#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1onk s ASP 2 N 0.00 5.49 -0.21 -1.12 -1.08 -1.26 -5.05 116.67 113.43 1onk s ASP 2 Ca 0.00 -3.15 -0.29 0.00 -0.52 0.00 0.00 52.55 48.59 1onk s ASP 2 Cb 0.00 -1.87 -0.02 0.00 -1.46 0.00 0.00 42.92 39.57 1onk s ASP 2 CO 0.00 -0.31 1.40 -0.69 0.52 0.00 0.00 175.17 176.09 1onk s VAL 3 N -0.50 4.02 0.02 1.11 1.01 -1.26 -5.00 120.40 119.79 1onk s VAL 3 Ca 0.20 1.19 -0.03 0.00 0.00 0.00 0.00 61.98 63.34 1onk s VAL 3 Cb -0.16 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 1onk s VAL 3 CO -0.07 -0.29 0.03 0.42 0.00 0.00 0.00 175.10 175.20 1onk s THR 4 N 4.27 0.11 -0.41 3.92 -4.23 -1.26 -5.07 115.64 112.99 1onk s THR 4 Ca 0.61 -0.94 0.09 0.00 -1.18 0.00 0.00 61.69 60.28 1onk s THR 4 Cb -0.22 -0.47 0.31 0.00 1.34 0.00 0.00 72.50 73.46 1onk s THR 4 CO 0.23 -0.52 0.80 0.00 -0.54 0.00 0.00 174.62 174.59 1onk s SER 6 N -1.84 6.31 0.00 0.00 1.04 -1.26 -4.98 113.70 112.98 1onk s SER 6 Ca 0.34 0.88 0.00 0.00 0.48 0.00 0.00 55.95 57.64 1onk s SER 6 Cb 0.29 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 64.19 1onk s SER 6 CO -0.10 -0.49 0.00 0.00 0.98 0.00 0.00 173.24 173.63 1onk n ALA 7 N -1.98 0.00 -2.01 5.32 0.00 -1.26 -5.13 120.51 115.45 1onk n ALA 7 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1onk n ALA 7 Cb 0.55 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.02 1onk n ALA 7 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1onk s SER 8 N 0.00 5.58 -0.45 0.00 0.01 -1.26 -5.03 113.70 112.55 1onk s SER 8 Ca 0.00 -0.33 0.02 0.00 1.31 0.00 0.00 55.95 56.95 1onk s SER 8 Cb 0.00 -0.71 0.14 0.00 0.21 0.00 0.00 66.02 65.66 1onk s SER 8 CO 0.00 -0.84 0.27 -1.61 0.41 0.00 0.00 173.24 171.47 1onk s GLU 9 N -4.43 1.29 0.60 12.44 2.02 -1.26 -4.85 118.70 124.51 1onk s GLU 9 Ca 0.55 -2.07 -0.16 0.00 0.02 0.00 0.00 54.97 53.31 1onk s GLU 9 Cb -0.10 -2.26 -0.03 0.00 0.10 0.00 0.00 34.13 31.84 1onk s GLU 9 CO 0.34 -1.19 1.07 -1.25 0.02 0.00 0.00 175.26 174.25 1onk s PRO 10 N 0.24 3.22 -0.24 0.39 0.04 -1.26 -4.72 135.00 132.67 1onk s PRO 10 Ca 0.20 1.28 -0.01 0.00 0.04 0.00 0.00 61.00 62.51 1onk s PRO 10 Cb -0.20 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.35 1onk s PRO 10 CO -0.03 -0.90 -0.08 0.99 0.04 0.00 0.00 177.00 177.02 1onk s THR 11 N -2.36 2.75 0.15 1.26 2.01 -1.26 -1.18 115.64 117.01 1onk s THR 11 Ca 0.65 -1.04 -0.03 0.00 0.31 0.00 0.00 61.69 61.58 1onk s THR 11 Cb -0.18 -2.38 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 1onk s THR 11 CO 0.36 0.23 0.12 0.68 -0.69 0.00 0.00 174.62 175.32 1onk s VAL 12 N 1.31 0.08 0.86 3.82 -7.23 0.23 -4.82 120.40 114.65 1onk s VAL 12 Ca 0.00 -1.81 -0.11 0.00 -1.81 0.00 0.00 61.98 58.25 1onk s VAL 12 Cb -0.16 -2.08 0.11 0.00 0.56 0.00 0.00 36.38 34.81 1onk s VAL 12 CO -0.05 -0.35 1.09 -0.13 -0.31 0.00 0.00 175.10 175.35 1onk s ARG 13 N -4.05 1.57 -0.17 4.82 0.52 -1.24 -0.68 118.95 119.72 1onk s ARG 13 Ca 0.25 0.82 -0.01 0.00 -0.52 0.00 0.00 55.73 56.27 1onk s ARG 13 Cb 0.06 -1.84 0.05 0.00 0.52 0.00 0.00 34.95 33.73 1onk s ARG 13 CO 0.03 -2.03 -0.03 0.42 0.02 0.00 0.00 175.30 173.72 1onk s ILE 14 N -2.98 0.93 -0.00 1.52 1.01 -1.26 -0.82 121.20 119.60 1onk s ILE 14 Ca 0.62 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 1onk s ILE 14 Cb -0.17 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 1onk s ILE 14 CO 0.56 0.05 0.10 0.54 0.00 0.00 0.00 174.94 176.19 1onk s VAL 15 N 1.70 4.85 0.00 2.92 0.11 -0.58 -0.65 120.40 128.75 1onk s VAL 15 Ca 0.00 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.68 1onk s VAL 15 Cb -0.16 -3.23 0.00 0.00 -1.53 0.00 0.00 36.38 31.46 1onk s VAL 15 CO -0.07 0.34 0.00 0.61 -3.33 0.00 0.00 175.10 172.65 1onk n GLY 16 N 1.13 5.15 3.65 6.54 0.00 0.26 -0.48 105.19 121.43 1onk n GLY 16 Ca -0.13 -0.68 -0.60 0.00 0.00 0.00 0.00 46.02 44.61 1onk n GLY 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1onk n ARG 17 N 0.00 0.51 -1.69 1.61 0.63 -1.25 -0.75 116.66 115.71 1onk n ARG 17 Ca 0.00 0.19 -0.18 0.00 -0.92 0.00 0.00 57.85 56.94 1onk n ARG 17 Cb 0.00 -1.76 -0.06 0.00 0.45 0.00 0.00 32.46 31.09 1onk n ARG 17 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1onk n ASN 18 N 3.41 -5.16 0.00 6.15 3.02 -1.26 -2.45 115.26 118.97 1onk n ASN 18 Ca 0.25 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 55.14 1onk n ASN 18 Cb 0.07 -4.24 0.00 0.00 -0.61 0.00 0.00 39.78 35.00 1onk n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1onk n GLY 19 N -0.83 0.77 3.93 7.41 0.00 0.07 -5.05 105.19 111.49 1onk n GLY 19 Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1onk n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1onk s MET 20 N -0.27 3.28 0.14 1.61 -1.94 -1.03 -4.74 119.30 116.35 1onk s MET 20 Ca 0.00 -0.09 0.05 0.00 -1.71 0.00 0.00 55.69 53.94 1onk s MET 20 Cb 0.00 -2.44 -0.04 0.00 2.01 0.00 0.00 34.83 34.36 1onk s MET 20 CO 0.00 -0.27 0.07 1.03 -0.01 0.00 0.00 175.02 175.84 1onk s ARG 21 N -4.69 2.73 -0.04 2.03 3.00 -0.13 0.90 118.95 122.76 1onk s ARG 21 Ca 0.48 -0.88 -0.30 0.00 0.00 0.00 0.00 55.73 55.03 1onk s ARG 21 Cb -0.10 -2.58 -0.04 0.00 0.00 0.00 0.00 34.95 32.22 1onk s ARG 21 CO 0.42 0.50 1.38 0.08 0.00 0.00 0.00 175.30 177.68 1onk s VAL 22 N -1.60 3.87 -0.02 3.52 1.01 0.17 -2.24 120.40 125.11 1onk s VAL 22 Ca 0.29 1.19 -0.00 0.00 0.00 0.00 0.00 61.98 63.45 1onk s VAL 22 Cb -0.11 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1onk s VAL 22 CO 0.21 -0.03 0.04 -0.62 0.00 0.00 0.00 175.10 174.70 1onk s ASP 23 N 2.03 0.28 -0.36 3.32 -1.08 -0.22 -4.51 116.67 116.13 1onk s ASP 23 Ca 0.62 0.05 -0.29 0.00 -0.52 0.00 0.00 52.55 52.41 1onk s ASP 23 Cb -0.29 -0.08 0.00 0.00 -1.46 0.00 0.00 42.92 41.09 1onk s ASP 23 CO 0.24 -0.15 1.38 -0.69 0.52 0.00 0.00 175.17 176.47 1onk s VAL 24 N 1.30 3.99 0.23 1.11 1.01 -0.85 -0.09 120.40 127.09 1onk s VAL 24 Ca -0.06 1.06 -0.32 0.00 0.00 0.00 0.00 61.98 62.66 1onk s VAL 24 Cb -0.13 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 31.96 1onk s VAL 24 CO -0.03 -0.62 1.47 -1.14 0.00 0.00 0.00 175.10 174.78 1onk n ARG 25 N 7.74 2.14 -1.49 2.72 0.63 -1.09 -1.79 116.66 125.51 1onk n ARG 25 Ca 0.16 0.76 -0.17 0.00 -0.92 0.00 0.00 57.85 57.68 1onk n ARG 25 Cb 0.47 -2.46 -0.07 0.00 0.45 0.00 0.00 32.46 30.85 1onk n ARG 25 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1onk n ASP 26 N 2.46 -5.27 -2.29 6.15 2.03 -1.26 -1.39 116.55 116.98 1onk n ASP 26 Ca 0.12 0.41 -0.21 0.00 0.52 0.00 0.00 54.79 55.64 1onk n ASP 26 Cb 0.31 -4.24 -0.02 0.00 -0.72 0.00 0.00 41.12 36.45 1onk n ASP 26 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1onk n ASP 27 N -0.98 -5.90 -4.42 1.67 8.00 -0.74 -4.93 116.55 109.26 1onk n ASP 27 Ca -0.17 0.06 -0.41 0.00 0.71 0.00 0.00 54.79 54.98 1onk n ASP 27 Cb 0.59 -4.95 -0.11 0.00 -0.02 0.00 0.00 41.12 36.64 1onk n ASP 27 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1onk s ASP 28 N -2.16 5.87 -0.29 -2.24 -1.08 -0.49 -4.94 116.67 111.35 1onk s ASP 28 Ca 0.00 -0.89 0.11 0.00 -0.52 0.00 0.00 52.55 51.25 1onk s ASP 28 Cb 0.00 -2.08 0.75 0.00 -1.46 0.00 0.00 42.92 40.14 1onk s ASP 28 CO 0.00 -0.38 1.77 0.49 0.52 0.00 0.00 175.17 177.56 1onk n PHE 29 N 5.06 2.31 -2.15 -5.34 3.72 -1.26 -4.73 117.46 115.07 1onk n PHE 29 Ca -0.12 -1.03 -0.39 0.00 -0.05 0.00 0.00 57.45 55.85 1onk n PHE 29 Cb 0.47 -0.63 -0.01 0.00 -0.94 0.00 0.00 39.48 38.36 1onk n PHE 29 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1onk s HIS 30 N -2.85 2.97 -0.05 1.38 3.76 -1.26 -4.88 115.29 114.36 1onk s HIS 30 Ca 0.54 1.47 -0.37 0.00 -0.15 0.00 0.00 55.06 56.54 1onk s HIS 30 Cb 0.42 -3.58 -0.16 0.00 1.11 0.00 0.00 32.58 30.38 1onk s HIS 30 CO 0.14 -1.76 1.55 -0.25 -0.85 0.00 0.00 174.74 173.57 1onk n ASP 31 N 0.29 2.19 0.00 1.40 8.00 -1.26 -1.69 116.55 125.47 1onk n ASP 31 Ca 0.03 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.62 1onk n ASP 31 Cb 0.44 -1.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 1onk n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1onk n GLY 32 N 3.33 1.03 3.75 0.44 0.00 -0.45 -5.03 105.19 108.27 1onk n GLY 32 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1onk n GLY 32 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1onk s ASN 33 N -1.75 5.13 0.47 1.61 2.47 -0.68 -4.70 114.94 117.49 1onk s ASN 33 Ca 0.00 2.60 -0.16 0.00 0.42 0.00 0.00 52.86 55.71 1onk s ASN 33 Cb 0.00 -2.62 -0.08 0.00 -1.45 0.00 0.00 41.25 37.10 1onk s ASN 33 CO 0.00 -1.65 0.92 -1.10 -3.72 0.00 0.00 177.10 171.56 1onk s GLN 34 N -3.13 3.97 -0.07 0.43 -0.21 -1.26 -1.02 119.66 118.36 1onk s GLN 34 Ca 0.76 0.88 -0.08 0.00 0.02 0.00 0.00 55.36 56.93 1onk s GLN 34 Cb -0.36 -2.21 -0.04 0.00 1.00 0.00 0.00 33.01 31.40 1onk s GLN 34 CO 0.41 -0.16 0.21 0.42 -2.12 0.00 0.00 175.29 174.05 1onk s ILE 35 N -2.46 5.39 0.33 1.08 -1.09 -0.13 -2.68 121.20 121.64 1onk s ILE 35 Ca 0.58 0.30 0.04 0.00 -2.23 0.00 0.00 60.65 59.33 1onk s ILE 35 Cb -0.10 -3.49 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 1onk s ILE 35 CO 0.27 0.56 0.16 0.00 -1.23 0.00 0.00 174.94 174.70 1onk s GLN 36 N -1.19 1.69 -0.15 2.79 -2.07 0.87 -0.70 119.66 120.90 1onk s GLN 36 Ca 0.19 -1.99 -0.22 0.00 -1.82 0.00 0.00 55.36 51.53 1onk s GLN 36 Cb -0.13 -0.21 -0.03 0.00 -1.09 0.00 0.00 33.01 31.55 1onk s GLN 36 CO 0.08 -0.47 0.66 -1.17 -1.32 0.00 0.00 175.29 173.08 1onk s LEU 37 N -3.43 4.21 -0.17 2.60 2.96 -0.14 -1.06 118.68 123.64 1onk s LEU 37 Ca 0.33 0.98 -0.16 0.00 -0.22 0.00 0.00 54.13 55.06 1onk s LEU 37 Cb 0.04 -2.98 0.04 0.00 0.50 0.00 0.00 46.19 43.80 1onk s LEU 37 CO 0.18 -0.22 0.46 0.86 -1.32 0.00 0.00 176.35 176.31 1onk s TRP 38 N 1.53 -0.50 0.50 5.38 -0.11 -0.95 -0.25 118.94 124.55 1onk s TRP 38 Ca 0.32 1.22 -0.23 0.00 1.22 0.00 0.00 56.10 58.63 1onk s TRP 38 Cb -0.16 0.18 -0.07 0.00 -1.50 0.00 0.00 33.47 31.92 1onk s TRP 38 CO 0.13 -0.26 1.33 -2.30 -4.62 0.00 0.00 176.95 171.23 1onk n PRO 39 N 2.75 1.80 -1.73 5.86 -0.02 -1.26 -0.95 135.00 141.44 1onk n PRO 39 Ca -0.14 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.58 1onk n PRO 39 Cb 0.57 -2.52 -0.02 0.00 -0.02 0.00 0.00 33.50 31.51 1onk n PRO 39 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1onk n SER 40 N -0.55 3.77 -0.18 2.55 2.88 -1.26 -4.83 113.62 116.00 1onk n SER 40 Ca 0.09 1.13 0.13 0.00 -1.33 0.00 0.00 58.87 58.89 1onk n SER 40 Cb 0.43 -1.57 0.42 0.00 -0.75 0.00 0.00 64.21 62.73 1onk n SER 40 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1onk n LYS 41 N 2.44 0.66 -3.91 -1.46 5.02 -1.26 -4.95 118.16 114.69 1onk n LYS 41 Ca 0.10 -0.35 -0.29 0.00 -2.02 0.00 0.00 58.31 55.75 1onk n LYS 41 Cb 0.36 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1onk n LYS 41 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1onk n SER 42 N -0.86 -1.18 0.00 4.39 7.64 -1.26 -4.95 113.62 117.40 1onk n SER 42 Ca 0.12 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 59.05 1onk n SER 42 Cb 0.33 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 1onk n SER 42 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1onk n ASN 43 N -1.65 0.67 -1.33 6.43 0.23 -1.26 -5.05 115.26 113.30 1onk n ASN 43 Ca -0.16 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.00 1onk n ASN 43 Cb 0.46 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.47 1onk n ASN 43 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1onk n ASN 44 N 0.00 4.01 -4.68 0.53 5.03 -1.26 -4.94 115.26 113.95 1onk n ASN 44 Ca 0.00 -2.08 -0.44 0.00 0.87 0.00 0.00 54.58 52.93 1onk n ASN 44 Cb 0.00 -0.48 -0.04 0.00 -1.02 0.00 0.00 39.78 38.24 1onk n ASN 44 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1onk n ASP 45 N 1.46 3.73 0.30 6.41 10.43 -1.26 -4.85 116.55 132.77 1onk n ASP 45 Ca 0.24 1.00 0.17 0.00 2.57 0.00 0.00 54.79 58.77 1onk n ASP 45 Cb 0.65 -1.48 0.94 0.00 1.84 0.00 0.00 41.12 43.06 1onk n ASP 45 CO 0.00 0.00 0.00 1.55 -1.07 0.00 0.00 177.20 177.68 1onk h PRO 46 N 8.21 0.00 0.00 -0.24 0.13 -1.92 -3.02 132.00 135.16 1onk h PRO 46 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1onk h PRO 46 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1onk h PRO 46 CO 0.94 0.04 0.00 0.27 -0.23 0.00 0.00 178.00 179.01 1onk n ASN 47 N -3.50 0.00 -0.34 1.44 6.94 -1.26 -1.09 115.26 117.45 1onk n ASN 47 Ca -0.02 0.35 0.04 0.00 -0.02 0.00 0.00 54.58 54.93 1onk n ASN 47 Cb 0.14 -0.42 0.10 0.00 -2.36 0.00 0.00 39.78 37.25 1onk n ASN 47 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1onk n GLN 48 N -1.42 2.73 -5.16 -3.83 6.02 -1.14 -2.00 117.38 112.59 1onk n GLN 48 Ca 0.04 -1.98 -0.32 0.00 -0.01 0.00 0.00 57.00 54.73 1onk n GLN 48 Cb 0.12 -1.25 -0.17 0.00 1.02 0.00 0.00 30.24 29.96 1onk n GLN 48 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1onk s LEU 49 N -1.44 2.19 -0.06 1.08 1.43 -0.25 -4.01 118.68 117.61 1onk s LEU 49 Ca 0.17 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1onk s LEU 49 Cb 0.12 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.91 1onk s LEU 49 CO 0.07 0.17 -0.13 0.26 0.23 0.00 0.00 176.35 176.95 1onk s TRP 50 N 0.31 1.51 -0.24 0.29 0.52 0.15 -4.35 118.94 117.12 1onk s TRP 50 Ca -0.17 -0.55 -0.16 0.00 0.02 0.00 0.00 56.10 55.25 1onk s TRP 50 Cb -0.17 -1.09 -0.04 0.00 -1.15 0.00 0.00 33.47 31.02 1onk s TRP 50 CO 0.08 -0.27 0.41 0.99 0.02 0.00 0.00 176.95 178.18 1onk s THR 51 N 0.59 5.16 -0.87 2.01 2.01 0.38 -0.60 115.64 124.33 1onk s THR 51 Ca -0.14 0.69 -0.25 0.00 0.31 0.00 0.00 61.69 62.30 1onk s THR 51 Cb -0.15 -3.74 0.03 0.00 0.01 0.00 0.00 72.50 68.65 1onk s THR 51 CO 0.04 0.18 1.45 -0.63 -0.69 0.00 0.00 174.62 174.97 1onk s ILE 52 N 1.83 3.77 0.56 1.82 -1.09 -0.33 -1.89 121.20 125.87 1onk s ILE 52 Ca 0.18 -0.21 -0.16 0.00 -2.23 0.00 0.00 60.65 58.23 1onk s ILE 52 Cb -0.15 -4.85 -0.05 0.00 -1.58 0.00 0.00 42.46 35.83 1onk s ILE 52 CO 0.09 -1.76 1.03 -0.54 -1.23 0.00 0.00 174.94 172.53 1onk s LYS 53 N 5.57 3.56 0.43 2.79 -0.14 -0.56 -4.17 119.74 127.24 1onk s LYS 53 Ca 0.45 1.10 0.18 0.00 -1.36 0.00 0.00 55.97 56.35 1onk s LYS 53 Cb -0.04 -2.07 1.00 0.00 -1.68 0.00 0.00 37.83 35.03 1onk s LYS 53 CO 0.03 -0.60 1.92 0.00 -0.76 0.00 0.00 175.35 175.94 1onk h ARG 54 N 0.61 0.00 -0.44 1.68 3.08 -1.88 -2.90 114.38 114.52 1onk h ARG 54 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1onk h ARG 54 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1onk h ARG 54 CO 0.59 0.25 0.00 -0.40 -1.07 0.00 0.00 179.97 179.34 1onk n ASP 55 N -3.92 1.06 0.00 7.04 5.68 -1.26 -4.83 116.55 120.32 1onk n ASP 55 Ca -0.02 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.21 1onk n ASP 55 Cb 0.33 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 1onk n ASP 55 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1onk n GLY 56 N 0.45 0.81 3.91 6.12 0.00 -1.09 -4.95 105.19 110.44 1onk n GLY 56 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1onk n GLY 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1onk s THR 57 N -3.21 4.99 -0.24 2.61 -4.23 -1.26 -1.17 115.64 113.14 1onk s THR 57 Ca 0.00 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.52 1onk s THR 57 Cb 0.00 -3.81 0.06 0.00 1.34 0.00 0.00 72.50 70.09 1onk s THR 57 CO 0.00 -0.55 -0.07 -0.63 -0.54 0.00 0.00 174.62 172.83 1onk s ILE 58 N -2.35 1.66 -0.05 2.99 1.01 -1.26 -1.49 121.20 121.71 1onk s ILE 58 Ca 0.44 -1.31 0.05 0.00 0.00 0.00 0.00 60.65 59.84 1onk s ILE 58 Cb -0.10 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 1onk s ILE 58 CO 0.36 -0.09 -0.18 -0.13 0.00 0.00 0.00 174.94 174.90 1onk s ARG 59 N 1.33 2.46 -0.12 2.79 0.52 -0.79 -1.20 118.95 123.95 1onk s ARG 59 Ca -0.07 -0.78 0.02 0.00 -0.52 0.00 0.00 55.73 54.39 1onk s ARG 59 Cb -0.19 -2.28 0.01 0.00 0.52 0.00 0.00 34.95 33.01 1onk s ARG 59 CO -0.06 0.55 -0.17 0.45 0.02 0.00 0.00 175.30 176.09 1onk s SER 60 N -0.56 2.64 -1.34 0.23 0.15 0.29 -0.47 113.70 114.64 1onk s SER 60 Ca 0.08 -0.48 -0.10 0.00 0.70 0.00 0.00 55.95 56.15 1onk s SER 60 Cb -0.11 -1.20 0.08 0.00 -1.71 0.00 0.00 66.02 63.08 1onk s SER 60 CO 0.01 0.04 0.54 -3.20 1.20 0.00 0.00 173.24 171.83 1onk n ASN 61 N 4.12 -3.78 0.00 5.45 4.05 -1.26 -1.11 115.26 122.72 1onk n ASN 61 Ca -0.19 -0.46 0.00 0.00 0.45 0.00 0.00 54.58 54.37 1onk n ASN 61 Cb 0.51 -3.12 0.00 0.00 1.23 0.00 0.00 39.78 38.41 1onk n ASN 61 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1onk n GLY 62 N -1.22 2.24 3.93 8.20 0.00 -1.26 -5.03 105.19 112.03 1onk n GLY 62 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1onk n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1onk s SER 63 N -1.88 5.95 -0.10 1.61 0.01 -0.27 -4.55 113.70 114.48 1onk s SER 63 Ca 0.00 -0.12 -0.12 0.00 1.31 0.00 0.00 55.95 57.02 1onk s SER 63 Cb 0.00 -1.53 -0.05 0.00 0.21 0.00 0.00 66.02 64.65 1onk s SER 63 CO 0.00 -0.16 0.29 0.00 0.41 0.00 0.00 173.24 173.77 1onk n LEU 65 N 2.54 3.68 -3.95 0.00 7.94 -0.34 -0.75 117.00 126.12 1onk n LEU 65 Ca -0.15 0.52 -0.19 0.00 -1.11 0.00 0.00 56.01 55.08 1onk n LEU 65 Cb 0.53 -1.54 -0.15 0.00 0.53 0.00 0.00 43.42 42.78 1onk n LEU 65 CO 0.36 -0.28 -0.42 -0.89 -1.11 0.00 0.00 177.39 175.06 1onk s THR 66 N 6.58 0.58 0.18 1.96 2.01 0.74 -4.50 115.64 123.20 1onk s THR 66 Ca 0.95 -0.23 -0.27 0.00 0.31 0.00 0.00 61.69 62.45 1onk s THR 66 Cb -0.38 -0.55 -0.08 0.00 0.01 0.00 0.00 72.50 71.50 1onk s THR 66 CO 0.38 0.20 0.83 0.28 -0.69 0.00 0.00 174.62 175.63 1onk s THR 67 N 0.37 4.28 0.33 -0.82 -1.32 0.07 -0.75 115.64 117.81 1onk s THR 67 Ca -0.05 1.84 0.04 0.00 -1.21 0.00 0.00 61.69 62.31 1onk s THR 67 Cb -0.09 -4.21 0.15 0.00 -1.51 0.00 0.00 72.50 66.84 1onk s THR 67 CO 0.00 0.51 1.85 0.22 -2.21 0.00 0.00 174.62 174.99 1onk h TYR 68 N 4.34 0.55 -0.85 9.09 3.20 -1.67 -3.46 116.97 128.17 1onk h TYR 68 Ca -0.46 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.35 1onk h TYR 68 Cb 1.20 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1onk h TYR 68 CO 0.63 0.56 0.00 0.41 -1.64 0.00 0.00 178.16 178.12 1onk n GLY 69 N -0.81 1.93 0.46 1.82 0.00 -1.26 -5.04 105.19 102.30 1onk n GLY 69 Ca 0.01 -0.75 0.07 0.00 0.00 0.00 0.00 46.02 45.36 1onk n GLY 69 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1onk n TYR 70 N 0.00 0.30 -4.74 1.61 4.01 -1.26 -4.93 117.16 112.15 1onk n TYR 70 Ca 0.00 -1.15 -0.24 0.00 -0.16 0.00 0.00 57.90 56.35 1onk n TYR 70 Cb 0.00 -0.24 -0.15 0.00 -0.31 0.00 0.00 39.34 38.63 1onk n TYR 70 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1onk s THR 71 N -2.99 1.25 0.17 -0.72 2.01 -1.26 -4.91 115.64 109.20 1onk s THR 71 Ca 0.37 -0.66 -0.34 0.00 0.31 0.00 0.00 61.69 61.37 1onk s THR 71 Cb 0.32 -1.06 -0.14 0.00 0.01 0.00 0.00 72.50 71.64 1onk s THR 71 CO 0.02 0.36 1.59 0.00 -0.69 0.00 0.00 174.62 175.90 1onk n ALA 72 N 2.86 1.55 0.00 7.40 0.00 -1.26 -2.60 120.51 128.46 1onk n ALA 72 Ca -0.16 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1onk n ALA 72 Cb 0.54 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1onk n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1onk n GLY 73 N 3.43 2.93 3.81 0.00 0.00 -0.29 -5.00 105.19 110.08 1onk n GLY 73 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1onk n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1onk s VAL 74 N -2.57 4.01 0.70 1.61 -7.23 -1.07 -4.82 120.40 111.03 1onk s VAL 74 Ca 0.00 0.97 -0.09 0.00 -1.81 0.00 0.00 61.98 61.05 1onk s VAL 74 Cb 0.00 -3.48 0.03 0.00 0.56 0.00 0.00 36.38 33.49 1onk s VAL 74 CO 0.00 -0.55 1.05 -0.72 -0.31 0.00 0.00 175.10 174.58 1onk s TYR 75 N -2.48 3.16 -0.05 2.82 1.13 -1.26 -2.22 117.35 118.45 1onk s TYR 75 Ca 0.62 0.79 -0.01 0.00 -1.41 0.00 0.00 57.07 57.06 1onk s TYR 75 Cb -0.14 -3.10 -0.03 0.00 -1.10 0.00 0.00 41.96 37.59 1onk s TYR 75 CO 0.35 -1.25 0.02 0.08 -2.51 0.00 0.00 175.55 172.23 1onk s VAL 76 N -3.30 4.39 0.25 -3.49 1.01 0.59 -1.80 120.40 118.06 1onk s VAL 76 Ca 0.58 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.24 1onk s VAL 76 Cb -0.11 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1onk s VAL 76 CO 0.48 0.51 0.15 0.00 0.00 0.00 0.00 175.10 176.24 1onk s MET 77 N -1.19 1.41 -0.02 2.72 0.23 0.07 -0.95 119.30 121.57 1onk s MET 77 Ca 0.16 -1.77 -0.15 0.00 -1.03 0.00 0.00 55.69 52.90 1onk s MET 77 Cb -0.11 0.09 -0.05 0.00 -1.53 0.00 0.00 34.83 33.23 1onk s MET 77 CO 0.06 -0.42 0.42 -1.50 -2.03 0.00 0.00 175.02 171.54 1onk s ILE 78 N -3.86 5.06 -0.09 3.16 1.10 -0.19 -0.18 121.20 126.20 1onk s ILE 78 Ca 0.38 0.85 -0.18 0.00 -0.51 0.00 0.00 60.65 61.19 1onk s ILE 78 Cb 0.06 -3.73 0.04 0.00 0.15 0.00 0.00 42.46 38.98 1onk s ILE 78 CO 0.16 0.53 0.43 0.12 -2.11 0.00 0.00 174.94 174.07 1onk s PHE 79 N -0.75 -0.40 -0.26 3.50 2.19 0.07 -1.34 117.98 120.99 1onk s PHE 79 Ca 0.24 0.82 -0.41 0.00 0.33 0.00 0.00 56.93 57.92 1onk s PHE 79 Cb -0.16 0.18 -0.16 0.00 -1.31 0.00 0.00 43.02 41.57 1onk s PHE 79 CO 0.13 -0.36 1.68 -3.47 1.83 0.00 0.00 175.22 175.02 1onk n ASP 80 N 1.89 2.16 0.23 6.13 -0.08 -1.26 -0.09 116.55 125.52 1onk n ASP 80 Ca -0.18 1.09 0.07 0.00 -1.51 0.00 0.00 54.79 54.27 1onk n ASP 80 Cb 0.57 -1.12 0.53 0.00 2.34 0.00 0.00 41.12 43.44 1onk n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1onk h ASN 82 N 0.00 0.00 0.00 0.00 4.21 -1.94 -3.37 115.58 114.48 1onk h ASN 82 Ca -0.00 -0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.47 1onk h ASN 82 Cb 0.44 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 1onk h ASN 82 CO 0.03 0.02 -1.23 0.35 -1.29 0.00 0.00 177.43 175.31 1onk n THR 83 N -2.70 0.00 -0.77 2.81 -2.24 -1.08 -5.01 114.28 105.28 1onk n THR 83 Ca 0.02 -0.24 -0.31 0.00 -2.27 0.00 0.00 64.05 61.25 1onk n THR 83 Cb 0.52 0.45 0.16 0.00 -2.10 0.00 0.00 70.33 69.35 1onk n THR 83 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1onk s ALA 84 N -2.53 1.56 0.04 6.98 0.00 -0.74 -4.91 121.76 122.17 1onk s ALA 84 Ca -0.02 0.60 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1onk s ALA 84 Cb 0.07 -3.44 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 1onk s ALA 84 CO 0.43 -2.65 1.73 0.08 0.00 0.00 0.00 175.76 175.34 1onk s VAL 85 N -2.62 3.11 0.18 0.00 1.01 -1.26 -4.88 120.40 115.94 1onk s VAL 85 Ca 0.67 0.41 -0.13 0.00 0.00 0.00 0.00 61.98 62.93 1onk s VAL 85 Cb -0.23 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 32.99 1onk s VAL 85 CO 0.57 -0.02 1.73 -0.09 0.00 0.00 0.00 175.10 177.29 1onk h ARG 86 N 9.02 0.26 -0.15 2.72 9.65 -1.91 0.05 114.38 134.02 1onk h ARG 86 Ca -0.43 -0.02 0.04 0.00 -1.10 0.00 0.00 59.98 58.47 1onk h ARG 86 Cb 1.20 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.72 1onk h ARG 86 CO 0.94 0.17 0.17 0.93 2.80 0.00 0.00 179.97 184.99 1onk h GLU 87 N 0.27 0.00 0.00 0.20 3.07 -1.97 0.10 114.58 116.25 1onk h GLU 87 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1onk h GLU 87 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1onk h GLU 87 CO -0.30 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.31 1onk n ALA 88 N -2.32 2.20 0.66 3.43 0.00 0.00 -3.37 120.51 121.12 1onk n ALA 88 Ca 0.01 -0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.45 1onk n ALA 88 Cb 0.29 -1.43 0.06 0.00 0.00 0.00 0.00 19.45 18.37 1onk n ALA 88 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1onk n THR 89 N -1.58 0.00 -3.67 0.00 -2.24 0.35 -0.75 114.28 106.40 1onk n THR 89 Ca 0.06 -0.49 -0.37 0.00 -2.27 0.00 0.00 64.05 60.98 1onk n THR 89 Cb 0.32 1.33 -0.07 0.00 -2.10 0.00 0.00 70.33 69.81 1onk n THR 89 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1onk s ILE 90 N -1.34 5.32 0.02 2.28 -1.09 -1.21 -4.07 121.20 121.11 1onk s ILE 90 Ca 0.18 0.46 0.02 0.00 -2.23 0.00 0.00 60.65 59.08 1onk s ILE 90 Cb 0.13 -3.55 -0.01 0.00 -1.58 0.00 0.00 42.46 37.45 1onk s ILE 90 CO 0.20 0.52 -0.06 0.26 -1.23 0.00 0.00 174.94 174.64 1onk s TRP 91 N -0.46 0.51 -0.11 3.97 0.52 -0.32 -4.15 118.94 118.91 1onk s TRP 91 Ca 0.17 -0.30 0.00 0.00 0.02 0.00 0.00 56.10 55.99 1onk s TRP 91 Cb -0.13 -0.31 -0.02 0.00 -1.15 0.00 0.00 33.47 31.85 1onk s TRP 91 CO 0.06 -0.06 -0.12 -0.65 0.02 0.00 0.00 176.95 176.20 1onk s GLN 92 N -0.87 3.17 -0.33 4.98 -0.21 0.18 -4.81 119.66 121.76 1onk s GLN 92 Ca -0.05 -0.66 -0.12 0.00 0.02 0.00 0.00 55.36 54.55 1onk s GLN 92 Cb -0.06 -2.60 -0.01 0.00 1.00 0.00 0.00 33.01 31.34 1onk s GLN 92 CO 0.00 0.35 0.21 0.42 -2.12 0.00 0.00 175.29 174.15 1onk s ILE 93 N 0.01 5.04 0.18 1.08 1.01 -1.26 -0.34 121.20 126.92 1onk s ILE 93 Ca -0.03 -0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.24 1onk s ILE 93 Cb -0.14 -3.60 -0.06 0.00 0.01 0.00 0.00 42.46 38.67 1onk s ILE 93 CO 0.04 -0.01 0.44 0.26 0.00 0.00 0.00 174.94 175.67 1onk s TRP 94 N 1.68 3.46 0.57 3.97 0.51 -0.12 -4.96 118.94 124.04 1onk s TRP 94 Ca 0.05 0.64 0.29 0.00 -2.12 0.00 0.00 56.10 54.96 1onk s TRP 94 Cb -0.17 -2.08 1.47 0.00 -0.81 0.00 0.00 33.47 31.88 1onk s TRP 94 CO 0.09 0.36 1.92 -0.44 -0.51 0.00 0.00 176.95 178.37 1onk h ASP 95 N 2.60 0.00 -0.55 2.95 3.32 -1.98 -0.43 116.42 122.33 1onk h ASP 95 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1onk h ASP 95 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1onk h ASP 95 CO 0.71 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.77 1onk n ASN 96 N -3.98 5.09 0.00 6.45 0.23 -1.26 -4.94 115.26 116.85 1onk n ASN 96 Ca 0.11 -2.76 0.00 0.00 -0.53 0.00 0.00 54.58 51.40 1onk n ASN 96 Cb 0.72 -0.62 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 1onk n ASN 96 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1onk n GLY 97 N 0.62 2.71 3.74 4.83 0.00 -0.17 -4.86 105.19 112.05 1onk n GLY 97 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1onk n GLY 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1onk s THR 98 N -2.71 4.05 -0.27 2.61 2.01 -1.25 -0.85 115.64 119.23 1onk s THR 98 Ca 0.00 1.77 -0.03 0.00 0.31 0.00 0.00 61.69 63.74 1onk s THR 98 Cb 0.00 -4.13 0.03 0.00 0.01 0.00 0.00 72.50 68.41 1onk s THR 98 CO 0.00 0.30 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.60 1onk s ILE 99 N -0.24 3.23 -0.01 1.82 1.01 -1.26 -0.95 121.20 124.80 1onk s ILE 99 Ca 0.48 -1.00 0.06 0.00 0.00 0.00 0.00 60.65 60.19 1onk s ILE 99 Cb -0.27 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.48 1onk s ILE 99 CO 0.33 0.10 -0.20 -0.51 0.00 0.00 0.00 174.94 174.66 1onk s ILE 100 N 1.36 2.63 -0.55 2.92 2.07 0.54 -0.98 121.20 129.20 1onk s ILE 100 Ca -0.00 -1.02 -0.20 0.00 -1.41 0.00 0.00 60.65 58.02 1onk s ILE 100 Cb -0.17 -2.02 0.07 0.00 0.13 0.00 0.00 42.46 40.47 1onk s ILE 100 CO -0.02 0.50 0.70 0.21 -1.91 0.00 0.00 174.94 174.42 1onk s ASN 101 N -0.95 6.21 0.21 4.50 3.84 -0.43 0.48 114.94 128.80 1onk s ASN 101 Ca 0.12 -1.06 -0.10 0.00 0.21 0.00 0.00 52.86 52.04 1onk s ASN 101 Cb -0.10 -2.32 0.20 0.00 -0.55 0.00 0.00 41.25 38.49 1onk s ASN 101 CO 0.02 -1.04 1.84 -0.65 -2.79 0.00 0.00 177.10 174.48 1onk h PRO 102 N 9.13 0.81 -0.58 0.43 0.11 -1.85 0.49 132.00 140.54 1onk h PRO 102 Ca -0.28 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 1onk h PRO 102 Cb 1.09 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.99 1onk h PRO 102 CO 1.04 0.53 0.30 -0.09 -0.21 0.00 0.00 178.00 179.57 1onk h ARG 103 N 0.83 0.83 0.00 1.05 9.65 -1.89 -2.23 114.38 122.62 1onk h ARG 103 Ca 0.29 -0.11 -0.01 0.00 -1.10 0.00 0.00 59.98 59.05 1onk h ARG 103 Cb 0.06 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.48 1onk h ARG 103 CO -0.12 0.65 -0.43 0.66 2.80 0.00 0.00 179.97 183.53 1onk h SER 104 N 0.79 0.00 -2.39 -3.80 4.64 -1.81 -3.47 113.55 107.51 1onk h SER 104 Ca 0.20 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.16 1onk h SER 104 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.14 1onk h SER 104 CO -0.03 0.03 -0.45 -3.20 -0.87 0.00 0.00 176.83 172.31 1onk n ASN 105 N -2.94 -5.22 -4.66 4.97 5.15 0.17 -4.95 115.26 107.77 1onk n ASN 105 Ca 0.02 0.03 -0.24 0.00 -0.60 0.00 0.00 54.58 53.79 1onk n ASN 105 Cb 0.55 -4.30 -0.07 0.00 -0.53 0.00 0.00 39.78 35.43 1onk n ASN 105 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1onk s LEU 106 N -5.05 3.12 0.17 1.20 1.43 -1.21 -4.72 118.68 113.62 1onk s LEU 106 Ca 0.00 -0.82 0.11 0.00 -1.03 0.00 0.00 54.13 52.39 1onk s LEU 106 Cb 0.00 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 1onk s LEU 106 CO 0.00 -0.18 -0.23 0.68 0.23 0.00 0.00 176.35 176.85 1onk s VAL 107 N -2.43 2.18 0.15 -1.59 -7.23 0.55 -1.32 120.40 110.72 1onk s VAL 107 Ca 0.35 -1.94 -0.31 0.00 -1.81 0.00 0.00 61.98 58.26 1onk s VAL 107 Cb -0.03 -2.01 -0.10 0.00 0.56 0.00 0.00 36.38 34.81 1onk s VAL 107 CO 0.20 -0.13 1.59 -0.22 -0.31 0.00 0.00 175.10 176.23 1onk s LEU 108 N -2.53 4.37 -0.01 1.32 2.96 -0.15 -0.76 118.68 123.88 1onk s LEU 108 Ca 0.18 2.61 -0.12 0.00 -0.22 0.00 0.00 54.13 56.58 1onk s LEU 108 Cb -0.08 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 43.04 1onk s LEU 108 CO 0.08 -0.84 0.25 0.00 -1.32 0.00 0.00 176.35 174.53 1onk s ALA 109 N 1.33 -0.63 -0.59 5.97 0.00 -0.17 -4.51 121.76 123.16 1onk s ALA 109 Ca 0.71 0.16 -0.08 0.00 0.00 0.00 0.00 51.96 52.75 1onk s ALA 109 Cb -0.44 0.09 0.15 0.00 0.00 0.00 0.00 23.12 22.93 1onk s ALA 109 CO 0.31 -0.25 0.47 0.00 0.00 0.00 0.00 175.76 176.30 1onk s ALA 110 N -1.37 3.60 0.53 0.00 0.00 -0.27 -1.30 121.76 122.94 1onk s ALA 110 Ca -0.14 -2.92 0.19 0.00 0.00 0.00 0.00 51.96 49.10 1onk s ALA 110 Cb -0.06 -2.93 1.34 0.00 0.00 0.00 0.00 23.12 21.46 1onk s ALA 110 CO 0.03 -2.04 2.12 0.66 0.00 0.00 0.00 175.76 176.53 1onk h SER 111 N 7.91 0.00 -2.48 0.00 4.64 -1.86 -3.42 113.55 118.33 1onk h SER 111 Ca -0.09 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.68 1onk h SER 111 Cb 1.03 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.98 1onk h SER 111 CO 0.80 0.00 -0.68 -0.44 -0.87 0.00 0.00 176.83 175.63 1onk s SER 112 N -6.80 3.21 -0.17 4.97 0.01 -1.26 -5.05 113.70 108.61 1onk s SER 112 Ca -0.05 -1.18 0.16 0.00 1.31 0.00 0.00 55.95 56.19 1onk s SER 112 Cb 0.17 -0.25 0.56 0.00 0.21 0.00 0.00 66.02 66.71 1onk s SER 112 CO 0.67 -0.26 1.46 0.61 0.41 0.00 0.00 173.24 176.14 1onk n GLY 113 N -0.67 3.71 3.91 3.44 0.00 -1.26 -4.91 105.19 109.41 1onk n GLY 113 Ca -0.05 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 1onk n GLY 113 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1onk s ILE 114 N -2.60 5.21 0.31 -0.61 -4.36 -1.26 -4.85 121.20 113.05 1onk s ILE 114 Ca 0.43 -0.13 -0.29 0.00 -0.26 0.00 0.00 60.65 60.39 1onk s ILE 114 Cb 0.33 -3.65 -0.12 0.00 1.25 0.00 0.00 42.46 40.27 1onk s ILE 114 CO 0.11 -0.00 1.50 1.17 0.24 0.00 0.00 174.94 177.96 1onk n LYS 115 N -0.07 2.52 0.00 0.37 4.81 -1.26 -2.20 118.16 122.32 1onk n LYS 115 Ca -0.03 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.30 1onk n LYS 115 Cb 0.52 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.96 1onk n LYS 115 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1onk n GLY 116 N 1.56 2.07 3.69 3.14 0.00 0.66 -5.02 105.19 111.29 1onk n GLY 116 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.64 1onk n GLY 116 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1onk n THR 117 N -2.00 0.41 -2.73 2.61 -1.04 -0.93 -4.67 114.28 105.93 1onk n THR 117 Ca 0.00 -0.10 -0.41 0.00 -2.04 0.00 0.00 64.05 61.50 1onk n THR 117 Cb 0.00 -1.65 -0.05 0.00 -1.82 0.00 0.00 70.33 66.81 1onk n THR 117 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1onk s THR 118 N 0.55 4.39 0.32 12.58 2.01 -1.26 -0.97 115.64 133.27 1onk s THR 118 Ca 0.73 2.06 -0.27 0.00 0.31 0.00 0.00 61.69 64.52 1onk s THR 118 Cb -0.62 -4.32 -0.09 0.00 0.01 0.00 0.00 72.50 67.48 1onk s THR 118 CO 0.42 0.35 1.00 -0.76 -0.69 0.00 0.00 174.62 174.94 1onk s LEU 119 N -0.24 4.38 0.35 4.42 1.43 0.12 -4.58 118.68 124.55 1onk s LEU 119 Ca 0.46 1.99 0.03 0.00 -1.03 0.00 0.00 54.13 55.58 1onk s LEU 119 Cb -0.24 -3.92 -0.04 0.00 0.03 0.00 0.00 46.19 42.02 1onk s LEU 119 CO 0.30 -0.15 0.10 0.42 0.23 0.00 0.00 176.35 177.25 1onk s THR 120 N -1.47 0.82 -0.06 5.49 -4.23 -0.42 -0.30 115.64 115.47 1onk s THR 120 Ca 0.49 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.96 1onk s THR 120 Cb -0.23 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 1onk s THR 120 CO 0.29 0.00 0.14 0.68 -0.54 0.00 0.00 174.62 175.19 1onk s VAL 121 N -3.34 5.29 0.17 2.29 -7.23 -0.94 -1.00 120.40 115.62 1onk s VAL 121 Ca 0.31 -0.04 -0.05 0.00 -1.81 0.00 0.00 61.98 60.40 1onk s VAL 121 Cb 0.06 -3.37 -0.03 0.00 0.56 0.00 0.00 36.38 33.60 1onk s VAL 121 CO 0.15 0.48 0.19 -1.10 -0.31 0.00 0.00 175.10 174.51 1onk s GLN 122 N -1.43 1.12 0.26 4.82 -1.52 0.06 -1.14 119.66 121.83 1onk s GLN 122 Ca 0.20 -1.37 -0.31 0.00 -1.95 0.00 0.00 55.36 51.94 1onk s GLN 122 Cb -0.12 0.32 -0.12 0.00 -0.22 0.00 0.00 33.01 32.87 1onk s GLN 122 CO 0.10 -0.38 1.62 2.41 -0.25 0.00 0.00 175.29 178.80 1onk n THR 123 N -0.20 0.64 -1.69 -0.19 -1.04 -1.26 -0.33 114.28 110.21 1onk n THR 123 Ca -0.04 -0.16 -0.52 0.00 -2.04 0.00 0.00 64.05 61.28 1onk n THR 123 Cb 0.64 -1.91 -0.06 0.00 -1.82 0.00 0.00 70.33 67.18 1onk n THR 123 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1onk n LEU 124 N 2.80 2.82 0.00 -4.42 7.94 -1.26 -4.80 117.00 120.08 1onk n LEU 124 Ca 0.12 1.04 0.00 0.00 -1.11 0.00 0.00 56.01 56.05 1onk n LEU 124 Cb 0.35 -1.26 0.00 0.00 0.53 0.00 0.00 43.42 43.04 1onk n LEU 124 CO 0.64 -0.31 0.13 -0.90 -1.11 0.00 0.00 177.39 175.84 1onk n ASP 125 N 5.54 0.00 -2.02 1.96 5.68 -1.26 -5.03 116.55 121.43 1onk n ASP 125 Ca 0.24 -1.00 -0.19 0.00 -0.50 0.00 0.00 54.79 53.34 1onk n ASP 125 Cb 0.21 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.15 1onk n ASP 125 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1onk n TYR 126 N 0.00 -0.64 -2.32 2.11 4.01 -1.26 -4.64 117.16 114.42 1onk n TYR 126 Ca 0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.48 1onk n TYR 126 Cb 0.40 -3.51 0.05 0.00 -0.31 0.00 0.00 39.34 35.96 1onk n TYR 126 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1onk s THR 127 N -2.80 2.89 0.42 -0.72 -4.23 -1.26 -4.09 115.64 105.85 1onk s THR 127 Ca 0.00 -0.18 0.14 0.00 -1.18 0.00 0.00 61.69 60.46 1onk s THR 127 Cb 0.00 -3.19 0.33 0.00 1.34 0.00 0.00 72.50 70.98 1onk s THR 127 CO 0.00 -0.20 1.96 -0.07 -0.54 0.00 0.00 174.62 175.77 1onk h LEU 128 N -0.37 0.41 0.00 4.79 3.38 -1.49 -0.02 115.31 122.00 1onk h LEU 128 Ca -0.45 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1onk h LEU 128 Cb 1.29 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1onk h LEU 128 CO 0.60 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.97 1onk n GLY 129 N -1.51 -0.84 0.50 0.83 0.00 -1.26 -1.81 105.19 101.10 1onk n GLY 129 Ca 0.11 -0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.14 1onk n GLY 129 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1onk n GLN 130 N -1.44 2.80 -4.07 1.61 6.02 -0.03 -1.12 117.38 121.16 1onk n GLN 130 Ca 0.04 -2.11 -0.34 0.00 -0.01 0.00 0.00 57.00 54.57 1onk n GLN 130 Cb 0.12 -1.33 -0.10 0.00 1.02 0.00 0.00 30.24 29.95 1onk n GLN 130 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1onk s GLY 131 N -1.30 1.86 0.07 1.08 0.00 -0.75 -3.89 107.32 104.38 1onk s GLY 131 Ca 0.22 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 44.15 1onk s GLY 131 CO 0.10 0.07 -0.05 -0.98 0.00 0.00 0.00 173.10 172.24 1onk s TRP 132 N 0.48 0.69 -0.06 1.90 0.52 -0.03 -3.97 118.94 118.46 1onk s TRP 132 Ca 0.02 -0.85 -0.03 0.00 0.02 0.00 0.00 56.10 55.26 1onk s TRP 132 Cb -0.13 -0.43 0.04 0.00 -1.15 0.00 0.00 33.47 31.80 1onk s TRP 132 CO 0.01 -0.21 0.08 -1.17 0.02 0.00 0.00 176.95 175.68 1onk s LEU 133 N -2.60 0.12 -0.05 2.99 2.96 0.37 -4.40 118.68 118.06 1onk s LEU 133 Ca 0.04 0.05 -0.26 0.00 -0.22 0.00 0.00 54.13 53.73 1onk s LEU 133 Cb 0.02 -0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.60 1onk s LEU 133 CO -0.05 -0.26 0.84 0.00 -1.32 0.00 0.00 176.35 175.56 1onk s ALA 134 N 2.19 3.29 0.00 5.97 0.00 -1.26 -1.53 121.76 130.41 1onk s ALA 134 Ca 0.04 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1onk s ALA 134 Cb -0.12 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1onk s ALA 134 CO -0.04 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1onk n GLY 135 N 3.07 3.23 0.15 0.00 0.00 -0.00 -5.01 105.19 106.63 1onk n GLY 135 Ca 0.03 -0.48 0.13 0.00 0.00 0.00 0.00 46.02 45.69 1onk n GLY 135 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1onk h ASN 136 N 0.00 0.00 -2.08 1.61 2.35 -1.91 -3.30 115.58 112.24 1onk h ASN 136 Ca 0.00 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 55.07 1onk h ASN 136 Cb 0.00 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 38.21 1onk h ASN 136 CO 0.00 0.00 1.06 -0.62 -1.65 0.00 0.00 177.43 176.22 1onk s ASP 137 N -4.94 6.66 0.00 5.81 -1.08 -1.26 -4.82 116.67 117.04 1onk s ASP 137 Ca 0.08 -2.04 0.28 0.00 -0.52 0.00 0.00 52.55 50.35 1onk s ASP 137 Cb 0.10 -2.44 1.14 0.00 -1.46 0.00 0.00 42.92 40.26 1onk s ASP 137 CO 0.57 -1.12 1.85 0.35 0.52 0.00 0.00 175.17 177.34 1onk n THR 138 N 5.70 0.00 -2.04 1.71 -2.24 -1.26 -4.84 114.28 111.31 1onk n THR 138 Ca 0.28 -0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.72 1onk n THR 138 Cb 0.49 -0.36 0.02 0.00 -2.10 0.00 0.00 70.33 68.38 1onk n THR 138 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1onk s ALA 139 N -2.95 2.61 0.58 6.98 0.00 -1.26 -4.93 121.76 122.80 1onk s ALA 139 Ca 0.15 0.65 -0.19 0.00 0.00 0.00 0.00 51.96 52.58 1onk s ALA 139 Cb 0.19 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 1onk s ALA 139 CO 0.55 -0.97 1.19 -2.14 0.00 0.00 0.00 175.76 174.40 1onk s PRO 140 N -3.71 3.04 -0.24 0.00 0.02 -1.26 -4.93 135.00 127.91 1onk s PRO 140 Ca 0.69 1.79 -0.29 0.00 0.02 0.00 0.00 61.00 63.21 1onk s PRO 140 Cb -0.21 -1.94 0.01 0.00 0.02 0.00 0.00 34.50 32.37 1onk s PRO 140 CO 0.34 -1.14 1.10 1.03 -0.33 0.00 0.00 177.00 177.99 1onk s ARG 141 N -3.32 4.19 -0.11 5.54 1.81 -0.41 -4.79 118.95 121.86 1onk s ARG 141 Ca 0.77 1.34 -0.18 0.00 -1.72 0.00 0.00 55.73 55.94 1onk s ARG 141 Cb -0.29 -3.70 -0.04 0.00 -0.45 0.00 0.00 34.95 30.47 1onk s ARG 141 CO 0.32 -0.73 0.46 -1.21 -0.68 0.00 0.00 175.30 173.46 1onk s GLU 142 N 3.41 4.32 0.17 3.54 0.41 -1.26 0.26 118.70 129.54 1onk s GLU 142 Ca 0.47 0.43 -0.07 0.00 -0.41 0.00 0.00 54.97 55.38 1onk s GLU 142 Cb -0.15 -3.42 -0.02 0.00 -1.78 0.00 0.00 34.13 28.75 1onk s GLU 142 CO 0.10 0.19 0.25 0.14 -0.49 0.00 0.00 175.26 175.46 1onk s VAL 143 N 0.52 0.05 -0.17 2.63 -7.23 0.10 -4.63 120.40 111.67 1onk s VAL 143 Ca 0.25 -1.55 -0.07 0.00 -1.81 0.00 0.00 61.98 58.80 1onk s VAL 143 Cb -0.15 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 1onk s VAL 143 CO 0.10 -0.25 0.06 -0.89 -0.31 0.00 0.00 175.10 173.81 1onk s THR 144 N -4.01 4.79 -0.39 5.32 2.01 -1.07 -0.16 115.64 122.13 1onk s THR 144 Ca 0.22 -0.04 -0.08 0.00 0.31 0.00 0.00 61.69 62.10 1onk s THR 144 Cb 0.04 -3.15 0.06 0.00 0.01 0.00 0.00 72.50 69.46 1onk s THR 144 CO 0.03 0.48 0.21 -0.63 -0.69 0.00 0.00 174.62 174.01 1onk s ILE 145 N 0.23 4.09 0.39 1.82 1.01 -1.26 -1.37 121.20 126.12 1onk s ILE 145 Ca 0.04 -1.29 -0.24 0.00 0.00 0.00 0.00 60.65 59.16 1onk s ILE 145 Cb -0.12 -3.44 -0.09 0.00 0.01 0.00 0.00 42.46 38.82 1onk s ILE 145 CO 0.00 -0.39 1.06 -0.31 0.00 0.00 0.00 174.94 175.31 1onk s TYR 146 N 1.42 3.27 0.00 3.97 2.02 -0.12 -1.78 117.35 126.12 1onk s TYR 146 Ca 0.02 1.64 0.00 0.00 -0.37 0.00 0.00 57.07 58.36 1onk s TYR 146 Cb -0.21 -3.16 0.00 0.00 -0.40 0.00 0.00 41.96 38.18 1onk s TYR 146 CO 0.03 -0.69 0.00 0.41 -1.57 0.00 0.00 175.55 173.72 1onk n GLY 147 N 0.43 5.37 3.39 0.71 0.00 0.97 -1.03 105.19 115.02 1onk n GLY 147 Ca 0.05 -1.20 -0.60 0.00 0.00 0.00 0.00 46.02 44.27 1onk n GLY 147 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1onk n PHE 148 N 0.00 1.35 -2.07 1.61 7.35 -1.25 -1.05 117.46 123.40 1onk n PHE 148 Ca 0.00 1.04 -0.18 0.00 -0.76 0.00 0.00 57.45 57.55 1onk n PHE 148 Cb 0.00 -2.02 -0.03 0.00 0.35 0.00 0.00 39.48 37.78 1onk n PHE 148 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1onk n ARG 149 N 3.09 -1.36 -2.75 -4.13 1.74 -1.26 -1.53 116.66 110.46 1onk n ARG 149 Ca 0.26 0.95 -0.18 0.00 -0.77 0.00 0.00 57.85 58.11 1onk n ARG 149 Cb -0.02 -5.37 0.00 0.00 -1.02 0.00 0.00 32.46 26.05 1onk n ARG 149 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1onk n ASP 150 N -1.24 -4.68 -4.85 0.55 9.92 -0.22 -4.99 116.55 111.05 1onk n ASP 150 Ca -0.20 -0.06 -0.29 0.00 -0.53 0.00 0.00 54.79 53.70 1onk n ASP 150 Cb 0.64 -3.89 0.10 0.00 -0.64 0.00 0.00 41.12 37.33 1onk n ASP 150 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1onk s LEU 151 N -6.09 2.44 -0.04 0.64 1.43 -0.58 -4.45 118.68 112.02 1onk s LEU 151 Ca 0.15 0.78 0.06 0.00 -1.03 0.00 0.00 54.13 54.09 1onk s LEU 151 Cb -0.07 -3.23 -0.02 0.00 0.03 0.00 0.00 46.19 42.90 1onk s LEU 151 CO 0.18 -2.04 -0.23 0.00 0.23 0.00 0.00 176.35 174.49 1onk n MET 153 N 2.64 2.71 -4.98 0.00 1.56 -0.73 -0.75 117.12 117.56 1onk n MET 153 Ca -0.17 0.96 -0.28 0.00 -0.27 0.00 0.00 57.70 57.94 1onk n MET 153 Cb 0.52 -3.05 -0.16 0.00 2.15 0.00 0.00 33.22 32.67 1onk n MET 153 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 1onk s GLU 154 N 4.82 2.04 -0.12 2.12 2.12 0.41 -4.42 118.70 125.68 1onk s GLU 154 Ca 0.91 -0.70 -0.23 0.00 0.36 0.00 0.00 54.97 55.31 1onk s GLU 154 Cb -0.42 -1.75 -0.03 0.00 0.26 0.00 0.00 34.13 32.19 1onk s GLU 154 CO 0.41 0.28 0.69 -1.54 -0.54 0.00 0.00 175.26 174.56 1onk s SER 155 N -0.01 6.88 -0.40 -1.70 1.04 0.15 -1.33 113.70 118.33 1onk s SER 155 Ca -0.04 1.07 0.01 0.00 0.48 0.00 0.00 55.95 57.47 1onk s SER 155 Cb -0.12 -2.39 0.13 0.00 0.10 0.00 0.00 66.02 63.74 1onk s SER 155 CO 0.03 -0.20 0.22 0.20 0.98 0.00 0.00 173.24 174.47 1onk s ASN 156 N 0.95 3.49 1.70 7.02 -0.87 0.20 -4.85 114.94 122.58 1onk s ASN 156 Ca 0.35 -2.40 0.00 0.00 -1.57 0.00 0.00 52.86 49.23 1onk s ASN 156 Cb -0.17 -0.83 0.00 0.00 -0.02 0.00 0.00 41.25 40.23 1onk s ASN 156 CO 0.15 -0.29 0.00 0.61 -2.57 0.00 0.00 177.10 174.99 1onk n GLY 157 N 3.81 3.77 0.00 0.66 0.00 -1.26 -0.21 105.19 111.96 1onk n GLY 157 Ca 0.08 0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.26 1onk n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1onk n GLY 158 N 0.00 -0.70 3.59 -0.02 0.00 -1.26 -4.68 105.19 102.11 1onk n GLY 158 Ca 0.00 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 1onk n GLY 158 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1onk s SER 159 N -1.95 4.27 -0.04 1.61 0.01 0.70 -0.53 113.70 117.77 1onk s SER 159 Ca 0.31 -0.67 0.04 0.00 1.31 0.00 0.00 55.95 56.94 1onk s SER 159 Cb 0.14 -0.71 0.00 0.00 0.21 0.00 0.00 66.02 65.66 1onk s SER 159 CO 0.24 0.05 -0.14 0.54 0.41 0.00 0.00 173.24 174.35 1onk s VAL 160 N -2.06 1.18 0.30 3.43 0.11 -1.26 0.62 120.40 122.71 1onk s VAL 160 Ca 0.28 -0.57 0.04 0.00 -2.93 0.00 0.00 61.98 58.80 1onk s VAL 160 Cb -0.07 -1.02 -0.01 0.00 -1.53 0.00 0.00 36.38 33.74 1onk s VAL 160 CO 0.17 0.35 0.31 -2.67 -3.33 0.00 0.00 175.10 169.93 1onk n TRP 161 N 3.24 -0.92 -4.43 1.54 2.14 -0.44 -4.19 117.44 114.38 1onk n TRP 161 Ca -0.18 -2.32 -0.34 0.00 2.07 0.00 0.00 57.50 56.73 1onk n TRP 161 Cb 0.53 0.34 -0.12 0.00 -0.81 0.00 0.00 31.31 31.25 1onk n TRP 161 CO 0.00 0.00 0.00 0.14 2.07 0.00 0.00 177.69 179.90 1onk s VAL 162 N -3.03 3.88 0.15 -1.67 -7.23 -1.26 0.16 120.40 111.39 1onk s VAL 162 Ca 0.32 -0.37 -0.01 0.00 -1.81 0.00 0.00 61.98 60.11 1onk s VAL 162 Cb 0.01 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1onk s VAL 162 CO 0.22 0.51 0.08 -1.61 -0.31 0.00 0.00 175.10 173.99 1onk s GLU 163 N 0.23 0.99 0.03 4.82 2.02 0.07 -4.85 118.70 122.02 1onk s GLU 163 Ca -0.03 -1.48 -0.37 0.00 0.02 0.00 0.00 54.97 53.11 1onk s GLU 163 Cb -0.14 0.25 -0.16 0.00 0.10 0.00 0.00 34.13 34.18 1onk s GLU 163 CO 0.03 -0.29 1.41 2.41 0.02 0.00 0.00 175.26 178.84 1onk n THR 164 N -0.14 0.05 -2.06 3.63 -1.04 -1.26 0.69 114.28 114.14 1onk n THR 164 Ca -0.04 -0.01 -0.37 0.00 -2.04 0.00 0.00 64.05 61.59 1onk n THR 164 Cb 0.64 -0.90 0.02 0.00 -1.82 0.00 0.00 70.33 68.26 1onk n THR 164 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1onk s ASP 166 N -1.34 3.28 -0.34 0.00 -1.08 -1.26 -5.05 116.67 110.89 1onk s ASP 166 Ca 0.70 -1.33 -0.38 0.00 -0.52 0.00 0.00 52.55 51.01 1onk s ASP 166 Cb -0.32 -0.26 -0.17 0.00 -1.46 0.00 0.00 42.92 40.71 1onk s ASP 166 CO 0.37 -0.42 1.26 -0.24 0.52 0.00 0.00 175.17 176.66 1onk n SER 167 N 5.12 0.82 -1.27 -0.34 2.88 -1.26 0.94 113.62 120.51 1onk n SER 167 Ca -0.04 1.00 -0.15 0.00 -1.33 0.00 0.00 58.87 58.35 1onk n SER 167 Cb 0.42 -0.75 -0.06 0.00 -0.75 0.00 0.00 64.21 63.07 1onk n SER 167 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1onk n SER 168 N 2.96 -4.84 -4.68 -3.46 7.64 -1.26 -4.94 113.62 105.04 1onk n SER 168 Ca 0.24 0.37 -0.42 0.00 1.01 0.00 0.00 58.87 60.07 1onk n SER 168 Cb -0.03 -4.08 -0.03 0.00 -1.01 0.00 0.00 64.21 59.06 1onk n SER 168 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1onk s GLN 169 N -3.24 4.29 0.37 1.43 0.74 0.27 -4.89 119.66 118.63 1onk s GLN 169 Ca 0.00 1.73 0.13 0.00 0.05 0.00 0.00 55.36 57.28 1onk s GLN 169 Cb 0.00 -3.65 0.72 0.00 1.10 0.00 0.00 33.01 31.19 1onk s GLN 169 CO 0.00 -0.57 1.82 0.87 -0.55 0.00 0.00 175.29 176.86 1onk h LYS 170 N 7.85 0.00 -0.22 1.67 1.79 -1.92 -2.45 116.57 123.30 1onk h LYS 170 Ca -0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 1onk h LYS 170 Cb 1.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 1onk h LYS 170 CO 0.92 0.38 0.00 0.27 -1.08 0.00 0.00 179.45 179.94 1onk n ASN 171 N -4.03 0.72 -0.36 0.86 2.04 -1.26 -1.88 115.26 111.35 1onk n ASN 171 Ca -0.02 -2.02 0.03 0.00 -0.44 0.00 0.00 54.58 52.14 1onk n ASN 171 Cb 0.42 -0.13 0.07 0.00 -2.53 0.00 0.00 39.78 37.61 1onk n ASN 171 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1onk n GLN 172 N -0.15 1.98 -4.09 -3.83 6.02 -0.92 0.33 117.38 116.73 1onk n GLN 172 Ca 0.04 -1.55 -0.35 0.00 -0.01 0.00 0.00 57.00 55.12 1onk n GLN 172 Cb 0.13 -1.16 -0.07 0.00 1.02 0.00 0.00 30.24 30.16 1onk n GLN 172 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1onk s LYS 173 N -0.87 3.21 -0.02 -1.09 -0.14 -0.79 -4.27 119.74 115.78 1onk s LYS 173 Ca 0.13 -0.31 0.03 0.00 -1.36 0.00 0.00 55.97 54.46 1onk s LYS 173 Cb 0.07 -2.99 -0.00 0.00 -1.68 0.00 0.00 37.83 33.23 1onk s LYS 173 CO 0.10 0.72 -0.11 -1.58 -0.76 0.00 0.00 175.35 173.72 1onk s TRP 174 N -1.04 1.02 -0.34 3.18 0.52 0.78 -2.50 118.94 120.56 1onk s TRP 174 Ca 0.17 -0.22 -0.15 0.00 0.02 0.00 0.00 56.10 55.92 1onk s TRP 174 Cb -0.12 -0.68 -0.01 0.00 -1.15 0.00 0.00 33.47 31.51 1onk s TRP 174 CO 0.07 -0.05 0.35 0.00 0.02 0.00 0.00 176.95 177.33 1onk s ALA 175 N -0.11 3.50 -0.53 0.98 0.00 0.15 0.02 121.76 125.76 1onk s ALA 175 Ca 0.02 -1.22 -0.25 0.00 0.00 0.00 0.00 51.96 50.51 1onk s ALA 175 Cb -0.06 -2.80 0.04 0.00 0.00 0.00 0.00 23.12 20.30 1onk s ALA 175 CO -0.00 -1.05 0.95 -0.51 0.00 0.00 0.00 175.76 175.15 1onk s LEU 176 N 1.98 4.05 0.22 0.00 1.02 0.14 -1.11 118.68 124.99 1onk s LEU 176 Ca 0.11 -0.23 -0.13 0.00 0.02 0.00 0.00 54.13 53.90 1onk s LEU 176 Cb -0.17 -2.92 -0.08 0.00 0.02 0.00 0.00 46.19 43.05 1onk s LEU 176 CO 0.11 -1.20 0.60 -0.31 0.02 0.00 0.00 176.35 175.57 1onk s TYR 177 N 3.95 3.48 0.38 0.29 1.51 -0.65 -1.29 117.35 125.02 1onk s TYR 177 Ca 0.32 1.03 0.39 0.00 -1.01 0.00 0.00 57.07 57.80 1onk s TYR 177 Cb -0.12 -2.37 1.95 0.00 -0.11 0.00 0.00 41.96 41.32 1onk s TYR 177 CO 0.21 0.29 2.17 0.78 -1.11 0.00 0.00 175.55 177.89 1onk h GLY 178 N 2.83 0.00 1.57 0.71 0.00 -1.88 -1.03 103.07 105.29 1onk h GLY 178 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1onk h GLY 178 CO 0.67 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.30 1onk n ASP 179 N -2.98 0.00 0.00 0.19 5.68 -1.26 -3.76 116.55 114.42 1onk n ASP 179 Ca -0.02 -0.03 0.00 0.00 -0.50 0.00 0.00 54.79 54.25 1onk n ASP 179 Cb 0.15 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.84 1onk n ASP 179 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1onk n GLY 180 N 0.63 0.36 3.86 6.12 0.00 -0.39 -4.40 105.19 111.37 1onk n GLY 180 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1onk n GLY 180 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1onk s SER 181 N -2.28 6.62 -0.24 1.61 1.04 -1.25 0.21 113.70 119.41 1onk s SER 181 Ca 0.00 1.28 0.02 0.00 0.48 0.00 0.00 55.95 57.73 1onk s SER 181 Cb 0.00 -2.38 0.05 0.00 0.10 0.00 0.00 66.02 63.79 1onk s SER 181 CO 0.00 -0.39 -0.12 -0.63 0.98 0.00 0.00 173.24 173.07 1onk s ILE 182 N -2.33 2.06 -0.06 -1.02 1.01 -1.26 -1.64 121.20 117.96 1onk s ILE 182 Ca 0.54 -1.43 0.05 0.00 0.00 0.00 0.00 60.65 59.81 1onk s ILE 182 Cb -0.10 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 1onk s ILE 182 CO 0.27 0.09 -0.22 -0.13 0.00 0.00 0.00 174.94 174.95 1onk s ARG 183 N 1.18 2.36 0.17 2.79 0.52 -0.26 -0.88 118.95 124.83 1onk s ARG 183 Ca -0.06 -0.80 -0.32 0.00 -0.52 0.00 0.00 55.73 54.04 1onk s ARG 183 Cb -0.18 -1.98 -0.11 0.00 0.52 0.00 0.00 34.95 33.20 1onk s ARG 183 CO -0.07 0.30 1.76 -1.25 0.02 0.00 0.00 175.30 176.06 1onk s PRO 184 N -0.01 4.14 0.51 3.54 0.04 -1.26 0.30 135.00 142.26 1onk s PRO 184 Ca -0.06 2.58 0.19 0.00 0.04 0.00 0.00 61.00 63.76 1onk s PRO 184 Cb -0.14 -3.30 1.28 0.00 0.04 0.00 0.00 34.50 32.38 1onk s PRO 184 CO 0.04 -0.78 2.06 -0.22 0.04 0.00 0.00 177.00 178.14 1onk h LYS 185 N 7.58 0.07 0.00 4.56 3.64 -1.77 0.13 116.57 130.77 1onk h LYS 185 Ca -0.44 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1onk h LYS 185 Cb 1.21 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1onk h LYS 185 CO 0.95 0.05 0.00 1.04 -2.27 0.00 0.00 179.45 179.22 1onk n GLN 186 N -4.46 0.03 -3.21 1.90 6.02 -1.26 -4.43 117.38 111.96 1onk n GLN 186 Ca 0.04 0.06 -0.01 0.00 -0.01 0.00 0.00 57.00 57.08 1onk n GLN 186 Cb 0.34 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 30.05 1onk n GLN 186 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1onk s ASN 187 N -3.18 -1.00 -0.07 1.08 3.84 0.44 -5.01 114.94 111.03 1onk s ASN 187 Ca 0.13 -0.33 0.09 0.00 0.21 0.00 0.00 52.86 52.95 1onk s ASN 187 Cb 0.17 1.73 0.36 0.00 -0.55 0.00 0.00 41.25 42.96 1onk s ASN 187 CO 0.50 -0.27 1.17 0.00 -2.79 0.00 0.00 177.10 175.71 1onk n GLN 188 N 5.04 2.43 0.02 0.43 6.02 -1.19 -2.02 117.38 128.11 1onk n GLN 188 Ca 0.06 -1.42 0.12 0.00 -0.01 0.00 0.00 57.00 55.75 1onk n GLN 188 Cb 0.53 -1.62 0.13 0.00 1.02 0.00 0.00 30.24 30.31 1onk n GLN 188 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1onk n ASP 189 N 0.41 0.62 -4.83 1.08 8.00 -1.26 -4.96 116.55 115.61 1onk n ASP 189 Ca 0.13 -0.26 -0.26 0.00 0.71 0.00 0.00 54.79 55.11 1onk n ASP 189 Cb 0.53 0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 42.06 1onk n ASP 189 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1onk s GLN 190 N -3.08 3.00 -0.02 -1.24 -1.52 -0.85 0.31 119.66 116.25 1onk s GLN 190 Ca 0.08 -0.84 -0.01 0.00 -1.95 0.00 0.00 55.36 52.64 1onk s GLN 190 Cb 0.16 -2.70 0.02 0.00 -0.22 0.00 0.00 33.01 30.27 1onk s GLN 190 CO 0.75 0.48 0.05 0.00 -0.25 0.00 0.00 175.29 176.32 1onk n LEU 192 N 3.57 3.77 -3.73 0.00 4.77 -0.06 -2.70 117.00 122.61 1onk n LEU 192 Ca -0.19 1.15 -0.13 0.00 -0.03 0.00 0.00 56.01 56.81 1onk n LEU 192 Cb 0.56 -1.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.00 1onk n LEU 192 CO 0.23 -0.16 -0.16 -0.89 -1.33 0.00 0.00 177.39 175.08 1onk s THR 193 N -0.08 -0.06 -0.76 -5.08 2.01 -0.29 -4.39 115.64 106.99 1onk s THR 193 Ca 0.65 0.16 -0.23 0.00 0.31 0.00 0.00 61.69 62.59 1onk s THR 193 Cb -0.57 -0.34 0.07 0.00 0.01 0.00 0.00 72.50 71.67 1onk s THR 193 CO 0.50 0.07 1.12 -0.94 -0.69 0.00 0.00 174.62 174.67 1onk s SER 194 N 1.28 6.28 0.65 3.53 1.04 -0.25 -1.76 113.70 124.47 1onk s SER 194 Ca -0.09 -1.08 0.35 0.00 0.48 0.00 0.00 55.95 55.61 1onk s SER 194 Cb -0.11 -2.46 1.91 0.00 0.10 0.00 0.00 66.02 65.46 1onk s SER 194 CO -0.08 -1.48 2.10 1.23 0.98 0.00 0.00 173.24 175.99 1onk h GLY 195 N 11.75 0.00 -2.55 7.32 0.00 -1.86 -3.42 103.07 114.31 1onk h GLY 195 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 46.89 1onk h GLY 195 CO 1.22 0.00 -0.63 0.50 0.00 0.00 0.00 176.54 177.64 1onk s ARG 196 N -4.21 1.23 0.00 4.80 0.52 -1.26 -5.04 118.95 114.99 1onk s ARG 196 Ca -0.04 -1.64 0.26 0.00 -0.52 0.00 0.00 55.73 53.78 1onk s ARG 196 Cb 0.11 0.04 0.60 0.00 0.52 0.00 0.00 34.95 36.23 1onk s ARG 196 CO 0.37 -0.32 1.48 -0.25 0.02 0.00 0.00 175.30 176.60 1onk n ASP 197 N -0.31 1.96 -4.77 0.23 8.00 -1.26 -4.91 116.55 115.50 1onk n ASP 197 Ca -0.00 -1.56 -0.41 0.00 0.71 0.00 0.00 54.79 53.52 1onk n ASP 197 Cb 0.66 0.08 -0.01 0.00 -0.02 0.00 0.00 41.12 41.82 1onk n ASP 197 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1onk s SER 198 N -2.14 6.54 0.27 -2.24 0.01 -1.26 -4.93 113.70 109.95 1onk s SER 198 Ca 0.30 2.86 -0.29 0.00 1.31 0.00 0.00 55.95 60.13 1onk s SER 198 Cb 0.20 -2.65 -0.14 0.00 0.21 0.00 0.00 66.02 63.64 1onk s SER 198 CO 0.38 -0.74 1.18 0.52 0.41 0.00 0.00 173.24 175.00 1onk n VAL 199 N 1.08 1.62 -1.03 3.43 0.31 -1.26 -0.98 118.33 121.49 1onk n VAL 199 Ca 0.02 -0.40 -0.01 0.00 -0.01 0.00 0.00 64.34 63.94 1onk n VAL 199 Cb 0.40 -1.21 -0.00 0.00 -0.91 0.00 0.00 33.84 32.11 1onk n VAL 199 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1onk n SER 200 N 1.42 -4.13 -4.71 4.52 7.64 -0.15 -4.98 113.62 113.23 1onk n SER 200 Ca 0.10 0.03 -0.43 0.00 1.01 0.00 0.00 58.87 59.58 1onk n SER 200 Cb 0.32 -1.73 -0.03 0.00 -1.01 0.00 0.00 64.21 61.76 1onk n SER 200 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1onk n THR 201 N -2.64 0.14 -2.75 0.44 -1.04 -0.15 -4.74 114.28 103.54 1onk n THR 201 Ca -0.01 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1onk n THR 201 Cb 0.20 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 66.78 1onk n THR 201 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1onk s VAL 202 N 0.96 4.85 0.24 12.58 1.01 -1.26 -0.06 120.40 138.73 1onk s VAL 202 Ca 0.74 1.97 -0.28 0.00 0.00 0.00 0.00 61.98 64.41 1onk s VAL 202 Cb -0.54 -4.28 -0.09 0.00 0.00 0.00 0.00 36.38 31.48 1onk s VAL 202 CO 0.35 0.10 0.90 -0.63 0.00 0.00 0.00 175.10 175.82 1onk s ILE 203 N 1.48 4.17 0.08 2.22 1.01 0.37 -4.59 121.20 125.94 1onk s ILE 203 Ca 0.48 1.93 0.02 0.00 0.00 0.00 0.00 60.65 63.08 1onk s ILE 203 Cb -0.19 -4.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.06 1onk s ILE 203 CO 0.22 0.42 0.06 -0.46 0.00 0.00 0.00 174.94 175.18 1onk n ASN 204 N 1.30 0.09 -4.13 3.58 6.94 -0.72 -4.35 115.26 117.97 1onk n ASN 204 Ca -0.02 -1.50 -0.33 0.00 -0.02 0.00 0.00 54.58 52.71 1onk n ASN 204 Cb 0.48 0.35 -0.15 0.00 -2.36 0.00 0.00 39.78 38.10 1onk n ASN 204 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1onk s ILE 205 N -2.21 2.31 0.19 1.53 1.01 0.31 -1.14 121.20 123.19 1onk s ILE 205 Ca 0.08 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 59.60 1onk s ILE 205 Cb 0.00 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 1onk s ILE 205 CO 0.06 0.30 0.03 0.68 0.00 0.00 0.00 174.94 176.01 1onk s VAL 206 N 1.25 0.58 0.23 2.92 -7.23 -1.10 -4.41 120.40 112.64 1onk s VAL 206 Ca -0.00 -1.98 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 1onk s VAL 206 Cb -0.16 -2.26 -0.15 0.00 0.56 0.00 0.00 36.38 34.37 1onk s VAL 206 CO -0.09 -0.33 1.05 -0.24 -0.31 0.00 0.00 175.10 175.18 1onk n SER 207 N -0.29 1.17 0.00 4.85 2.88 -1.26 0.05 113.62 121.01 1onk n SER 207 Ca -0.04 1.16 0.14 0.00 -1.33 0.00 0.00 58.87 58.80 1onk n SER 207 Cb 0.64 -1.24 0.81 0.00 -0.75 0.00 0.00 64.21 63.67 1onk n SER 207 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1onk h SER 209 N 0.00 0.30 0.14 0.00 4.64 -1.90 -0.35 113.55 116.37 1onk h SER 209 Ca 0.00 -0.10 -0.09 0.00 -0.47 0.00 0.00 61.79 61.13 1onk h SER 209 Cb 0.09 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 1onk h SER 209 CO 0.00 0.58 -0.33 1.23 -0.87 0.00 0.00 176.83 177.44 1onk h GLY 210 N 1.03 0.31 -5.87 -0.77 0.00 -1.99 -3.46 103.07 92.32 1onk h GLY 210 Ca 0.04 -0.26 -0.37 0.00 0.00 0.00 0.00 47.33 46.74 1onk h GLY 210 CO 0.05 0.24 -0.81 0.00 0.00 0.00 0.00 176.54 176.01 1onk n ALA 211 N -2.48 -2.08 -1.71 3.60 0.00 -0.14 -4.90 120.51 112.79 1onk n ALA 211 Ca -0.01 -0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.03 1onk n ALA 211 Cb 0.42 -2.52 0.16 0.00 0.00 0.00 0.00 19.45 17.52 1onk n ALA 211 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1onk s SER 212 N -4.25 3.19 0.42 0.00 1.04 -1.26 -1.71 113.70 111.12 1onk s SER 212 Ca 0.06 0.59 0.25 0.00 0.48 0.00 0.00 55.95 57.32 1onk s SER 212 Cb -0.01 -0.87 1.29 0.00 0.10 0.00 0.00 66.02 66.53 1onk s SER 212 CO 0.78 -2.71 1.68 1.23 0.98 0.00 0.00 173.24 175.19 1onk h GLY 213 N -1.62 1.34 -2.96 7.32 0.00 -1.82 -0.58 103.07 104.74 1onk h GLY 213 Ca -0.46 -0.15 -0.17 0.00 0.00 0.00 0.00 47.33 46.55 1onk h GLY 213 CO 0.49 -0.32 0.16 -1.14 0.00 0.00 0.00 176.54 175.73 1onk n SER 214 N -4.70 4.26 -0.76 0.19 3.41 -1.26 -3.10 113.62 111.65 1onk n SER 214 Ca 0.33 -3.27 0.09 0.00 -0.26 0.00 0.00 58.87 55.75 1onk n SER 214 Cb 1.21 -0.69 0.11 0.00 -0.26 0.00 0.00 64.21 64.59 1onk n SER 214 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1onk n GLN 215 N -0.40 1.74 -3.97 4.33 6.02 -0.23 -1.09 117.38 123.78 1onk n GLN 215 Ca 0.36 -1.73 -0.35 0.00 -0.01 0.00 0.00 57.00 55.27 1onk n GLN 215 Cb 1.23 -1.35 -0.13 0.00 1.02 0.00 0.00 30.24 31.01 1onk n GLN 215 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1onk s ARG 216 N -1.31 3.50 0.26 -1.09 3.52 -1.18 -3.76 118.95 118.89 1onk s ARG 216 Ca 0.24 -0.57 0.07 0.00 -0.13 0.00 0.00 55.73 55.33 1onk s ARG 216 Cb 0.15 -3.07 -0.05 0.00 -1.56 0.00 0.00 34.95 30.42 1onk s ARG 216 CO 0.22 -0.12 -0.07 -1.58 -0.81 0.00 0.00 175.30 172.94 1onk s TRP 217 N 1.31 1.86 -0.10 5.12 0.52 0.13 -1.84 118.94 125.94 1onk s TRP 217 Ca 0.04 -0.69 -0.00 0.00 0.02 0.00 0.00 56.10 55.46 1onk s TRP 217 Cb -0.15 -1.02 0.02 0.00 -1.15 0.00 0.00 33.47 31.18 1onk s TRP 217 CO -0.00 0.26 -0.08 0.08 0.02 0.00 0.00 176.95 177.24 1onk s VAL 218 N -3.04 0.99 -0.09 4.03 1.01 0.47 -4.75 120.40 119.02 1onk s VAL 218 Ca 0.28 -0.28 -0.26 0.00 0.00 0.00 0.00 61.98 61.71 1onk s VAL 218 Cb 0.03 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 1onk s VAL 218 CO 0.10 0.36 0.83 -0.36 0.00 0.00 0.00 175.10 176.03 1onk s PHE 219 N 1.56 3.53 0.16 5.22 0.40 -1.26 -0.93 117.98 126.67 1onk s PHE 219 Ca 0.02 1.38 0.03 0.00 -0.60 0.00 0.00 56.93 57.76 1onk s PHE 219 Cb -0.13 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.38 1onk s PHE 219 CO -0.06 -0.08 0.28 0.95 0.70 0.00 0.00 175.22 177.01 1onk s THR 220 N 1.44 5.25 0.55 0.64 -4.23 -0.63 -4.98 115.64 113.67 1onk s THR 220 Ca 0.42 -0.76 0.26 0.00 -1.18 0.00 0.00 61.69 60.43 1onk s THR 220 Cb -0.18 -3.72 0.37 0.00 1.34 0.00 0.00 72.50 70.31 1onk s THR 220 CO 0.18 -0.13 2.02 -1.13 -0.54 0.00 0.00 174.62 175.03 1onk h ASN 221 N 2.03 0.00 0.17 3.99 -0.73 -1.98 -0.30 115.58 118.77 1onk h ASN 221 Ca -0.49 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.68 1onk h ASN 221 Cb 1.20 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.79 1onk h ASN 221 CO 0.67 0.00 -0.02 -0.62 -0.37 0.00 0.00 177.43 177.09 1onk n GLU 222 N -4.17 0.92 -0.15 6.67 4.71 -1.26 -4.91 120.64 122.46 1onk n GLU 222 Ca 0.06 -0.18 0.00 0.00 -0.01 0.00 0.00 57.16 57.04 1onk n GLU 222 Cb 0.50 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.43 1onk n GLU 222 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1onk n GLY 223 N 1.13 0.66 3.90 0.62 0.00 -0.12 -4.89 105.19 106.49 1onk n GLY 223 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 1onk n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1onk s ALA 224 N -2.22 3.48 -0.31 4.61 0.00 -1.26 0.07 121.76 126.13 1onk s ALA 224 Ca 0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 1onk s ALA 224 Cb 0.00 -2.49 0.06 0.00 0.00 0.00 0.00 23.12 20.69 1onk s ALA 224 CO 0.00 -0.03 0.01 0.42 0.00 0.00 0.00 175.76 176.15 1onk s ILE 225 N -2.39 2.81 0.00 0.00 1.01 -1.26 -1.61 121.20 119.77 1onk s ILE 225 Ca 0.47 -1.58 0.02 0.00 0.00 0.00 0.00 60.65 59.56 1onk s ILE 225 Cb -0.10 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 1onk s ILE 225 CO 0.35 -0.20 -0.03 -0.76 0.00 0.00 0.00 174.94 174.30 1onk s LEU 226 N 1.18 3.34 0.03 2.97 1.43 -0.11 -0.52 118.68 127.00 1onk s LEU 226 Ca -0.03 -0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.69 1onk s LEU 226 Cb -0.20 -1.91 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 1onk s LEU 226 CO -0.03 0.28 1.44 0.21 0.23 0.00 0.00 176.35 178.49 1onk s ASN 227 N -1.48 6.81 0.20 2.29 3.84 -0.56 -0.39 114.94 125.64 1onk s ASN 227 Ca 0.18 2.20 -0.10 0.00 0.21 0.00 0.00 52.86 55.35 1onk s ASN 227 Cb -0.11 -2.56 0.22 0.00 -0.55 0.00 0.00 41.25 38.25 1onk s ASN 227 CO 0.09 -0.74 1.78 0.25 -2.79 0.00 0.00 177.10 175.69 1onk h LEU 228 N 8.20 0.40 0.03 3.21 5.85 -1.62 0.11 115.31 131.48 1onk h LEU 228 Ca -0.39 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 1onk h LEU 228 Cb 1.19 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1onk h LEU 228 CO 0.90 0.26 -0.17 0.50 -0.34 0.00 0.00 178.44 179.59 1onk h LYS 229 N 0.55 0.07 -0.00 1.25 3.64 -1.82 -3.36 116.57 116.89 1onk h LYS 229 Ca 0.28 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1onk h LYS 229 Cb 0.23 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1onk h LYS 229 CO -0.21 1.03 -0.51 0.27 -2.27 0.00 0.00 179.45 177.75 1onk n ASN 230 N -4.52 0.79 0.00 4.20 0.23 -1.21 -4.95 115.26 109.81 1onk n ASN 230 Ca -0.11 -0.59 0.00 0.00 -0.53 0.00 0.00 54.58 53.35 1onk n ASN 230 Cb 0.54 0.35 0.00 0.00 -2.08 0.00 0.00 39.78 38.59 1onk n ASN 230 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1onk n GLY 231 N 1.46 0.51 3.86 4.83 0.00 0.02 -5.00 105.19 110.88 1onk n GLY 231 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1onk n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1onk s LEU 232 N 0.00 3.53 -0.09 0.99 1.43 -1.26 -4.61 118.68 118.66 1onk s LEU 232 Ca 0.00 1.41 -0.06 0.00 -1.03 0.00 0.00 54.13 54.45 1onk s LEU 232 Cb 0.00 -4.38 -0.04 0.00 0.03 0.00 0.00 46.19 41.80 1onk s LEU 232 CO 0.00 -0.65 0.14 0.00 0.23 0.00 0.00 176.35 176.07 1onk s ALA 233 N -2.78 3.87 0.23 4.21 0.00 0.14 -1.50 121.76 125.93 1onk s ALA 233 Ca 0.56 -0.67 -0.31 0.00 0.00 0.00 0.00 51.96 51.53 1onk s ALA 233 Cb -0.10 -1.93 -0.11 0.00 0.00 0.00 0.00 23.12 20.98 1onk s ALA 233 CO 0.40 0.65 1.59 -1.64 0.00 0.00 0.00 175.76 176.75 1onk s MET 234 N -1.23 4.18 -0.03 0.00 -1.94 0.32 -0.85 119.30 119.75 1onk s MET 234 Ca 0.18 2.47 -0.01 0.00 -1.71 0.00 0.00 55.69 56.62 1onk s MET 234 Cb -0.12 -3.09 0.03 0.00 2.01 0.00 0.00 34.83 33.66 1onk s MET 234 CO 0.07 -0.62 0.05 0.34 -0.01 0.00 0.00 175.02 174.86 1onk s ASP 235 N 0.83 0.22 -0.53 3.03 -1.08 0.15 -4.50 116.67 114.80 1onk s ASP 235 Ca 0.67 0.09 -0.28 0.00 -0.52 0.00 0.00 52.55 52.51 1onk s ASP 235 Cb -0.46 -0.04 0.02 0.00 -1.46 0.00 0.00 42.92 40.99 1onk s ASP 235 CO 0.38 -0.15 1.30 -0.69 0.52 0.00 0.00 175.17 176.52 1onk s VAL 236 N 1.29 3.95 -0.31 1.11 1.01 0.42 -0.21 120.40 127.66 1onk s VAL 236 Ca -0.07 0.89 -0.36 0.00 0.00 0.00 0.00 61.98 62.45 1onk s VAL 236 Cb -0.13 -4.52 -0.12 0.00 0.00 0.00 0.00 36.38 31.62 1onk s VAL 236 CO -0.03 -1.12 2.11 0.00 0.00 0.00 0.00 175.10 176.05 1onk n ALA 237 N 8.78 0.91 -3.51 5.51 0.00 -1.04 -4.90 120.51 126.26 1onk n ALA 237 Ca 0.12 0.03 -0.32 0.00 0.00 0.00 0.00 53.44 53.26 1onk n ALA 237 Cb 0.49 -2.51 -0.17 0.00 0.00 0.00 0.00 19.45 17.27 1onk n ALA 237 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1onk s GLN 238 N 5.68 3.02 0.00 0.00 2.00 -1.26 -3.26 119.66 125.85 1onk s GLN 238 Ca 1.07 -0.86 0.00 0.00 -2.00 0.00 0.00 55.36 53.56 1onk s GLN 238 Cb -0.86 -2.38 0.00 0.00 0.80 0.00 0.00 33.01 30.56 1onk s GLN 238 CO 0.51 0.05 0.00 0.00 -0.50 0.00 0.00 175.29 175.36 1onk n ALA 239 N 3.88 0.00 0.00 1.58 0.00 -1.26 -5.09 120.51 119.62 1onk n ALA 239 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1onk n ALA 239 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1onk n ALA 239 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1onk n ASN 240 N 0.00 0.00 0.27 0.00 2.85 -1.20 -4.98 115.26 112.19 1onk n ASN 240 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 1onk n ASN 240 Cb 0.00 0.00 0.66 0.00 1.24 0.00 0.00 39.78 41.68 1onk n ASN 240 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1onk h PRO 241 N 0.00 0.00 0.00 1.20 0.13 -1.86 -1.77 132.00 129.70 1onk h PRO 241 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 1onk h PRO 241 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1onk h PRO 241 CO 0.00 0.00 -0.50 1.57 -0.23 0.00 0.00 178.00 178.84 1onk h LYS 242 N 0.00 0.00 0.00 0.86 5.09 -1.93 -0.41 116.57 120.19 1onk h LYS 242 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.71 1onk h LYS 242 Cb 0.57 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.89 1onk h LYS 242 CO 0.00 0.50 -0.16 1.25 -2.09 0.00 0.00 179.45 178.96 1onk h LEU 243 N 0.00 0.00 0.00 7.07 6.46 -1.65 -3.47 115.31 123.72 1onk h LEU 243 Ca -0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1onk h LEU 243 Cb 1.05 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.98 1onk h LEU 243 CO 0.07 0.16 0.00 0.54 -0.62 0.00 0.00 178.44 178.58 1onk n ARG 244 N -3.92 0.00 0.00 1.25 5.12 -0.16 -5.01 116.66 113.94 1onk n ARG 244 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1onk n ARG 244 Cb 0.25 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.55 1onk n ARG 244 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1onk n ARG 245 N 0.00 0.00 -3.68 5.56 1.74 -1.26 -4.52 116.66 114.50 1onk n ARG 245 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1onk n ARG 245 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 1onk n ARG 245 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1onk s ILE 246 N 0.00 5.38 0.38 0.55 1.01 -1.26 -2.48 121.20 124.78 1onk s ILE 246 Ca 0.00 0.32 0.06 0.00 0.00 0.00 0.00 60.65 61.03 1onk s ILE 246 Cb 0.00 -3.52 -0.07 0.00 0.01 0.00 0.00 42.46 38.88 1onk s ILE 246 CO 0.00 0.45 0.02 0.27 0.00 0.00 0.00 174.94 175.68 1onk s ILE 247 N 0.21 1.75 0.05 2.92 -4.36 0.71 -0.48 121.20 122.01 1onk s ILE 247 Ca 0.12 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.38 1onk s ILE 247 Cb -0.12 -2.93 -0.06 0.00 1.25 0.00 0.00 42.46 40.60 1onk s ILE 247 CO 0.01 -0.00 0.43 0.27 0.24 0.00 0.00 174.94 175.88 1onk s ILE 248 N -2.89 5.02 0.03 8.37 -4.36 0.91 0.32 121.20 128.61 1onk s ILE 248 Ca 0.35 0.69 -0.13 0.00 -0.26 0.00 0.00 60.65 61.31 1onk s ILE 248 Cb 0.10 -3.69 0.02 0.00 1.25 0.00 0.00 42.46 40.13 1onk s ILE 248 CO 0.17 0.42 0.27 -0.47 0.24 0.00 0.00 174.94 175.57 1onk s TYR 249 N -1.26 -0.07 0.38 1.37 5.04 -0.03 -0.98 117.35 121.81 1onk s TYR 249 Ca 0.29 -0.06 -0.26 0.00 -2.44 0.00 0.00 57.07 54.61 1onk s TYR 249 Cb -0.15 0.06 -0.11 0.00 0.35 0.00 0.00 41.96 42.10 1onk s TYR 249 CO 0.16 -0.47 1.06 -2.30 -1.34 0.00 0.00 175.55 172.67 1onk n PRO 250 N 0.71 1.50 -1.94 4.97 -0.02 -1.26 0.24 135.00 139.19 1onk n PRO 250 Ca -0.19 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 1onk n PRO 250 Cb 0.59 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 1onk n PRO 250 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1onk s ALA 251 N -1.20 3.74 0.00 3.55 0.00 -1.26 -4.71 121.76 121.87 1onk s ALA 251 Ca 0.61 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.94 1onk s ALA 251 Cb -0.58 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1onk s ALA 251 CO 0.58 -0.78 0.00 0.25 0.00 0.00 0.00 175.76 175.81 1onk n THR 252 N 3.46 0.00 -0.95 0.00 -2.24 -1.26 -5.00 114.28 108.29 1onk n THR 252 Ca 0.12 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1onk n THR 252 Cb 0.39 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1onk n THR 252 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1onk n GLY 253 N 1.39 0.48 3.91 3.38 0.00 -1.26 -5.00 105.19 108.09 1onk n GLY 253 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1onk n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1onk s LYS 254 N -0.48 2.94 0.63 1.61 1.02 -1.26 -4.92 119.74 119.28 1onk s LYS 254 Ca 0.00 0.14 0.36 0.00 0.02 0.00 0.00 55.97 56.49 1onk s LYS 254 Cb 0.00 -2.21 2.02 0.00 -0.52 0.00 0.00 37.83 37.13 1onk s LYS 254 CO 0.00 -0.77 2.24 -1.35 -0.92 0.00 0.00 175.35 174.56 1onk h PRO 255 N -0.29 0.00 -0.24 -1.68 0.11 -1.95 -0.16 132.00 127.79 1onk h PRO 255 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1onk h PRO 255 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1onk h PRO 255 CO 0.62 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.68 1onk n ASN 256 N -3.43 1.12 -0.02 -2.05 6.94 -1.26 -2.68 115.26 113.88 1onk n ASN 256 Ca -0.02 -2.02 0.01 0.00 -0.02 0.00 0.00 54.58 52.53 1onk n ASN 256 Cb 0.16 -0.16 0.01 0.00 -2.36 0.00 0.00 39.78 37.43 1onk n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1onk n GLN 257 N 0.07 2.03 -4.66 -3.83 6.02 -0.08 -0.44 117.38 116.49 1onk n GLN 257 Ca 0.07 -1.29 -0.34 0.00 -0.01 0.00 0.00 57.00 55.43 1onk n GLN 257 Cb 0.19 -0.89 -0.12 0.00 1.02 0.00 0.00 30.24 30.44 1onk n GLN 257 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1onk s MET 258 N -0.83 2.87 0.14 -1.09 -1.94 -1.09 -4.10 119.30 113.25 1onk s MET 258 Ca 0.02 -0.59 0.01 0.00 -1.71 0.00 0.00 55.69 53.42 1onk s MET 258 Cb 0.02 -2.59 -0.04 0.00 2.01 0.00 0.00 34.83 34.22 1onk s MET 258 CO 0.00 0.56 -0.00 -1.58 -0.01 0.00 0.00 175.02 173.99 1onk s TRP 259 N -0.54 0.99 -0.24 -0.03 0.52 0.11 -3.77 118.94 115.98 1onk s TRP 259 Ca 0.08 -1.06 -0.03 0.00 0.02 0.00 0.00 56.10 55.12 1onk s TRP 259 Cb -0.12 -0.58 0.13 0.00 -1.15 0.00 0.00 33.47 31.76 1onk s TRP 259 CO 0.02 -0.29 0.35 -1.17 0.02 0.00 0.00 176.95 175.87 1onk s LEU 260 N -3.09 -0.53 0.05 2.99 2.96 -0.20 -4.62 118.68 116.24 1onk s LEU 260 Ca 0.20 0.05 -0.30 0.00 -0.22 0.00 0.00 54.13 53.85 1onk s LEU 260 Cb 0.06 0.95 -0.04 0.00 0.50 0.00 0.00 46.19 47.66 1onk s LEU 260 CO 0.00 -0.31 1.04 -2.16 -1.32 0.00 0.00 176.35 173.60 1onk s PRO 261 N 2.49 4.55 -0.06 0.98 0.04 -1.26 -0.95 135.00 140.80 1onk s PRO 261 Ca 0.11 1.54 0.05 0.00 0.04 0.00 0.00 61.00 62.74 1onk s PRO 261 Cb -0.15 -3.40 -0.00 0.00 0.04 0.00 0.00 34.50 30.98 1onk s PRO 261 CO -0.17 -0.05 -0.20 0.08 0.04 0.00 0.00 177.00 176.70 1onk s VAL 262 N 0.77 1.67 -2.00 -0.36 1.01 -0.47 -4.92 120.40 116.10 1onk s VAL 262 Ca 0.53 -0.84 0.16 0.00 0.00 0.00 0.00 61.98 61.82 1onk s VAL 262 Cb -0.24 -1.44 0.45 0.00 0.00 0.00 0.00 36.38 35.15 1onk s VAL 262 CO 0.29 0.47 1.35 0.49 0.00 0.00 0.00 175.10 177.71