218 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1tei s SER 219 N -0.45 4.74 0.15 -1.12 0.15 -0.96 -5.04 113.70 111.16 1tei s SER 219 Ca 0.23 2.54 -0.12 0.00 0.70 0.00 0.00 55.95 59.29 1tei s SER 219 Cb 0.16 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.87 1tei s SER 219 CO 0.08 -1.91 0.34 -0.94 1.20 0.00 0.00 173.24 172.01 1tei s SER 220 N -1.50 -0.06 0.01 5.45 1.04 -1.26 -5.08 113.70 112.29 1tei s SER 220 Ca 0.80 -0.65 -0.30 0.00 0.48 0.00 0.00 55.95 56.28 1tei s SER 220 Cb -0.35 0.46 -0.09 0.00 0.10 0.00 0.00 66.02 66.14 1tei s SER 220 CO 0.38 -0.89 1.99 -0.38 0.98 0.00 0.00 173.24 175.32 1tei n ILE 221 N -0.22 0.73 -2.00 -1.02 5.41 -1.26 -4.95 119.36 116.05 1tei n ILE 221 Ca -0.11 -0.16 -0.37 0.00 1.00 0.00 0.00 62.75 63.12 1tei n ILE 221 Cb 0.63 -2.30 0.03 0.00 -0.71 0.00 0.00 39.64 37.29 1tei n ILE 221 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1tei s PRO 222 N 4.59 3.09 0.06 0.38 0.02 -1.26 -4.91 135.00 136.97 1tei s PRO 222 Ca 0.90 1.90 -0.33 0.00 0.02 0.00 0.00 61.00 63.50 1tei s PRO 222 Cb -0.45 -2.05 -0.12 0.00 0.02 0.00 0.00 34.50 31.90 1tei s PRO 222 CO 0.43 -1.13 1.81 0.43 -0.33 0.00 0.00 177.00 178.20 1tei n SER 223 N -1.35 3.67 -1.65 2.53 7.64 -1.26 -2.42 113.62 120.77 1tei n SER 223 Ca 0.12 1.00 -0.15 0.00 1.01 0.00 0.00 58.87 60.85 1tei n SER 223 Cb 0.49 -1.47 -0.01 0.00 -1.01 0.00 0.00 64.21 62.21 1tei n SER 223 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tei n GLY 224 N 4.13 -0.15 1.63 0.23 0.00 -1.26 -4.91 105.19 104.86 1tei n GLY 224 Ca 0.19 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.82 1tei n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tei n SER 225 N -0.80 3.96 -2.52 1.61 3.41 -1.02 -4.87 113.62 113.40 1tei n SER 225 Ca -0.17 -2.81 -0.07 0.00 -0.26 0.00 0.00 58.87 55.56 1tei n SER 225 Cb 0.63 -0.74 0.05 0.00 -0.26 0.00 0.00 64.21 63.89 1tei n SER 225 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1tei n THR 226 N -0.14 0.00 -3.08 6.66 -2.24 -1.26 -0.65 114.28 113.57 1tei n THR 226 Ca 0.28 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1tei n THR 226 Cb 0.96 -1.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 1tei n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tei n GLY 227 N 2.44 1.17 0.30 3.38 0.00 0.31 -2.80 105.19 109.99 1tei n GLY 227 Ca 0.04 -0.56 0.05 0.00 0.00 0.00 0.00 46.02 45.55 1tei n GLY 227 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1tei h ARG 228 N 0.00 0.00 0.00 1.61 0.11 -1.89 -1.53 114.38 112.68 1tei h ARG 228 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1tei h ARG 228 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1tei h ARG 228 CO 0.00 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.35 1tei n LEU 229 N -2.51 0.00 -2.17 0.08 4.77 -1.12 -4.93 117.00 111.12 1tei n LEU 229 Ca -0.01 0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 56.13 1tei n LEU 229 Cb 0.73 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 1tei n LEU 229 CO 0.05 -0.00 -0.12 0.18 -1.33 0.00 0.00 177.39 176.17 1tei n LEU 230 N -1.25 -0.86 -1.43 2.23 4.77 -0.58 -1.67 117.00 118.20 1tei n LEU 230 Ca 0.15 0.25 -0.18 0.00 -0.03 0.00 0.00 56.01 56.20 1tei n LEU 230 Cb 0.23 -1.84 -0.08 0.00 -2.33 0.00 0.00 43.42 39.40 1tei n LEU 230 CO 0.23 -0.20 -0.18 0.61 -1.33 0.00 0.00 177.39 176.52 1tei n GLY 231 N -0.61 1.74 0.02 -0.72 0.00 0.18 -4.12 105.19 101.68 1tei n GLY 231 Ca -0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 45.74 1tei n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tei n LEU 232 N -2.11 2.50 -4.60 0.99 4.77 -0.67 -4.45 117.00 113.42 1tei n LEU 232 Ca -0.19 -0.02 -0.31 0.00 -0.03 0.00 0.00 56.01 55.47 1tei n LEU 232 Cb 0.61 -0.12 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 1tei n LEU 232 CO 0.28 0.50 -0.39 -0.36 -1.33 0.00 0.00 177.39 176.08 1tei s PHE 233 N -2.09 2.83 0.16 -1.77 0.08 -1.15 -4.79 117.98 111.25 1tei s PHE 233 Ca -0.06 -0.10 0.02 0.00 0.12 0.00 0.00 56.93 56.92 1tei s PHE 233 Cb 0.02 -1.51 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 1tei s PHE 233 CO 0.11 0.41 1.36 -1.00 -0.10 0.00 0.00 175.22 176.01 1tei h PRO 234 N 3.91 0.20 -4.46 0.24 0.13 -1.92 -3.42 132.00 126.68 1tei h PRO 234 Ca -0.48 -0.22 -0.30 0.00 -0.87 0.00 0.00 66.00 64.13 1tei h PRO 234 Cb 1.17 0.07 -0.12 0.00 0.13 0.00 0.00 31.00 32.24 1tei h PRO 234 CO 0.54 0.97 -0.42 0.16 -0.23 0.00 0.00 178.00 179.02 1tei s ASP 235 N -6.93 0.77 -0.04 1.44 1.47 -1.26 -4.89 116.67 107.23 1tei s ASP 235 Ca -0.03 -1.47 0.12 0.00 1.18 0.00 0.00 52.55 52.35 1tei s ASP 235 Cb 0.10 0.53 0.40 0.00 -0.34 0.00 0.00 42.92 43.61 1tei s ASP 235 CO 0.83 -1.05 1.28 0.00 0.68 0.00 0.00 175.17 176.91 1tei n ALA 236 N -0.46 2.69 0.69 2.11 0.00 -1.26 -4.73 120.51 119.55 1tei n ALA 236 Ca 0.03 -0.85 0.05 0.00 0.00 0.00 0.00 53.44 52.68 1tei n ALA 236 Cb 0.63 -1.00 0.33 0.00 0.00 0.00 0.00 19.45 19.41 1tei n ALA 236 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79