#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n59 s PRO 2 N 0.00 0.29 0.19 1.61 0.04 -1.26 -4.01 135.00 131.85 1n59 s PRO 2 Ca 0.00 -0.10 -0.16 0.00 0.04 0.00 0.00 61.00 60.78 1n59 s PRO 2 Cb 0.00 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.78 1n59 s PRO 2 CO 0.00 -2.70 0.47 -1.01 0.04 0.00 0.00 177.00 173.80 1n59 s HIS 3 N -3.46 -0.02 0.15 0.56 3.76 -0.91 -4.93 115.29 110.45 1n59 s HIS 3 Ca 0.70 -0.33 -0.08 0.00 -0.15 0.00 0.00 55.06 55.20 1n59 s HIS 3 Cb -0.09 0.30 -0.01 0.00 1.11 0.00 0.00 32.58 33.89 1n59 s HIS 3 CO 0.54 -0.87 0.26 -1.54 -0.85 0.00 0.00 174.74 172.28 1n59 s SER 4 N -2.89 0.07 -0.15 1.40 1.04 -1.26 0.92 113.70 112.83 1n59 s SER 4 Ca 0.10 -0.87 -0.00 0.00 0.48 0.00 0.00 55.95 55.66 1n59 s SER 4 Cb -0.00 0.42 0.04 0.00 0.10 0.00 0.00 66.02 66.57 1n59 s SER 4 CO -0.03 -0.87 -0.06 -0.22 0.98 0.00 0.00 173.24 173.05 1n59 s LEU 5 N -2.96 1.49 -0.06 2.42 2.96 -0.68 -2.42 118.68 119.42 1n59 s LEU 5 Ca 0.16 -0.55 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 1n59 s LEU 5 Cb 0.04 -0.90 -0.01 0.00 0.50 0.00 0.00 46.19 45.82 1n59 s LEU 5 CO -0.01 -0.16 -0.24 -0.13 -1.32 0.00 0.00 176.35 174.48 1n59 s ARG 6 N 1.65 2.59 -0.18 1.98 0.52 0.15 -1.89 118.95 123.77 1n59 s ARG 6 Ca 0.02 -0.89 -0.02 0.00 -0.52 0.00 0.00 55.73 54.33 1n59 s ARG 6 Cb -0.14 -2.15 -0.00 0.00 0.52 0.00 0.00 34.95 33.17 1n59 s ARG 6 CO -0.08 0.34 -0.10 0.71 0.02 0.00 0.00 175.30 176.19 1n59 s TYR 7 N -0.07 2.87 -0.40 -0.53 2.02 0.06 -1.12 117.35 120.18 1n59 s TYR 7 Ca -0.06 -1.01 -0.11 0.00 -0.37 0.00 0.00 57.07 55.52 1n59 s TYR 7 Cb -0.14 -1.99 0.05 0.00 -0.40 0.00 0.00 41.96 39.48 1n59 s TYR 7 CO 0.04 -0.51 0.24 -0.06 -1.57 0.00 0.00 175.55 173.70 1n59 s PHE 8 N 1.10 3.27 -0.06 2.71 0.08 0.22 -2.99 117.98 122.32 1n59 s PHE 8 Ca 0.01 -1.15 0.03 0.00 0.12 0.00 0.00 56.93 55.93 1n59 s PHE 8 Cb -0.14 -2.69 -0.03 0.00 -0.57 0.00 0.00 43.02 39.59 1n59 s PHE 8 CO -0.03 -0.73 -0.12 0.14 -0.10 0.00 0.00 175.22 174.38 1n59 s VAL 9 N 1.52 3.28 0.01 -0.44 -7.23 -0.87 -0.96 120.40 115.71 1n59 s VAL 9 Ca 0.02 -0.64 0.01 0.00 -1.81 0.00 0.00 61.98 59.57 1n59 s VAL 9 Cb -0.21 -2.31 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 1n59 s VAL 9 CO 0.05 0.59 -0.04 -0.89 -0.31 0.00 0.00 175.10 174.51 1n59 s THR 10 N -0.72 0.26 -0.03 5.32 2.01 -0.37 -1.77 115.64 120.33 1n59 s THR 10 Ca 0.11 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1n59 s THR 10 Cb -0.11 -0.27 0.01 0.00 0.01 0.00 0.00 72.50 72.14 1n59 s THR 10 CO 0.01 -0.08 -0.08 0.00 -0.69 0.00 0.00 174.62 173.78 1n59 s ALA 11 N -0.45 0.84 -0.11 7.40 0.00 -0.33 -1.21 121.76 127.91 1n59 s ALA 11 Ca -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 51.96 51.65 1n59 s ALA 11 Cb -0.04 -0.37 0.04 0.00 0.00 0.00 0.00 23.12 22.76 1n59 s ALA 11 CO -0.00 0.10 0.03 0.14 0.00 0.00 0.00 175.76 176.02 1n59 s VAL 12 N 0.43 0.28 0.47 0.00 -7.23 -0.83 -1.37 120.40 112.15 1n59 s VAL 12 Ca -0.07 -0.03 -0.23 0.00 -1.81 0.00 0.00 61.98 59.84 1n59 s VAL 12 Cb -0.11 -0.60 -0.07 0.00 0.56 0.00 0.00 36.38 36.16 1n59 s VAL 12 CO 0.01 0.07 1.22 -0.94 -0.31 0.00 0.00 175.10 175.14 1n59 s SER 13 N 2.00 6.01 -0.43 4.85 1.04 -0.82 -1.60 113.70 124.75 1n59 s SER 13 Ca 0.03 2.43 0.07 0.00 0.48 0.00 0.00 55.95 58.96 1n59 s SER 13 Cb -0.14 -2.61 0.22 0.00 0.10 0.00 0.00 66.02 63.59 1n59 s SER 13 CO -0.06 -1.04 0.58 -2.11 0.98 0.00 0.00 173.24 171.60 1n59 n ARG 14 N -0.53 0.59 -1.59 4.02 1.85 -1.26 -3.88 116.66 115.86 1n59 n ARG 14 Ca 0.07 -2.76 -0.50 0.00 -1.00 0.00 0.00 57.85 53.66 1n59 n ARG 14 Cb 0.47 -1.39 -0.05 0.00 -1.05 0.00 0.00 32.46 30.44 1n59 n ARG 14 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1n59 n PRO 15 N 1.92 1.28 0.00 2.89 -0.02 -1.26 -1.07 135.00 138.73 1n59 n PRO 15 Ca 0.20 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1n59 n PRO 15 Cb 0.54 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1n59 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n59 n GLY 16 N 2.31 2.42 0.55 -1.23 0.00 -1.26 -4.82 105.19 103.17 1n59 n GLY 16 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1n59 n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n59 n LEU 17 N 0.00 2.47 0.00 0.99 4.77 -0.23 -5.10 117.00 119.89 1n59 n LEU 17 Ca 0.00 -1.53 0.00 0.00 -0.03 0.00 0.00 56.01 54.45 1n59 n LEU 17 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1n59 n LEU 17 CO 0.00 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1n59 n GLY 18 N 0.57 -0.71 3.75 -0.72 0.00 -1.23 -5.03 105.19 101.82 1n59 n GLY 18 Ca 0.09 -2.17 -0.37 0.00 0.00 0.00 0.00 46.02 43.57 1n59 n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n59 s GLU 19 N 0.00 3.08 1.03 1.61 0.41 -1.26 -4.53 118.70 119.04 1n59 s GLU 19 Ca 0.00 1.92 -0.17 0.00 -0.41 0.00 0.00 54.97 56.31 1n59 s GLU 19 Cb 0.00 -2.05 0.02 0.00 -1.78 0.00 0.00 34.13 30.32 1n59 s GLU 19 CO 0.00 -1.14 -0.09 -2.30 -0.49 0.00 0.00 175.26 171.24 1n59 n PRO 20 N -1.35 -0.80 -3.74 0.39 -0.02 -1.26 -4.80 135.00 123.42 1n59 n PRO 20 Ca 0.12 -0.21 -0.37 0.00 -2.02 0.00 0.00 63.50 61.03 1n59 n PRO 20 Cb 0.48 -1.62 -0.12 0.00 -0.02 0.00 0.00 33.50 32.22 1n59 n PRO 20 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1n59 s ARG 21 N -3.23 3.71 -0.09 -0.52 3.52 -0.63 -4.90 118.95 116.81 1n59 s ARG 21 Ca 0.53 -0.45 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 1n59 s ARG 21 Cb -0.14 -3.37 -0.03 0.00 -1.56 0.00 0.00 34.95 29.86 1n59 s ARG 21 CO 0.68 -0.18 -0.07 -0.47 -0.81 0.00 0.00 175.30 174.45 1n59 s TYR 22 N 1.61 2.92 0.02 5.12 5.04 -1.26 -1.97 117.35 128.83 1n59 s TYR 22 Ca 0.06 -0.13 0.00 0.00 -2.44 0.00 0.00 57.07 54.57 1n59 s TYR 22 Cb -0.15 -1.77 -0.02 0.00 0.35 0.00 0.00 41.96 40.37 1n59 s TYR 22 CO 0.05 0.19 -0.03 1.41 -1.34 0.00 0.00 175.55 175.82 1n59 s MET 23 N -0.44 0.31 -0.01 4.97 1.75 -0.35 0.15 119.30 125.68 1n59 s MET 23 Ca 0.06 -0.57 0.01 0.00 -1.25 0.00 0.00 55.69 53.94 1n59 s MET 23 Cb -0.12 0.05 0.00 0.00 2.84 0.00 0.00 34.83 37.61 1n59 s MET 23 CO 0.02 -0.03 -0.03 -1.21 -0.65 0.00 0.00 175.02 173.12 1n59 s GLU 24 N -1.34 0.28 -0.03 4.11 2.02 0.21 -1.24 118.70 122.70 1n59 s GLU 24 Ca -0.14 -0.07 -0.01 0.00 0.02 0.00 0.00 54.97 54.77 1n59 s GLU 24 Cb -0.09 -0.31 0.03 0.00 0.10 0.00 0.00 34.13 33.86 1n59 s GLU 24 CO -0.01 0.02 0.05 0.08 0.02 0.00 0.00 175.26 175.43 1n59 s VAL 25 N 0.17 -0.05 0.09 2.63 1.01 -0.13 -0.19 120.40 123.93 1n59 s VAL 25 Ca -0.01 0.18 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1n59 s VAL 25 Cb -0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 1n59 s VAL 25 CO -0.00 0.07 -0.25 -0.83 0.00 0.00 0.00 175.10 174.09 1n59 s GLY 26 N 0.92 1.52 0.04 4.51 0.00 -0.51 0.69 107.32 114.50 1n59 s GLY 26 Ca -0.08 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 43.32 1n59 s GLY 26 CO -0.03 -1.29 -0.09 -0.19 0.00 0.00 0.00 173.10 171.50 1n59 s TYR 27 N -0.95 0.74 -0.37 1.90 1.51 -0.28 -1.21 117.35 118.70 1n59 s TYR 27 Ca 0.13 -0.44 0.04 0.00 -1.01 0.00 0.00 57.07 55.79 1n59 s TYR 27 Cb -0.10 -0.44 0.10 0.00 -0.11 0.00 0.00 41.96 41.41 1n59 s TYR 27 CO 0.05 -0.05 0.09 0.08 -1.11 0.00 0.00 175.55 174.60 1n59 s VAL 28 N -1.20 2.39 -0.56 0.71 1.01 -1.06 -0.67 120.40 121.01 1n59 s VAL 28 Ca -0.07 -2.45 -0.14 0.00 0.00 0.00 0.00 61.98 59.31 1n59 s VAL 28 Cb -0.09 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.56 1n59 s VAL 28 CO 0.01 -0.63 0.64 0.47 0.00 0.00 0.00 175.10 175.58 1n59 n ASP 29 N 4.13 -7.16 0.00 3.32 8.00 -1.02 -3.15 116.55 120.68 1n59 n ASP 29 Ca 0.04 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.63 1n59 n ASP 29 Cb 0.41 -4.32 0.00 0.00 -0.02 0.00 0.00 41.12 37.19 1n59 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1n59 n ASP 30 N -0.92 0.00 -4.09 -2.24 8.00 -1.26 -4.94 116.55 111.10 1n59 n ASP 30 Ca 0.00 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.19 1n59 n ASP 30 Cb 0.54 -0.90 -0.16 0.00 -0.02 0.00 0.00 41.12 40.57 1n59 n ASP 30 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1n59 s THR 31 N -2.28 1.86 0.19 -3.53 -4.23 -1.19 -4.99 115.64 101.47 1n59 s THR 31 Ca 0.00 -0.83 -0.32 0.00 -1.18 0.00 0.00 61.69 59.36 1n59 s THR 31 Cb 0.00 -1.69 -0.11 0.00 1.34 0.00 0.00 72.50 72.04 1n59 s THR 31 CO 0.00 0.51 1.65 -0.70 -0.54 0.00 0.00 174.62 175.54 1n59 s GLU 32 N 1.23 4.16 0.00 3.99 2.12 -1.26 -2.58 118.70 126.37 1n59 s GLU 32 Ca 0.02 2.50 0.00 0.00 0.36 0.00 0.00 54.97 57.85 1n59 s GLU 32 Cb -0.14 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 31.15 1n59 s GLU 32 CO -0.09 -0.69 0.00 1.97 -0.54 0.00 0.00 175.26 175.91 1n59 n PHE 33 N 3.96 0.00 -3.87 5.30 -1.74 -0.35 -4.36 117.46 116.40 1n59 n PHE 33 Ca 0.15 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.95 1n59 n PHE 33 Cb 0.37 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.32 1n59 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1n59 s VAL 34 N -1.08 0.02 -0.14 1.97 -7.23 -1.20 -0.81 120.40 111.93 1n59 s VAL 34 Ca 0.00 -1.11 -0.34 0.00 -1.81 0.00 0.00 61.98 58.73 1n59 s VAL 34 Cb 0.00 -1.88 0.13 0.00 0.56 0.00 0.00 36.38 35.19 1n59 s VAL 34 CO 0.00 -0.09 1.14 0.00 -0.31 0.00 0.00 175.10 175.84 1n59 s ARG 35 N -3.94 0.43 -0.10 4.82 1.70 -0.89 -1.42 118.95 119.55 1n59 s ARG 35 Ca 0.15 -0.16 -0.06 0.00 -0.47 0.00 0.00 55.73 55.18 1n59 s ARG 35 Cb -0.01 0.19 0.04 0.00 -0.57 0.00 0.00 34.95 34.60 1n59 s ARG 35 CO 0.03 -0.19 0.24 0.12 -1.08 0.00 0.00 175.30 174.42 1n59 s PHE 36 N -2.58 -0.30 -0.11 5.89 5.36 0.74 -2.03 117.98 124.95 1n59 s PHE 36 Ca 0.09 0.72 -0.02 0.00 -0.96 0.00 0.00 56.93 56.76 1n59 s PHE 36 Cb -0.01 0.06 0.04 0.00 -0.34 0.00 0.00 43.02 42.77 1n59 s PHE 36 CO -0.05 -0.19 0.01 0.34 -1.46 0.00 0.00 175.22 173.87 1n59 s ASP 37 N 0.81 1.96 0.02 6.13 -1.08 -1.26 0.63 116.67 123.89 1n59 s ASP 37 Ca -0.06 -0.30 0.01 0.00 -0.52 0.00 0.00 52.55 51.69 1n59 s ASP 37 Cb -0.07 -0.48 0.06 0.00 -1.46 0.00 0.00 42.92 40.97 1n59 s ASP 37 CO -0.05 -0.23 0.95 -1.54 0.52 0.00 0.00 175.17 174.82 1n59 n SER 38 N 5.13 0.03 -1.15 -0.34 3.41 0.12 -1.25 113.62 119.57 1n59 n SER 38 Ca -0.08 0.43 0.12 0.00 -0.26 0.00 0.00 58.87 59.09 1n59 n SER 38 Cb 0.49 -0.44 0.22 0.00 -0.26 0.00 0.00 64.21 64.23 1n59 n SER 38 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1n59 n ASP 39 N -1.46 3.43 -4.36 4.04 9.92 -1.26 -4.81 116.55 122.05 1n59 n ASP 39 Ca -0.00 -1.99 -0.29 0.00 -0.53 0.00 0.00 54.79 51.98 1n59 n ASP 39 Cb 0.09 -0.25 0.21 0.00 -0.64 0.00 0.00 41.12 40.52 1n59 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1n59 s ALA 40 N -1.51 0.70 0.00 2.24 0.00 -0.38 -4.95 121.76 117.86 1n59 s ALA 40 Ca 0.39 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1n59 s ALA 40 Cb 0.23 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1n59 s ALA 40 CO 0.32 -3.20 0.78 0.39 0.00 0.00 0.00 175.76 174.04 1n59 n GLU 41 N -4.45 0.00 -3.94 0.00 1.02 -1.26 -4.33 120.64 107.68 1n59 n GLU 41 Ca 0.08 0.43 -0.35 0.00 -0.02 0.00 0.00 57.16 57.30 1n59 n GLU 41 Cb 0.58 -1.28 -0.14 0.00 -0.02 0.00 0.00 31.44 30.58 1n59 n GLU 41 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1n59 s ASN 42 N -2.31 4.43 -0.22 1.62 3.84 -1.26 -5.05 114.94 115.99 1n59 s ASN 42 Ca 0.00 -0.87 -0.29 0.00 0.21 0.00 0.00 52.86 51.92 1n59 s ASN 42 Cb 0.00 -1.69 -0.06 0.00 -0.55 0.00 0.00 41.25 38.95 1n59 s ASN 42 CO 0.00 -0.14 2.22 -2.65 -2.79 0.00 0.00 177.10 173.74 1n59 n PRO 43 N 4.69 1.93 -3.86 0.43 -0.02 -1.26 -4.96 135.00 131.95 1n59 n PRO 43 Ca -0.16 0.53 -0.11 0.00 -2.02 0.00 0.00 63.50 61.74 1n59 n PRO 43 Cb 0.47 -3.19 -0.10 0.00 -0.02 0.00 0.00 33.50 30.67 1n59 n PRO 43 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1n59 s ARG 44 N 6.31 0.51 0.23 -0.52 1.70 -1.26 -5.06 118.95 120.87 1n59 s ARG 44 Ca 1.01 -0.39 -0.30 0.00 -0.47 0.00 0.00 55.73 55.59 1n59 s ARG 44 Cb -0.37 0.21 -0.09 0.00 -0.57 0.00 0.00 34.95 34.14 1n59 s ARG 44 CO 0.36 -0.13 1.12 -0.47 -1.08 0.00 0.00 175.30 175.11 1n59 s TYR 45 N -1.42 3.54 0.06 5.89 5.04 -1.26 -4.67 117.35 124.52 1n59 s TYR 45 Ca -0.14 1.61 -0.08 0.00 -2.44 0.00 0.00 57.07 56.01 1n59 s TYR 45 Cb -0.07 -3.32 -0.00 0.00 0.35 0.00 0.00 41.96 38.91 1n59 s TYR 45 CO 0.02 -0.73 0.17 -1.83 -1.34 0.00 0.00 175.55 171.84 1n59 s GLU 46 N -0.92 0.74 0.67 4.97 -1.05 -0.86 -4.89 118.70 117.37 1n59 s GLU 46 Ca 0.48 -0.81 -0.13 0.00 -0.15 0.00 0.00 54.97 54.36 1n59 s GLU 46 Cb -0.32 0.30 0.00 0.00 -0.44 0.00 0.00 34.13 33.68 1n59 s GLU 46 CO 0.39 -0.22 1.07 -1.25 0.95 0.00 0.00 175.26 176.20 1n59 s PRO 47 N -3.19 2.91 -0.01 -4.83 0.04 -1.26 -2.08 135.00 126.57 1n59 s PRO 47 Ca -0.00 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.18 1n59 s PRO 47 Cb 0.02 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.61 1n59 s PRO 47 CO -0.07 -1.13 0.93 0.54 0.04 0.00 0.00 177.00 177.30 1n59 n ARG 48 N -2.77 0.19 -3.63 4.56 5.12 0.01 -4.84 116.66 115.30 1n59 n ARG 48 Ca 0.09 -1.08 -0.15 0.00 -1.93 0.00 0.00 57.85 54.78 1n59 n ARG 48 Cb 0.53 -0.61 -0.07 0.00 -1.16 0.00 0.00 32.46 31.15 1n59 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n59 s ALA 49 N -0.29 -1.47 0.09 7.54 0.00 -1.25 -4.51 121.76 121.87 1n59 s ALA 49 Ca 0.03 1.29 -0.35 0.00 0.00 0.00 0.00 51.96 52.93 1n59 s ALA 49 Cb 0.03 -0.40 -0.17 0.00 0.00 0.00 0.00 23.12 22.58 1n59 s ALA 49 CO 0.00 -0.31 1.57 0.00 0.00 0.00 0.00 175.76 177.02 1n59 h ARG 50 N 4.08 -0.96 -0.32 0.00 3.08 -1.96 -2.19 114.38 116.10 1n59 h ARG 50 Ca -0.28 0.07 0.09 0.00 0.07 0.00 0.00 59.98 59.93 1n59 h ARG 50 Cb 1.16 0.22 -0.01 0.00 0.08 0.00 0.00 29.97 31.41 1n59 h ARG 50 CO 0.28 -0.64 0.95 0.11 -1.07 0.00 0.00 179.97 179.60 1n59 h TRP 51 N -0.99 0.00 0.00 3.04 5.08 -1.97 1.18 115.95 122.29 1n59 h TRP 51 Ca -0.06 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.91 1n59 h TRP 51 Cb 0.86 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.02 1n59 h TRP 51 CO -0.23 0.00 0.00 -1.33 -1.28 0.00 0.00 178.44 175.60 1n59 n MET 52 N -2.84 0.89 0.00 0.12 2.81 -0.82 -2.38 117.12 114.89 1n59 n MET 52 Ca 0.07 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.09 1n59 n MET 52 Cb 1.05 -1.50 0.41 0.00 -0.71 0.00 0.00 33.22 32.47 1n59 n MET 52 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1n59 n GLU 53 N -1.04 0.06 0.00 0.03 1.02 0.41 -3.50 120.64 117.62 1n59 n GLU 53 Ca 0.22 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1n59 n GLU 53 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1n59 n GLU 53 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1n59 n GLN 54 N -1.45 0.79 -4.20 3.49 6.02 -1.00 -4.80 117.38 116.23 1n59 n GLN 54 Ca 0.07 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.72 1n59 n GLN 54 Cb 0.33 -1.07 -0.11 0.00 1.02 0.00 0.00 30.24 30.41 1n59 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1n59 s GLU 55 N -1.81 3.83 0.92 -1.09 0.41 -1.23 -5.09 118.70 114.63 1n59 s GLU 55 Ca 0.00 -0.43 -0.12 0.00 -0.41 0.00 0.00 54.97 54.01 1n59 s GLU 55 Cb 0.00 -3.06 0.07 0.00 -1.78 0.00 0.00 34.13 29.36 1n59 s GLU 55 CO 0.00 0.26 0.71 0.41 -0.49 0.00 0.00 175.26 176.15 1n59 n GLY 56 N 3.51 -1.32 0.32 -1.39 0.00 -1.26 -4.84 105.19 100.22 1n59 n GLY 56 Ca -0.17 -0.70 0.18 0.00 0.00 0.00 0.00 46.02 45.33 1n59 n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n59 h PRO 57 N -1.55 0.00 -0.14 1.61 0.11 -1.98 -2.41 132.00 127.63 1n59 h PRO 57 Ca -0.44 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.52 1n59 h PRO 57 Cb 1.28 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.40 1n59 h PRO 57 CO 0.38 0.00 -0.51 1.49 -0.21 0.00 0.00 178.00 179.15 1n59 h GLU 58 N 0.00 0.60 -0.46 1.05 4.81 -2.00 -3.09 114.58 115.49 1n59 h GLU 58 Ca 0.02 -0.45 0.09 0.00 -0.13 0.00 0.00 59.36 58.89 1n59 h GLU 58 Cb 0.16 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.53 1n59 h GLU 58 CO -0.00 1.07 -0.09 -0.92 -0.73 0.00 0.00 179.01 178.35 1n59 h TYR 59 N 0.25 -0.19 0.00 0.92 5.03 -1.77 0.17 116.97 121.38 1n59 h TYR 59 Ca -0.02 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1n59 h TYR 59 Cb 1.13 0.15 0.00 0.00 1.55 0.00 0.00 36.73 39.57 1n59 h TYR 59 CO 0.10 -0.18 0.00 0.91 -1.32 0.00 0.00 178.16 177.68 1n59 n TRP 60 N -5.31 0.12 -0.05 -3.82 7.02 -1.22 -2.16 117.44 112.02 1n59 n TRP 60 Ca 0.04 0.05 -0.19 0.00 -1.02 0.00 0.00 57.50 56.39 1n59 n TRP 60 Cb 0.25 -0.58 -0.13 0.00 -2.42 0.00 0.00 31.31 28.42 1n59 n TRP 60 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1n59 n GLU 61 N -1.61 0.71 0.03 -0.99 4.07 0.50 -3.05 120.64 120.29 1n59 n GLU 61 Ca 0.02 0.21 -0.02 0.00 -0.06 0.00 0.00 57.16 57.31 1n59 n GLU 61 Cb 0.12 -1.65 0.23 0.00 -0.06 0.00 0.00 31.44 30.09 1n59 n GLU 61 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1n59 h ARG 62 N 0.04 0.44 0.06 5.31 3.08 -0.91 -1.22 114.38 121.18 1n59 h ARG 62 Ca -0.47 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.43 1n59 h ARG 62 Cb 2.00 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 32.02 1n59 h ARG 62 CO 0.03 0.64 -0.03 0.93 -1.07 0.00 0.00 179.97 180.47 1n59 h GLU 63 N 0.39 -0.08 -1.03 0.04 4.39 -1.60 -0.49 114.58 116.20 1n59 h GLU 63 Ca 0.06 0.01 0.27 0.00 0.34 0.00 0.00 59.36 60.04 1n59 h GLU 63 Cb 0.61 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.21 1n59 h GLU 63 CO 0.04 0.51 0.69 1.15 -1.16 0.00 0.00 179.01 180.24 1n59 h THR 64 N -0.84 0.53 0.00 1.13 2.02 -1.47 0.20 112.91 114.47 1n59 h THR 64 Ca -0.01 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 1n59 h THR 64 Cb 0.63 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1n59 h THR 64 CO 0.01 0.05 -0.15 1.56 0.37 0.00 0.00 175.52 177.37 1n59 h GLN 65 N 0.29 0.00 0.00 6.66 1.08 -1.15 -2.56 115.11 119.43 1n59 h GLN 65 Ca 0.56 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.76 1n59 h GLN 65 Cb 1.61 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.04 1n59 h GLN 65 CO -0.20 0.39 0.04 0.36 -0.95 0.00 0.00 178.83 178.47 1n59 n LYS 66 N -4.68 0.00 -0.05 1.46 2.85 -0.20 -0.21 118.16 117.34 1n59 n LYS 66 Ca -0.06 0.42 -0.19 0.00 -1.05 0.00 0.00 58.31 57.42 1n59 n LYS 66 Cb 0.23 -1.54 -0.13 0.00 -0.65 0.00 0.00 35.03 32.94 1n59 n LYS 66 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1n59 h ALA 67 N 1.81 0.11 0.00 0.58 0.00 -0.63 -2.77 119.26 118.37 1n59 h ALA 67 Ca 0.00 -0.88 -0.02 0.00 0.00 0.00 0.00 54.91 54.01 1n59 h ALA 67 Cb 0.09 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1n59 h ALA 67 CO 0.00 0.45 -0.12 0.87 0.00 0.00 0.00 179.25 180.46 1n59 h LYS 68 N -0.76 0.00 0.22 0.00 1.57 -0.15 -0.75 116.57 116.70 1n59 h LYS 68 Ca -0.19 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1n59 h LYS 68 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1n59 h LYS 68 CO -0.03 0.12 -0.11 0.78 -0.57 0.00 0.00 179.45 179.64 1n59 h GLY 69 N 0.74 -0.31 0.39 3.86 0.00 -0.97 -2.87 103.07 103.92 1n59 h GLY 69 Ca -0.00 0.11 0.13 0.00 0.00 0.00 0.00 47.33 47.57 1n59 h GLY 69 CO 0.01 -0.11 0.58 3.43 0.00 0.00 0.00 176.54 180.45 1n59 h ASN 70 N -0.70 0.82 -0.56 0.19 2.35 -1.05 -1.28 115.58 115.36 1n59 h ASN 70 Ca -0.03 0.06 0.11 0.00 -0.55 0.00 0.00 56.30 55.89 1n59 h ASN 70 Cb 0.48 -0.10 -0.09 0.00 0.05 0.00 0.00 38.32 38.66 1n59 h ASN 70 CO 0.05 0.41 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.14 1n59 h GLU 71 N 0.88 0.09 -0.50 0.81 4.81 -1.07 0.35 114.58 119.96 1n59 h GLU 71 Ca 0.49 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.67 1n59 h GLU 71 Cb 0.55 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1n59 h GLU 71 CO -0.29 0.06 0.12 1.96 -0.73 0.00 0.00 179.01 180.13 1n59 h GLN 72 N 0.10 0.80 -0.36 1.92 1.08 -1.05 -0.70 115.11 116.89 1n59 h GLN 72 Ca 0.28 -0.19 0.02 0.00 -1.45 0.00 0.00 58.65 57.31 1n59 h GLN 72 Cb 0.44 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.74 1n59 h GLN 72 CO -0.49 0.78 0.19 1.03 -0.95 0.00 0.00 178.83 179.39 1n59 h SER 73 N 0.69 0.28 0.95 1.46 0.87 -0.18 0.19 113.55 117.82 1n59 h SER 73 Ca 0.16 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 1n59 h SER 73 Cb 0.34 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1n59 h SER 73 CO 0.00 0.21 -0.37 -0.26 -0.53 0.00 0.00 176.83 175.88 1n59 h PHE 74 N 0.39 0.00 -0.58 2.24 0.04 -0.33 -0.38 116.94 118.31 1n59 h PHE 74 Ca 0.15 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.83 1n59 h PHE 74 Cb 0.05 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 1n59 h PHE 74 CO -0.09 0.37 0.00 -0.09 -0.60 0.00 0.00 178.31 177.89 1n59 h ARG 75 N 0.00 1.01 -0.24 1.51 2.43 0.55 -0.31 114.38 119.32 1n59 h ARG 75 Ca -0.00 -0.31 -0.19 0.00 -0.81 0.00 0.00 59.98 58.67 1n59 h ARG 75 Cb 0.94 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 1n59 h ARG 75 CO 0.05 0.99 -0.60 0.28 -1.51 0.00 0.00 179.97 179.17 1n59 h VAL 76 N 0.92 1.28 -0.31 0.20 2.07 -0.32 -3.24 116.25 116.86 1n59 h VAL 76 Ca 0.17 -1.79 0.07 0.00 0.82 0.00 0.00 66.70 65.96 1n59 h VAL 76 Cb 0.53 1.77 -0.08 0.00 -1.52 0.00 0.00 31.29 31.99 1n59 h VAL 76 CO 0.03 0.58 -0.29 0.44 0.02 0.00 0.00 177.57 178.35 1n59 h ASP 77 N 0.59 -0.94 -0.89 0.57 3.32 -0.55 -1.16 116.42 117.36 1n59 h ASP 77 Ca -0.01 0.17 0.18 0.00 0.02 0.00 0.00 57.03 57.39 1n59 h ASP 77 Cb 1.22 0.44 -0.11 0.00 0.22 0.00 0.00 39.33 41.10 1n59 h ASP 77 CO 0.13 -0.31 0.45 -0.07 -1.72 0.00 0.00 179.24 177.73 1n59 h LEU 78 N -0.26 0.50 -0.49 1.55 3.38 -1.09 0.12 115.31 119.01 1n59 h LEU 78 Ca 0.15 0.12 -0.17 0.00 0.09 0.00 0.00 57.88 58.07 1n59 h LEU 78 Cb 0.51 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1n59 h LEU 78 CO -0.46 0.14 -0.73 -0.09 0.09 0.00 0.00 178.44 177.40 1n59 h ARG 79 N 0.56 0.21 0.72 1.13 1.12 -1.50 -2.97 114.38 113.66 1n59 h ARG 79 Ca 0.52 -0.18 -0.04 0.00 -1.11 0.00 0.00 59.98 59.18 1n59 h ARG 79 Cb 0.86 0.04 0.01 0.00 -0.01 0.00 0.00 29.97 30.86 1n59 h ARG 79 CO -0.43 0.85 -0.35 1.15 -3.11 0.00 0.00 179.97 178.08 1n59 h THR 80 N 0.14 0.28 0.00 0.20 2.02 0.38 -2.15 112.91 113.78 1n59 h THR 80 Ca -0.02 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1n59 h THR 80 Cb 1.29 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1n59 h THR 80 CO 0.11 0.00 0.05 -0.07 0.37 0.00 0.00 175.52 175.99 1n59 h LEU 81 N -0.99 0.00 -1.05 2.58 4.07 -1.11 0.18 115.31 118.99 1n59 h LEU 81 Ca -0.10 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.76 1n59 h LEU 81 Cb 0.75 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.48 1n59 h LEU 81 CO 0.16 0.00 -0.47 -0.07 -1.08 0.00 0.00 178.44 176.98 1n59 h LEU 82 N 0.00 0.00 0.17 1.67 3.38 -1.21 -2.03 115.31 117.29 1n59 h LEU 82 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 1n59 h LEU 82 Cb 0.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1n59 h LEU 82 CO 0.00 0.47 -1.42 1.23 0.09 0.00 0.00 178.44 178.81 1n59 h GLY 83 N 1.47 0.41 0.74 0.83 0.00 -0.57 -1.23 103.07 104.72 1n59 h GLY 83 Ca -0.00 -1.06 0.03 0.00 0.00 0.00 0.00 47.33 46.30 1n59 h GLY 83 CO 0.06 0.92 -0.00 -0.97 0.00 0.00 0.00 176.54 176.56 1n59 h TYR 84 N 0.10 -0.01 -0.51 5.60 0.05 -1.27 -2.83 116.97 118.11 1n59 h TYR 84 Ca -0.21 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.58 1n59 h TYR 84 Cb 2.06 0.03 0.00 0.00 1.01 0.00 0.00 36.73 39.83 1n59 h TYR 84 CO 0.09 -0.02 0.00 0.66 -1.05 0.00 0.00 178.16 177.83 1n59 n TYR 85 N -5.13 1.00 -4.10 4.88 4.01 -0.78 -4.92 117.16 112.13 1n59 n TYR 85 Ca -0.03 -0.42 -0.30 0.00 -0.16 0.00 0.00 57.90 56.98 1n59 n TYR 85 Cb 0.10 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 38.96 1n59 n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1n59 n ASN 86 N 0.89 -1.43 -4.90 7.72 5.03 -1.02 -4.91 115.26 116.63 1n59 n ASN 86 Ca 0.19 -1.03 -0.29 0.00 0.87 0.00 0.00 54.58 54.32 1n59 n ASN 86 Cb 0.63 -2.80 -0.03 0.00 -1.02 0.00 0.00 39.78 36.55 1n59 n ASN 86 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1n59 s GLN 87 N -6.79 3.63 0.36 3.52 -0.21 -0.49 -5.05 119.66 114.63 1n59 s GLN 87 Ca 0.31 -0.02 -0.27 0.00 0.02 0.00 0.00 55.36 55.39 1n59 s GLN 87 Cb -0.17 -2.68 -0.10 0.00 1.00 0.00 0.00 33.01 31.07 1n59 s GLN 87 CO 0.91 0.25 1.28 0.45 -2.12 0.00 0.00 175.29 176.07 1n59 s SER 88 N -3.08 6.60 0.00 5.90 0.15 -1.26 -4.83 113.70 117.18 1n59 s SER 88 Ca 0.43 2.63 0.16 0.00 0.70 0.00 0.00 55.95 59.87 1n59 s SER 88 Cb -0.11 -2.64 0.88 0.00 -1.71 0.00 0.00 66.02 62.44 1n59 s SER 88 CO 0.29 -0.65 1.41 0.29 1.20 0.00 0.00 173.24 175.79 1n59 n LYS 89 N 0.50 0.36 0.01 5.44 4.76 -1.26 -3.24 118.16 124.73 1n59 n LYS 89 Ca 0.02 0.07 -0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1n59 n LYS 89 Cb 0.43 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 32.02 1n59 n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n59 n GLY 90 N 0.03 -1.16 3.81 0.72 0.00 -1.26 -4.93 105.19 102.41 1n59 n GLY 90 Ca 0.10 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1n59 n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n59 s GLY 91 N -4.85 2.41 -0.03 -0.02 0.00 -1.20 -4.68 107.32 98.95 1n59 s GLY 91 Ca -0.04 0.48 -0.22 0.00 0.00 0.00 0.00 44.72 44.93 1n59 s GLY 91 CO 0.82 0.77 0.66 -0.45 0.00 0.00 0.00 173.10 174.90 1n59 s SER 92 N -2.17 7.00 0.12 1.64 0.15 -1.26 -4.79 113.70 114.39 1n59 s SER 92 Ca 0.64 1.19 0.04 0.00 0.70 0.00 0.00 55.95 58.52 1n59 s SER 92 Cb -0.12 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.75 1n59 s SER 92 CO 0.18 -0.02 -0.10 -1.00 1.20 0.00 0.00 173.24 173.51 1n59 s HIS 93 N 0.33 1.14 0.09 3.44 4.02 -1.25 -4.97 115.29 118.09 1n59 s HIS 93 Ca 0.35 -0.75 0.09 0.00 1.02 0.00 0.00 55.06 55.76 1n59 s HIS 93 Cb -0.18 -0.60 -0.03 0.00 -1.02 0.00 0.00 32.58 30.74 1n59 s HIS 93 CO 0.18 0.02 -0.23 0.99 1.02 0.00 0.00 174.74 176.72 1n59 s THR 94 N -3.10 1.91 -0.11 1.30 2.01 -1.26 -1.94 115.64 114.45 1n59 s THR 94 Ca 0.12 -1.53 0.00 0.00 0.31 0.00 0.00 61.69 60.60 1n59 s THR 94 Cb 0.01 -1.70 0.02 0.00 0.01 0.00 0.00 72.50 70.85 1n59 s THR 94 CO -0.01 0.08 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.27 1n59 s ILE 95 N -1.03 1.18 0.14 1.82 1.01 -0.47 0.75 121.20 124.60 1n59 s ILE 95 Ca 0.09 -0.41 0.09 0.00 0.00 0.00 0.00 60.65 60.42 1n59 s ILE 95 Cb -0.10 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 1n59 s ILE 95 CO 0.04 0.39 -0.13 -1.10 0.00 0.00 0.00 174.94 174.14 1n59 s GLN 96 N 1.43 1.97 -0.04 2.79 -0.21 -1.21 -1.19 119.66 123.21 1n59 s GLN 96 Ca 0.01 -1.19 -0.18 0.00 0.02 0.00 0.00 55.36 54.02 1n59 s GLN 96 Cb -0.13 -2.17 0.03 0.00 1.00 0.00 0.00 33.01 31.74 1n59 s GLN 96 CO -0.06 0.47 0.39 0.08 -2.12 0.00 0.00 175.29 174.04 1n59 s VAL 97 N -1.41 0.04 -0.09 1.09 1.01 -0.73 -1.00 120.40 119.32 1n59 s VAL 97 Ca 0.22 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 1n59 s VAL 97 Cb -0.10 -0.68 0.04 0.00 0.00 0.00 0.00 36.38 35.64 1n59 s VAL 97 CO 0.13 -0.18 0.04 -0.51 0.00 0.00 0.00 175.10 174.58 1n59 s ILE 98 N -1.10 0.10 0.17 2.22 2.07 -0.82 -2.06 121.20 121.79 1n59 s ILE 98 Ca -0.11 0.14 0.07 0.00 -1.41 0.00 0.00 60.65 59.34 1n59 s ILE 98 Cb -0.04 -0.42 -0.04 0.00 0.13 0.00 0.00 42.46 42.08 1n59 s ILE 98 CO 0.05 0.09 -0.15 -0.94 -1.91 0.00 0.00 174.94 172.08 1n59 s SER 99 N 2.07 2.35 0.00 4.50 1.04 -1.16 -1.18 113.70 121.32 1n59 s SER 99 Ca 0.04 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.54 1n59 s SER 99 Cb -0.13 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.88 1n59 s SER 99 CO -0.05 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1n59 n GLY 100 N 0.01 -1.30 3.25 7.32 0.00 -0.27 -0.76 105.19 113.44 1n59 n GLY 100 Ca -0.11 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 1n59 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n59 s GLU 102 N -0.82 2.58 0.28 0.00 2.02 0.68 -1.69 118.70 121.75 1n59 s GLU 102 Ca -0.09 -1.25 -0.00 0.00 0.02 0.00 0.00 54.97 53.65 1n59 s GLU 102 Cb -0.04 -2.35 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 1n59 s GLU 102 CO 0.03 0.38 0.30 0.14 0.02 0.00 0.00 175.26 176.14 1n59 s VAL 103 N -2.23 0.00 0.35 2.63 -7.23 0.26 -1.61 120.40 112.57 1n59 s VAL 103 Ca 0.32 -1.83 0.05 0.00 -1.81 0.00 0.00 61.98 58.72 1n59 s VAL 103 Cb -0.07 -2.50 0.05 0.00 0.56 0.00 0.00 36.38 34.43 1n59 s VAL 103 CO 0.22 0.00 0.45 0.61 -0.31 0.00 0.00 175.10 176.08 1n59 n GLY 104 N -0.46 2.05 0.23 2.32 0.00 -0.95 -2.13 105.19 106.26 1n59 n GLY 104 Ca 0.03 -2.19 0.14 0.00 0.00 0.00 0.00 46.02 43.99 1n59 n GLY 104 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n59 h SER 105 N 0.09 0.00 0.39 1.61 4.64 -1.91 -2.61 113.55 115.77 1n59 h SER 105 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1n59 h SER 105 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1n59 h SER 105 CO 0.24 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.30 1n59 n ASP 106 N -3.04 0.00 0.00 4.97 5.75 -1.26 -4.83 116.55 118.14 1n59 n ASP 106 Ca 0.03 -0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1n59 n ASP 106 Cb 0.44 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 1n59 n ASP 106 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n59 n GLY 107 N 0.50 0.92 3.91 6.12 0.00 -0.98 -5.04 105.19 110.61 1n59 n GLY 107 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1n59 n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n59 s ARG 108 N -0.40 1.94 0.27 1.61 0.52 -1.26 -4.82 118.95 116.81 1n59 s ARG 108 Ca 0.00 0.03 -0.29 0.00 -0.52 0.00 0.00 55.73 54.95 1n59 s ARG 108 Cb 0.00 -1.98 -0.09 0.00 0.52 0.00 0.00 34.95 33.40 1n59 s ARG 108 CO 0.00 -1.58 0.99 -1.17 0.02 0.00 0.00 175.30 173.56 1n59 s LEU 109 N -5.54 4.56 -0.06 2.53 2.96 -1.26 -2.23 118.68 119.64 1n59 s LEU 109 Ca 0.62 2.02 -0.02 0.00 -0.22 0.00 0.00 54.13 56.54 1n59 s LEU 109 Cb -0.11 -3.70 -0.03 0.00 0.50 0.00 0.00 46.19 42.86 1n59 s LEU 109 CO 0.49 0.02 -0.06 -0.11 -1.32 0.00 0.00 176.35 175.36 1n59 n LEU 110 N 1.21 1.48 -3.68 -0.68 7.94 -0.63 -4.74 117.00 117.90 1n59 n LEU 110 Ca -0.01 0.03 -0.15 0.00 -1.11 0.00 0.00 56.01 54.77 1n59 n LEU 110 Cb 0.47 -0.18 -0.08 0.00 0.53 0.00 0.00 43.42 44.16 1n59 n LEU 110 CO 0.50 0.32 0.16 -0.60 -1.11 0.00 0.00 177.39 176.66 1n59 s ARG 111 N -2.11 0.79 0.03 1.96 3.52 -1.11 -4.97 118.95 117.06 1n59 s ARG 111 Ca -0.08 -0.02 0.03 0.00 -0.13 0.00 0.00 55.73 55.53 1n59 s ARG 111 Cb 0.03 0.36 -0.02 0.00 -1.56 0.00 0.00 34.95 33.76 1n59 s ARG 111 CO 0.11 -0.23 -0.09 0.20 -0.81 0.00 0.00 175.30 174.48 1n59 s GLY 112 N -1.24 0.54 0.07 8.12 0.00 -1.26 -0.23 107.32 113.32 1n59 s GLY 112 Ca -0.12 -0.69 -0.21 0.00 0.00 0.00 0.00 44.72 43.70 1n59 s GLY 112 CO 0.06 -0.70 0.51 -2.52 0.00 0.00 0.00 173.10 170.45 1n59 s TYR 113 N -1.01 -0.40 -0.30 1.90 -0.85 -0.57 -4.89 117.35 111.23 1n59 s TYR 113 Ca -0.05 0.38 -0.13 0.00 -0.52 0.00 0.00 57.07 56.75 1n59 s TYR 113 Cb -0.08 0.35 0.15 0.00 0.38 0.00 0.00 41.96 42.76 1n59 s TYR 113 CO 0.01 -0.67 0.85 -1.14 -1.52 0.00 0.00 175.55 173.07 1n59 s GLN 114 N -2.75 0.41 -0.02 -3.49 0.74 -1.24 -1.12 119.66 112.19 1n59 s GLN 114 Ca -0.04 1.03 -0.02 0.00 0.05 0.00 0.00 55.36 56.38 1n59 s GLN 114 Cb -0.00 0.62 0.01 0.00 1.10 0.00 0.00 33.01 34.73 1n59 s GLN 114 CO -0.04 -0.15 0.06 1.14 -0.55 0.00 0.00 175.29 175.75 1n59 s GLN 115 N 2.64 0.06 0.26 1.67 -2.07 -0.32 -1.93 119.66 119.97 1n59 s GLN 115 Ca -0.04 0.10 0.05 0.00 -1.82 0.00 0.00 55.36 53.66 1n59 s GLN 115 Cb -0.09 -0.01 -0.03 0.00 -1.09 0.00 0.00 33.01 31.80 1n59 s GLN 115 CO -0.18 -0.03 0.39 0.71 -1.32 0.00 0.00 175.29 174.86 1n59 s TYR 116 N 0.19 3.39 0.27 9.60 1.51 0.24 -1.94 117.35 130.61 1n59 s TYR 116 Ca -0.01 -0.04 0.02 0.00 -1.01 0.00 0.00 57.07 56.02 1n59 s TYR 116 Cb -0.02 -1.66 -0.03 0.00 -0.11 0.00 0.00 41.96 40.14 1n59 s TYR 116 CO -0.01 0.35 0.24 0.00 -1.11 0.00 0.00 175.55 175.02 1n59 s ALA 117 N -2.03 1.35 -0.29 3.71 0.00 -0.17 -2.19 121.76 122.14 1n59 s ALA 117 Ca 0.36 -1.80 -0.08 0.00 0.00 0.00 0.00 51.96 50.45 1n59 s ALA 117 Cb -0.09 1.39 0.14 0.00 0.00 0.00 0.00 23.12 24.56 1n59 s ALA 117 CO 0.30 -0.65 0.61 -0.47 0.00 0.00 0.00 175.76 175.55 1n59 s TYR 118 N -3.77 -1.34 -1.20 0.00 5.04 0.02 -3.34 117.35 112.75 1n59 s TYR 118 Ca 0.38 2.09 -0.16 0.00 -2.44 0.00 0.00 57.07 56.94 1n59 s TYR 118 Cb 0.04 0.69 -0.01 0.00 0.35 0.00 0.00 41.96 43.04 1n59 s TYR 118 CO 0.19 -0.70 0.72 -0.25 -1.34 0.00 0.00 175.55 174.17 1n59 n ASP 119 N 5.44 -4.10 0.00 4.32 8.00 0.23 -2.32 116.55 128.12 1n59 n ASP 119 Ca -0.09 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1n59 n ASP 119 Cb 0.50 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.27 1n59 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n59 n GLY 120 N -1.74 1.06 3.63 0.44 0.00 -1.26 -4.96 105.19 102.36 1n59 n GLY 120 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 1n59 n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n59 n ASP 122 N 0.21 1.32 0.02 0.00 9.92 -1.26 -0.80 116.55 125.96 1n59 n ASP 122 Ca -0.11 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.31 1n59 n ASP 122 Cb 0.54 -1.25 0.00 0.00 -0.64 0.00 0.00 41.12 39.77 1n59 n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1n59 n TYR 123 N 0.89 -0.06 -3.72 1.24 9.36 -0.93 -4.69 117.16 119.25 1n59 n TYR 123 Ca 0.12 0.01 -0.13 0.00 3.32 0.00 0.00 57.90 61.23 1n59 n TYR 123 Cb 0.28 0.03 -0.07 0.00 -0.63 0.00 0.00 39.34 38.95 1n59 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1n59 s ILE 124 N -1.45 0.06 -0.08 2.97 2.07 -1.17 -0.23 121.20 123.38 1n59 s ILE 124 Ca 0.00 -0.53 -0.21 0.00 -1.41 0.00 0.00 60.65 58.50 1n59 s ILE 124 Cb 0.00 -0.85 0.05 0.00 0.13 0.00 0.00 42.46 41.79 1n59 s ILE 124 CO 0.00 -0.29 0.50 0.00 -1.91 0.00 0.00 174.94 173.24 1n59 s ALA 125 N -2.10 -1.27 -0.25 1.50 0.00 -1.03 0.83 121.76 119.44 1n59 s ALA 125 Ca -0.08 1.01 -0.25 0.00 0.00 0.00 0.00 51.96 52.64 1n59 s ALA 125 Cb -0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 1n59 s ALA 125 CO -0.00 -0.29 0.87 -1.17 0.00 0.00 0.00 175.76 175.16 1n59 s LEU 126 N -0.80 4.08 1.07 0.00 2.96 -0.81 -1.29 118.68 123.88 1n59 s LEU 126 Ca -0.09 1.07 -0.13 0.00 -0.22 0.00 0.00 54.13 54.76 1n59 s LEU 126 Cb -0.03 -3.25 0.18 0.00 0.50 0.00 0.00 46.19 43.60 1n59 s LEU 126 CO 0.05 -0.56 0.79 0.59 -1.32 0.00 0.00 176.35 175.91 1n59 n ASN 127 N 6.09 -1.33 0.00 3.68 3.02 -0.36 -4.69 115.26 121.67 1n59 n ASN 127 Ca 0.07 0.07 0.11 0.00 -0.03 0.00 0.00 54.58 54.80 1n59 n ASN 127 Cb 0.47 -1.26 0.52 0.00 -0.61 0.00 0.00 39.78 38.90 1n59 n ASN 127 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1n59 n GLU 128 N -3.82 0.17 0.06 3.52 4.07 -1.26 -1.96 120.64 121.41 1n59 n GLU 128 Ca 0.06 0.10 0.11 0.00 -0.06 0.00 0.00 57.16 57.37 1n59 n GLU 128 Cb 0.55 -1.50 0.46 0.00 -0.06 0.00 0.00 31.44 30.88 1n59 n GLU 128 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1n59 n ASP 129 N -1.39 0.34 -1.58 4.31 5.68 -1.26 -4.87 116.55 117.78 1n59 n ASP 129 Ca 0.08 0.56 -0.17 0.00 -0.50 0.00 0.00 54.79 54.76 1n59 n ASP 129 Cb 0.22 -0.64 -0.04 0.00 -1.14 0.00 0.00 41.12 39.51 1n59 n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1n59 n LEU 130 N -1.85 -1.48 0.00 -2.12 4.77 -0.83 -4.81 117.00 110.68 1n59 n LEU 130 Ca 0.05 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1n59 n LEU 130 Cb 0.29 -2.44 0.00 0.00 -2.33 0.00 0.00 43.42 38.94 1n59 n LEU 130 CO 0.22 -0.56 -0.32 0.29 -1.33 0.00 0.00 177.39 175.70 1n59 n LYS 131 N -2.56 1.03 -4.09 3.23 5.02 -1.26 -4.64 118.16 114.88 1n59 n LYS 131 Ca -0.18 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 55.87 1n59 n LYS 131 Cb 0.60 -0.82 -0.07 0.00 -0.02 0.00 0.00 35.03 34.72 1n59 n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1n59 s THR 132 N -1.64 2.75 0.12 -0.18 -4.23 -1.26 -4.84 115.64 106.36 1n59 s THR 132 Ca 0.00 -1.69 0.09 0.00 -1.18 0.00 0.00 61.69 58.91 1n59 s THR 132 Cb 0.00 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.83 1n59 s THR 132 CO 0.00 -0.12 -0.20 0.26 -0.54 0.00 0.00 174.62 174.02 1n59 s TRP 133 N -2.49 2.49 -0.28 3.99 0.52 -1.26 -1.23 118.94 120.68 1n59 s TRP 133 Ca 0.39 -0.29 0.03 0.00 0.02 0.00 0.00 56.10 56.25 1n59 s TRP 133 Cb -0.00 -1.33 0.07 0.00 -1.15 0.00 0.00 33.47 31.05 1n59 s TRP 133 CO 0.23 0.37 -0.08 0.99 0.02 0.00 0.00 176.95 178.48 1n59 s THR 134 N -1.11 2.25 0.02 2.01 2.01 -0.41 -4.88 115.64 115.52 1n59 s THR 134 Ca 0.17 -1.73 -0.17 0.00 0.31 0.00 0.00 61.69 60.27 1n59 s THR 134 Cb -0.10 -2.38 -0.06 0.00 0.01 0.00 0.00 72.50 69.97 1n59 s THR 134 CO 0.09 -0.12 0.48 0.00 -0.69 0.00 0.00 174.62 174.38 1n59 s ALA 135 N 1.08 3.63 0.00 7.40 0.00 -1.26 -2.47 121.76 130.14 1n59 s ALA 135 Ca -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.80 1n59 s ALA 135 Cb -0.20 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1n59 s ALA 135 CO -0.05 0.40 0.39 0.00 0.00 0.00 0.00 175.76 176.50 1n59 n ALA 136 N 1.96 -0.15 -2.29 0.00 0.00 0.69 -4.92 120.51 115.79 1n59 n ALA 136 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 1n59 n ALA 136 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1n59 n ALA 136 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1n59 s ASP 137 N -2.16 4.84 0.23 0.00 1.47 -1.26 -5.01 116.67 114.78 1n59 s ASP 137 Ca 0.00 -0.95 0.19 0.00 1.18 0.00 0.00 52.55 52.97 1n59 s ASP 137 Cb 0.00 -0.23 0.91 0.00 -0.34 0.00 0.00 42.92 43.25 1n59 s ASP 137 CO 0.00 -0.80 1.58 0.23 0.68 0.00 0.00 175.17 176.86 1n59 n MET 138 N -1.60 0.13 0.01 2.11 2.81 -1.26 -1.66 117.12 117.66 1n59 n MET 138 Ca 0.02 0.51 -0.13 0.00 -1.81 0.00 0.00 57.70 56.29 1n59 n MET 138 Cb 0.63 -1.83 -0.10 0.00 -0.71 0.00 0.00 33.22 31.21 1n59 n MET 138 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1n59 h ALA 139 N 2.14 -0.07 0.00 3.04 0.00 -1.95 -2.61 119.26 119.81 1n59 h ALA 139 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1n59 h ALA 139 Cb 0.15 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1n59 h ALA 139 CO 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1n59 h ALA 140 N 0.30 1.00 0.00 0.00 0.00 -1.59 -1.61 119.26 117.36 1n59 h ALA 140 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1n59 h ALA 140 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1n59 h ALA 140 CO 0.01 0.00 -0.29 1.25 0.00 0.00 0.00 179.25 180.22 1n59 h LEU 141 N 0.00 0.00 0.02 0.00 5.85 -0.93 -2.25 115.31 117.99 1n59 h LEU 141 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1n59 h LEU 141 Cb 0.16 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.20 1n59 h LEU 141 CO 0.00 0.29 -0.30 0.40 -0.34 0.00 0.00 178.44 178.49 1n59 h ILE 142 N 0.00 1.57 -0.49 4.05 2.04 -1.30 -3.11 117.51 120.26 1n59 h ILE 142 Ca -0.00 -2.08 0.07 0.00 1.00 0.00 0.00 64.86 63.85 1n59 h ILE 142 Cb 0.68 2.90 -0.03 0.00 -0.74 0.00 0.00 36.82 39.63 1n59 h ILE 142 CO 0.04 0.57 0.33 0.74 0.00 0.00 0.00 178.15 179.83 1n59 h THR 143 N -0.53 0.94 -0.51 -0.27 2.02 -1.62 0.64 112.91 113.58 1n59 h THR 143 Ca -0.04 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.04 1n59 h THR 143 Cb 1.10 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.01 1n59 h THR 143 CO 0.06 0.07 0.29 0.50 0.37 0.00 0.00 175.52 176.80 1n59 h LYS 144 N 0.37 0.55 -0.01 6.66 3.64 -1.34 -2.35 116.57 124.09 1n59 h LYS 144 Ca 0.22 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.39 1n59 h LYS 144 Cb 0.40 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1n59 h LYS 144 CO -0.05 0.37 -0.80 0.45 -2.27 0.00 0.00 179.45 177.14 1n59 h HIS 145 N 0.57 0.20 -0.50 1.91 3.86 -0.86 -1.97 115.15 118.36 1n59 h HIS 145 Ca 0.21 -0.10 0.05 0.00 -1.16 0.00 0.00 60.37 59.37 1n59 h HIS 145 Cb 0.06 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 28.46 1n59 h HIS 145 CO -0.08 0.88 0.24 0.87 0.86 0.00 0.00 177.93 180.70 1n59 h LYS 146 N 0.08 0.46 -0.13 2.45 1.57 -1.00 -1.10 116.57 118.90 1n59 h LYS 146 Ca -0.03 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.53 1n59 h LYS 146 Cb 1.40 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1n59 h LYS 146 CO 0.12 0.30 -0.71 -1.49 -0.57 0.00 0.00 179.45 177.10 1n59 h TRP 147 N 0.47 0.78 -0.58 -1.35 6.55 -1.34 -1.08 115.95 119.40 1n59 h TRP 147 Ca 0.23 -0.33 -0.02 0.00 0.95 0.00 0.00 58.89 59.72 1n59 h TRP 147 Cb 0.15 -0.13 -0.03 0.00 -0.86 0.00 0.00 29.16 28.30 1n59 h TRP 147 CO -0.11 1.12 0.30 0.93 -1.05 0.00 0.00 178.44 179.62 1n59 h GLU 148 N 0.41 0.82 0.00 0.49 5.08 -1.11 0.24 114.58 120.51 1n59 h GLU 148 Ca -0.03 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1n59 h GLU 148 Cb 1.30 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1n59 h GLU 148 CO 0.13 0.65 -0.18 1.96 -1.00 0.00 0.00 179.01 180.58 1n59 h GLN 149 N 0.79 0.00 -0.57 2.33 1.08 -1.07 -2.82 115.11 114.85 1n59 h GLN 149 Ca 0.20 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.40 1n59 h GLN 149 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1n59 h GLN 149 CO -0.03 0.18 0.00 0.00 -0.95 0.00 0.00 178.83 178.03 1n59 n ALA 150 N -2.20 2.34 -2.23 3.87 0.00 -0.42 -4.95 120.51 116.91 1n59 n ALA 150 Ca 0.00 -1.27 -0.18 0.00 0.00 0.00 0.00 53.44 51.99 1n59 n ALA 150 Cb 0.40 -0.73 -0.02 0.00 0.00 0.00 0.00 19.45 19.10 1n59 n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n59 n GLY 151 N 1.13 -0.05 0.32 0.00 0.00 0.32 -4.83 105.19 102.07 1n59 n GLY 151 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1n59 n GLY 151 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1n59 h GLU 152 N 0.00 0.08 -0.39 1.61 4.57 -0.94 -2.04 114.58 117.47 1n59 h GLU 152 Ca -0.41 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 1n59 h GLU 152 Cb 1.28 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 1n59 h GLU 152 CO 0.50 0.06 0.08 0.00 -1.18 0.00 0.00 179.01 178.47 1n59 h ALA 153 N 1.85 0.52 0.00 2.92 0.00 -1.88 -0.93 119.26 121.74 1n59 h ALA 153 Ca 0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1n59 h ALA 153 Cb 0.42 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1n59 h ALA 153 CO -0.01 0.21 -0.06 1.05 0.00 0.00 0.00 179.25 180.43 1n59 h GLU 154 N 0.49 0.00 -0.28 0.00 4.11 -1.68 -0.91 114.58 116.31 1n59 h GLU 154 Ca 0.12 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.38 1n59 h GLU 154 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1n59 h GLU 154 CO 0.00 0.06 -0.50 -0.09 0.07 0.00 0.00 179.01 178.56 1n59 h ARG 155 N 0.00 0.77 -0.02 1.06 1.12 -0.81 -2.62 114.38 113.89 1n59 h ARG 155 Ca -0.00 -0.46 -0.18 0.00 -1.11 0.00 0.00 59.98 58.23 1n59 h ARG 155 Cb 0.81 0.04 0.01 0.00 -0.01 0.00 0.00 29.97 30.83 1n59 h ARG 155 CO 0.01 1.09 -0.70 1.25 -3.11 0.00 0.00 179.97 178.51 1n59 h LEU 156 N 0.61 0.65 -0.36 3.80 6.46 -0.84 -3.14 115.31 122.48 1n59 h LEU 156 Ca 0.03 -0.74 0.07 0.00 -0.12 0.00 0.00 57.88 57.12 1n59 h LEU 156 Cb 1.08 -0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.74 1n59 h LEU 156 CO 0.11 1.30 -0.08 -0.09 -0.62 0.00 0.00 178.44 179.05 1n59 h ARG 157 N 0.06 0.01 -0.84 1.25 2.43 -1.14 0.48 114.38 116.64 1n59 h ARG 157 Ca -0.08 -0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.24 1n59 h ARG 157 Cb 1.39 -0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.84 1n59 h ARG 157 CO 0.14 0.01 0.42 0.00 -1.51 0.00 0.00 179.97 179.03 1n59 h ALA 158 N 1.35 1.26 -0.12 2.80 0.00 -1.54 0.32 119.26 123.34 1n59 h ALA 158 Ca 0.17 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1n59 h ALA 158 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1n59 h ALA 158 CO -0.36 -0.11 0.05 -0.92 0.00 0.00 0.00 179.25 177.91 1n59 h TYR 159 N 0.59 0.18 0.36 0.00 3.20 -0.32 0.11 116.97 121.09 1n59 h TYR 159 Ca 0.46 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.30 1n59 h TYR 159 Cb 0.67 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.89 1n59 h TYR 159 CO -0.10 0.27 -0.17 -0.07 -1.64 0.00 0.00 178.16 176.44 1n59 h LEU 160 N 0.04 -0.41 -1.73 2.82 3.38 0.11 0.30 115.31 119.81 1n59 h LEU 160 Ca 0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1n59 h LEU 160 Cb 0.16 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1n59 h LEU 160 CO -0.00 -0.19 -0.09 -0.33 0.09 0.00 0.00 178.44 177.92 1n59 h GLU 161 N -0.62 0.00 0.00 1.13 5.08 -0.45 -3.02 114.58 116.70 1n59 h GLU 161 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1n59 h GLU 161 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1n59 h GLU 161 CO 0.08 0.09 0.00 0.41 -1.00 0.00 0.00 179.01 178.59 1n59 n GLY 162 N -0.31 0.14 0.42 -3.84 0.00 0.37 -4.62 105.19 97.35 1n59 n GLY 162 Ca -0.01 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.23 1n59 n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1n59 h THR 163 N 0.00 0.59 0.32 2.61 2.02 -1.63 -1.46 112.91 115.36 1n59 h THR 163 Ca 0.00 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1n59 h THR 163 Cb 0.00 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1n59 h THR 163 CO 0.00 0.07 -0.15 0.00 0.37 0.00 0.00 175.52 175.80 1n59 h VAL 165 N -0.96 0.79 0.08 0.00 -1.51 -1.36 -2.14 116.25 111.15 1n59 h VAL 165 Ca -0.04 -0.44 -0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1n59 h VAL 165 Cb 0.50 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1n59 h VAL 165 CO 0.07 0.11 -0.04 -0.33 -1.23 0.00 0.00 177.57 176.15 1n59 h GLU 166 N 0.00 -0.11 0.00 5.19 5.08 -1.30 -3.05 114.58 120.38 1n59 h GLU 166 Ca -0.00 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1n59 h GLU 166 Cb 0.25 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1n59 h GLU 166 CO 0.01 0.43 -0.11 -1.49 -1.00 0.00 0.00 179.01 176.85 1n59 h TRP 167 N -0.87 0.00 -0.22 4.33 4.06 -1.43 -1.55 115.95 120.27 1n59 h TRP 167 Ca -0.01 0.00 0.05 0.00 2.06 0.00 0.00 58.89 60.99 1n59 h TRP 167 Cb 0.59 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.70 1n59 h TRP 167 CO 0.13 0.11 -0.08 1.25 -3.56 0.00 0.00 178.44 176.29 1n59 h LEU 168 N 0.00 -0.28 -0.35 -4.49 5.85 -1.41 0.31 115.31 114.94 1n59 h LEU 168 Ca -0.00 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1n59 h LEU 168 Cb 0.20 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1n59 h LEU 168 CO 0.01 -0.10 0.21 0.03 -0.34 0.00 0.00 178.44 178.25 1n59 h ARG 169 N -0.04 0.48 0.03 1.25 3.08 -1.20 0.61 114.38 118.59 1n59 h ARG 169 Ca 0.11 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1n59 h ARG 169 Cb 0.21 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.11 1n59 h ARG 169 CO -0.25 0.37 -0.49 -0.09 -1.07 0.00 0.00 179.97 178.44 1n59 h ARG 170 N 0.45 -0.61 -0.48 0.04 2.43 -0.60 -1.14 114.38 114.48 1n59 h ARG 170 Ca 0.12 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.43 1n59 h ARG 170 Cb 0.02 0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 29.62 1n59 h ARG 170 CO -0.02 -0.41 -0.08 1.88 -1.51 0.00 0.00 179.97 179.83 1n59 h TYR 171 N -0.63 -0.19 0.00 2.20 0.05 -0.15 0.38 116.97 118.64 1n59 h TYR 171 Ca 0.01 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.83 1n59 h TYR 171 Cb 0.67 0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.56 1n59 h TYR 171 CO -0.49 -0.18 0.01 1.28 -1.05 0.00 0.00 178.16 177.73 1n59 n LEU 172 N -5.31 0.01 -0.10 3.88 4.77 0.18 -1.95 117.00 118.48 1n59 n LEU 172 Ca 0.04 0.49 -0.16 0.00 -0.03 0.00 0.00 56.01 56.35 1n59 n LEU 172 Cb 0.26 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.77 1n59 n LEU 172 CO 0.13 -0.50 -1.16 1.17 -1.33 0.00 0.00 177.39 175.70 1n59 n LYS 173 N -1.50 0.47 -0.23 3.23 4.81 0.11 -3.28 118.16 121.76 1n59 n LYS 173 Ca -0.00 0.14 0.03 0.00 -0.87 0.00 0.00 58.31 57.61 1n59 n LYS 173 Cb 0.01 -1.33 0.15 0.00 0.02 0.00 0.00 35.03 33.88 1n59 n LYS 173 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1n59 h ASN 174 N -0.26 0.21 -1.28 3.14 4.21 -0.28 -3.08 115.58 118.24 1n59 h ASN 174 Ca -0.46 0.10 -0.51 0.00 1.21 0.00 0.00 56.30 56.64 1n59 h ASN 174 Cb 1.60 0.09 -0.41 0.00 -1.12 0.00 0.00 38.32 38.47 1n59 h ASN 174 CO -0.15 0.10 -0.88 0.61 -1.29 0.00 0.00 177.43 175.81 1n59 n GLY 175 N -1.32 4.61 0.22 2.83 0.00 -0.82 -4.82 105.19 105.90 1n59 n GLY 175 Ca 0.12 -2.28 0.02 0.00 0.00 0.00 0.00 46.02 43.87 1n59 n GLY 175 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1n59 h ASN 176 N 2.67 0.16 0.18 1.61 -1.07 -1.52 0.31 115.58 117.92 1n59 h ASN 176 Ca 0.18 -0.04 0.00 0.00 0.07 0.00 0.00 56.30 56.51 1n59 h ASN 176 Cb 1.05 -0.04 0.00 0.00 -2.07 0.00 0.00 38.32 37.26 1n59 h ASN 176 CO 0.72 0.38 0.00 0.00 0.07 0.00 0.00 177.43 178.60 1n59 h ALA 177 N 1.64 1.00 0.00 4.14 0.00 -1.87 0.28 119.26 124.44 1n59 h ALA 177 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 1n59 h ALA 177 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1n59 h ALA 177 CO 0.03 0.00 -1.68 2.41 0.00 0.00 0.00 179.25 180.02 1n59 n THR 178 N -2.33 0.68 0.02 0.00 -1.04 -0.65 -4.54 114.28 106.43 1n59 n THR 178 Ca -0.01 -0.33 0.01 0.00 -2.04 0.00 0.00 64.05 61.68 1n59 n THR 178 Cb 0.09 -0.85 -0.09 0.00 -1.82 0.00 0.00 70.33 67.66 1n59 n THR 178 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1n59 n LEU 179 N -2.63 0.76 -1.68 -4.42 4.77 0.01 -4.08 117.00 109.72 1n59 n LEU 179 Ca -0.19 0.33 0.06 0.00 -0.03 0.00 0.00 56.01 56.18 1n59 n LEU 179 Cb 0.77 0.09 0.36 0.00 -2.33 0.00 0.00 43.42 42.31 1n59 n LEU 179 CO 0.16 0.14 0.86 0.18 -1.33 0.00 0.00 177.39 177.40 1n59 n LEU 180 N -2.83 5.38 -4.91 2.23 4.77 0.95 -4.96 117.00 117.63 1n59 n LEU 180 Ca -0.10 -3.01 -0.28 0.00 -0.03 0.00 0.00 56.01 52.59 1n59 n LEU 180 Cb 0.83 -0.66 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1n59 n LEU 180 CO 0.43 0.67 0.16 0.00 -1.33 0.00 0.00 177.39 177.32 1n59 s ARG 181 N -2.83 3.59 -0.21 3.23 1.70 -1.26 -4.99 118.95 118.18 1n59 s ARG 181 Ca 0.52 -0.11 -0.01 0.00 -0.47 0.00 0.00 55.73 55.66 1n59 s ARG 181 Cb 0.41 -2.69 0.06 0.00 -0.57 0.00 0.00 34.95 32.15 1n59 s ARG 181 CO 0.14 0.24 -0.02 0.99 -1.08 0.00 0.00 175.30 175.57 1n59 s THR 182 N -2.07 1.10 -0.26 4.99 2.01 -1.26 -4.59 115.64 115.56 1n59 s THR 182 Ca 0.42 -0.92 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 1n59 s THR 182 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1n59 s THR 182 CO 0.31 -0.13 0.29 -1.81 -0.69 0.00 0.00 174.62 172.59 1n59 s ASP 183 N 1.60 6.20 0.49 3.53 1.01 -1.26 -4.87 116.67 123.37 1n59 s ASP 183 Ca -0.03 0.22 -0.21 0.00 0.71 0.00 0.00 52.55 53.23 1n59 s ASP 183 Cb -0.18 -2.17 -0.07 0.00 1.01 0.00 0.00 42.92 41.51 1n59 s ASP 183 CO -0.07 -0.09 1.13 -0.44 0.21 0.00 0.00 175.17 175.91 1n59 s SER 184 N 1.46 6.03 -0.28 0.27 0.01 -1.26 -0.28 113.70 119.65 1n59 s SER 184 Ca 0.12 2.20 -0.27 0.00 1.31 0.00 0.00 55.95 59.31 1n59 s SER 184 Cb -0.15 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.50 1n59 s SER 184 CO 0.09 -1.01 0.94 -2.16 0.41 0.00 0.00 173.24 171.51 1n59 s PRO 185 N -2.99 4.11 0.08 12.44 0.04 -1.26 -4.04 135.00 143.39 1n59 s PRO 185 Ca 0.67 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 62.55 1n59 s PRO 185 Cb -0.25 -3.69 -0.07 0.00 0.04 0.00 0.00 34.50 30.53 1n59 s PRO 185 CO 0.29 -0.70 0.53 0.15 0.04 0.00 0.00 177.00 177.32 1n59 s LYS 186 N 3.19 4.07 0.30 4.56 1.02 -0.93 -4.82 119.74 127.13 1n59 s LYS 186 Ca 0.40 0.58 0.03 0.00 0.02 0.00 0.00 55.97 57.00 1n59 s LYS 186 Cb -0.14 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 1n59 s LYS 186 CO 0.11 0.60 0.12 0.00 -0.92 0.00 0.00 175.35 175.25 1n59 s ALA 187 N -1.22 2.04 -0.01 5.17 0.00 -1.26 -0.12 121.76 126.36 1n59 s ALA 187 Ca 0.31 -1.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.19 1n59 s ALA 187 Cb -0.17 1.00 0.11 0.00 0.00 0.00 0.00 23.12 24.06 1n59 s ALA 187 CO 0.18 -0.44 1.20 -3.38 0.00 0.00 0.00 175.76 173.32 1n59 s HIS 188 N -3.57 -0.08 -0.03 0.00 -3.43 -0.62 -5.00 115.29 102.56 1n59 s HIS 188 Ca 0.35 -0.05 0.06 0.00 -0.80 0.00 0.00 55.06 54.63 1n59 s HIS 188 Cb 0.06 0.56 -0.01 0.00 -1.43 0.00 0.00 32.58 31.76 1n59 s HIS 188 CO 0.15 -0.38 -0.22 0.08 -2.00 0.00 0.00 174.74 172.38 1n59 s VAL 189 N -2.61 1.74 0.20 -5.38 1.01 -1.26 -0.07 120.40 114.03 1n59 s VAL 189 Ca 0.13 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.26 1n59 s VAL 189 Cb 0.03 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1n59 s VAL 189 CO -0.03 0.49 0.00 0.42 0.00 0.00 0.00 175.10 175.98 1n59 s THR 190 N -0.40 3.65 -0.04 3.92 -4.23 0.14 -4.81 115.64 113.86 1n59 s THR 190 Ca 0.05 -1.57 0.03 0.00 -1.18 0.00 0.00 61.69 59.02 1n59 s THR 190 Cb -0.10 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 70.88 1n59 s THR 190 CO 0.00 -0.20 -0.14 -2.28 -0.54 0.00 0.00 174.62 171.47 1n59 s HIS 191 N -1.91 1.43 -0.03 3.99 5.04 -1.26 -0.50 115.29 122.05 1n59 s HIS 191 Ca 0.29 -0.43 -0.00 0.00 -1.54 0.00 0.00 55.06 53.38 1n59 s HIS 191 Cb -0.08 -1.00 0.03 0.00 0.04 0.00 0.00 32.58 31.57 1n59 s HIS 191 CO 0.19 -0.17 0.01 -1.01 -2.34 0.00 0.00 174.74 171.42 1n59 s HIS 192 N 0.23 0.29 0.97 3.88 3.76 -0.43 -5.02 115.29 118.97 1n59 s HIS 192 Ca -0.06 0.03 -0.12 0.00 -0.15 0.00 0.00 55.06 54.76 1n59 s HIS 192 Cb -0.12 -0.45 0.17 0.00 1.11 0.00 0.00 32.58 33.30 1n59 s HIS 192 CO 0.02 -0.16 1.09 -1.54 -0.85 0.00 0.00 174.74 173.30 1n59 s SER 193 N 1.30 2.79 0.16 1.40 1.04 -1.26 -1.50 113.70 117.62 1n59 s SER 193 Ca -0.06 1.47 -0.19 0.00 0.48 0.00 0.00 55.95 57.65 1n59 s SER 193 Cb -0.13 -2.15 0.05 0.00 0.10 0.00 0.00 66.02 63.89 1n59 s SER 193 CO -0.02 -3.07 0.51 -0.13 0.98 0.00 0.00 173.24 171.51 1n59 s ARG 194 N -4.84 1.23 0.67 4.02 0.52 -1.05 -4.72 118.95 114.78 1n59 s ARG 194 Ca 0.65 -0.66 -0.17 0.00 -0.52 0.00 0.00 55.73 55.03 1n59 s ARG 194 Cb -0.20 0.53 -0.00 0.00 0.52 0.00 0.00 34.95 35.80 1n59 s ARG 194 CO 0.58 -0.51 1.20 -2.30 0.02 0.00 0.00 175.30 174.29 1n59 n PRO 195 N -0.31 0.91 -2.95 3.54 -0.02 -1.26 -3.73 135.00 131.17 1n59 n PRO 195 Ca -0.15 0.37 -0.15 0.00 -2.02 0.00 0.00 63.50 61.55 1n59 n PRO 195 Cb 0.64 -2.43 0.04 0.00 -0.02 0.00 0.00 33.50 31.72 1n59 n PRO 195 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1n59 n GLU 196 N -1.91 -4.09 -4.12 -0.52 2.13 -1.26 -2.88 120.64 107.98 1n59 n GLU 196 Ca 0.15 0.58 -0.33 0.00 0.66 0.00 0.00 57.16 58.22 1n59 n GLU 196 Cb 0.48 -4.79 -0.01 0.00 0.27 0.00 0.00 31.44 27.39 1n59 n GLU 196 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1n59 n ASP 197 N -1.24 -3.18 -4.85 4.31 9.92 -1.25 -4.97 116.55 115.31 1n59 n ASP 197 Ca -0.04 -0.96 -0.21 0.00 -0.53 0.00 0.00 54.79 53.04 1n59 n ASP 197 Cb 0.56 -3.04 -0.04 0.00 -0.64 0.00 0.00 41.12 37.96 1n59 n ASP 197 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1n59 s LYS 198 N -6.81 2.62 -0.14 -1.24 -0.14 -1.14 -2.25 119.74 110.64 1n59 s LYS 198 Ca 0.61 -1.40 -0.09 0.00 -1.36 0.00 0.00 55.97 53.74 1n59 s LYS 198 Cb -0.33 -2.41 0.05 0.00 -1.68 0.00 0.00 37.83 33.46 1n59 s LYS 198 CO 0.90 0.00 0.34 0.08 -0.76 0.00 0.00 175.35 175.91 1n59 s VAL 199 N -2.37 -0.02 -0.24 3.17 1.01 -0.04 -2.53 120.40 119.37 1n59 s VAL 199 Ca 0.43 0.09 -0.13 0.00 0.00 0.00 0.00 61.98 62.37 1n59 s VAL 199 Cb -0.04 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1n59 s VAL 199 CO 0.26 0.04 0.28 -0.89 0.00 0.00 0.00 175.10 174.79 1n59 s THR 200 N 1.06 5.27 -0.17 3.92 2.01 -0.56 -0.24 115.64 126.92 1n59 s THR 200 Ca -0.07 0.41 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 1n59 s THR 200 Cb -0.08 -3.61 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 1n59 s THR 200 CO -0.08 0.27 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.25 1n59 s LEU 201 N 1.43 2.69 -0.07 4.42 1.43 -0.35 -1.31 118.68 126.92 1n59 s LEU 201 Ca 0.12 -0.40 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 1n59 s LEU 201 Cb -0.15 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1n59 s LEU 201 CO 0.07 0.06 -0.11 -0.60 0.23 0.00 0.00 176.35 176.00 1n59 s ARG 202 N 0.95 2.72 -0.26 1.70 3.52 0.35 -0.96 118.95 126.97 1n59 s ARG 202 Ca -0.02 -0.64 -0.02 0.00 -0.13 0.00 0.00 55.73 54.92 1n59 s ARG 202 Cb -0.15 -2.49 0.03 0.00 -1.56 0.00 0.00 34.95 30.78 1n59 s ARG 202 CO -0.01 0.57 -0.04 0.00 -0.81 0.00 0.00 175.30 175.01 1n59 s TRP 204 N 1.31 3.58 -0.12 0.00 0.52 0.89 -1.99 118.94 123.14 1n59 s TRP 204 Ca -0.01 0.60 0.01 0.00 0.02 0.00 0.00 56.10 56.72 1n59 s TRP 204 Cb -0.17 -2.09 0.02 0.00 -1.15 0.00 0.00 33.47 30.08 1n59 s TRP 204 CO -0.03 0.60 -0.12 0.00 0.02 0.00 0.00 176.95 177.41 1n59 s ALA 205 N -0.67 1.63 0.31 0.98 0.00 -0.33 -1.59 121.76 122.09 1n59 s ALA 205 Ca 0.16 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.44 1n59 s ALA 205 Cb -0.13 -0.93 -0.06 0.00 0.00 0.00 0.00 23.12 22.00 1n59 s ALA 205 CO 0.05 -0.28 0.02 -0.51 0.00 0.00 0.00 175.76 175.04 1n59 s LEU 206 N 1.37 2.32 -1.73 0.00 1.43 0.83 -2.10 118.68 120.79 1n59 s LEU 206 Ca 0.01 -1.31 -0.17 0.00 -1.03 0.00 0.00 54.13 51.63 1n59 s LEU 206 Cb -0.13 -0.48 0.16 0.00 0.03 0.00 0.00 46.19 45.77 1n59 s LEU 206 CO -0.07 -0.51 0.62 0.61 0.23 0.00 0.00 176.35 177.23 1n59 n GLY 207 N -0.65 -0.38 3.77 -3.19 0.00 -1.18 -2.19 105.19 101.36 1n59 n GLY 207 Ca -0.04 0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1n59 n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1n59 s PHE 208 N -3.43 3.22 -0.24 1.61 -0.12 -1.10 -4.44 117.98 113.47 1n59 s PHE 208 Ca 0.64 0.14 -0.11 0.00 -0.05 0.00 0.00 56.93 57.55 1n59 s PHE 208 Cb -0.36 -1.68 -0.11 0.00 -0.63 0.00 0.00 43.02 40.24 1n59 s PHE 208 CO 0.97 0.53 -0.30 0.98 -0.05 0.00 0.00 175.22 177.34 1n59 n TYR 209 N 0.91 0.00 -1.71 3.49 9.36 0.61 -0.74 117.16 129.09 1n59 n TYR 209 Ca -0.11 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.67 1n59 n TYR 209 Cb 0.52 -0.86 -0.02 0.00 -0.63 0.00 0.00 39.34 38.34 1n59 n TYR 209 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1n59 n PRO 210 N -4.03 2.46 0.25 2.98 -0.02 -1.26 -4.64 135.00 130.73 1n59 n PRO 210 Ca -0.47 0.88 0.16 0.00 -2.02 0.00 0.00 63.50 62.05 1n59 n PRO 210 Cb 0.84 -2.63 0.88 0.00 -0.02 0.00 0.00 33.50 32.57 1n59 n PRO 210 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n59 h ALA 211 N 5.08 1.01 -2.07 3.55 0.00 -1.94 -3.42 119.26 121.48 1n59 h ALA 211 Ca -0.46 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 53.88 1n59 h ALA 211 Cb 1.24 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.97 1n59 h ALA 211 CO 0.82 -0.01 0.80 0.34 0.00 0.00 0.00 179.25 181.20 1n59 s ASP 212 N -4.54 7.08 0.08 0.00 2.15 -1.26 -4.97 116.67 115.21 1n59 s ASP 212 Ca -0.04 1.34 -0.19 0.00 0.43 0.00 0.00 52.55 54.10 1n59 s ASP 212 Cb 0.09 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 40.21 1n59 s ASP 212 CO 0.29 -0.69 0.45 -0.51 -0.17 0.00 0.00 175.17 174.54 1n59 s ILE 213 N 3.25 0.05 0.01 4.11 2.07 -1.26 -4.42 121.20 125.00 1n59 s ILE 213 Ca 0.44 -0.42 0.07 0.00 -1.41 0.00 0.00 60.65 59.33 1n59 s ILE 213 Cb -0.15 -1.03 -0.02 0.00 0.13 0.00 0.00 42.46 41.39 1n59 s ILE 213 CO 0.07 -0.23 -0.22 -0.89 -1.91 0.00 0.00 174.94 171.76 1n59 s THR 214 N -2.97 1.72 -0.06 4.00 2.01 0.37 -4.94 115.64 115.77 1n59 s THR 214 Ca -0.02 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 60.92 1n59 s THR 214 Cb 0.00 -1.46 0.02 0.00 0.01 0.00 0.00 72.50 71.08 1n59 s THR 214 CO -0.06 0.36 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.40 1n59 s LEU 215 N -0.84 1.30 0.04 4.42 1.43 -1.26 -0.41 118.68 123.37 1n59 s LEU 215 Ca 0.08 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1n59 s LEU 215 Cb -0.09 -0.60 -0.03 0.00 0.03 0.00 0.00 46.19 45.50 1n59 s LEU 215 CO 0.00 -0.06 -0.03 0.42 0.23 0.00 0.00 176.35 176.92 1n59 s THR 216 N 1.08 0.21 -0.13 5.49 -4.23 -0.72 -4.98 115.64 112.37 1n59 s THR 216 Ca -0.08 -1.51 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 1n59 s THR 216 Cb -0.14 -1.10 -0.02 0.00 1.34 0.00 0.00 72.50 72.58 1n59 s THR 216 CO -0.01 -0.82 -0.09 0.26 -0.54 0.00 0.00 174.62 173.43 1n59 s TRP 217 N -3.05 2.90 0.06 3.99 0.52 -1.26 -0.77 118.94 121.34 1n59 s TRP 217 Ca -0.01 -0.41 0.09 0.00 0.02 0.00 0.00 56.10 55.79 1n59 s TRP 217 Cb 0.02 -1.86 -0.03 0.00 -1.15 0.00 0.00 33.47 30.45 1n59 s TRP 217 CO -0.07 -0.06 -0.24 -0.65 0.02 0.00 0.00 176.95 175.96 1n59 s GLN 218 N 0.16 1.50 -0.17 4.98 -0.21 0.70 -1.23 119.66 125.38 1n59 s GLN 218 Ca -0.05 -1.09 -0.01 0.00 0.02 0.00 0.00 55.36 54.24 1n59 s GLN 218 Cb -0.14 -1.71 0.04 0.00 1.00 0.00 0.00 33.01 32.20 1n59 s GLN 218 CO 0.04 0.43 -0.05 -1.17 -2.12 0.00 0.00 175.29 172.42 1n59 s LEU 219 N -1.42 1.67 -1.31 2.90 2.96 -0.83 -1.23 118.68 121.42 1n59 s LEU 219 Ca 0.10 -0.72 -0.06 0.00 -0.22 0.00 0.00 54.13 53.23 1n59 s LEU 219 Cb -0.10 -0.91 0.04 0.00 0.50 0.00 0.00 46.19 45.72 1n59 s LEU 219 CO 0.03 -0.20 0.40 0.59 -1.32 0.00 0.00 176.35 175.85 1n59 n ASN 220 N 4.87 -4.35 0.00 3.68 5.03 -1.26 -2.15 115.26 121.08 1n59 n ASN 220 Ca -0.12 -0.23 0.00 0.00 0.87 0.00 0.00 54.58 55.10 1n59 n ASN 220 Cb 0.47 -3.59 0.00 0.00 -1.02 0.00 0.00 39.78 35.64 1n59 n ASN 220 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1n59 n GLY 221 N -1.17 0.69 3.24 7.41 0.00 -1.26 -5.05 105.19 109.04 1n59 n GLY 221 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1n59 n GLY 221 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n59 s GLU 222 N -0.62 3.06 -0.22 1.61 -1.05 -0.91 -5.09 118.70 115.47 1n59 s GLU 222 Ca 0.00 -0.86 -0.29 0.00 -0.15 0.00 0.00 54.97 53.67 1n59 s GLU 222 Cb 0.00 -2.34 0.01 0.00 -0.44 0.00 0.00 34.13 31.36 1n59 s GLU 222 CO 0.00 0.20 1.09 -1.21 0.95 0.00 0.00 175.26 176.29 1n59 s GLU 223 N 0.31 4.24 -1.26 -4.83 2.02 -1.26 -1.97 118.70 115.94 1n59 s GLU 223 Ca -0.17 1.41 -0.11 0.00 0.02 0.00 0.00 54.97 56.12 1n59 s GLU 223 Cb -0.17 -3.68 0.16 0.00 0.10 0.00 0.00 34.13 30.54 1n59 s GLU 223 CO 0.08 -0.67 1.73 1.47 0.02 0.00 0.00 175.26 177.90 1n59 n LEU 224 N 6.43 6.13 0.19 1.80 -0.00 -0.37 -4.69 117.00 126.49 1n59 n LEU 224 Ca 0.12 -4.55 0.04 0.00 -0.00 0.00 0.00 56.01 51.62 1n59 n LEU 224 Cb 0.46 -1.54 0.39 0.00 -0.00 0.00 0.00 43.42 42.73 1n59 n LEU 224 CO 0.53 1.12 0.73 0.16 -0.00 0.00 0.00 177.39 179.93 1n59 h ILE 225 N 4.10 1.12 0.01 1.47 3.07 -1.92 -3.34 117.51 122.03 1n59 h ILE 225 Ca 0.38 -1.29 -0.00 0.00 1.55 0.00 0.00 64.86 65.49 1n59 h ILE 225 Cb 0.72 1.72 0.00 0.00 -0.27 0.00 0.00 36.82 38.99 1n59 h ILE 225 CO 1.50 0.35 -0.01 1.56 -1.05 0.00 0.00 178.15 180.51 1n59 h GLN 226 N 0.00 -0.02 -1.98 0.16 4.20 -1.99 -3.30 115.11 112.19 1n59 h GLN 226 Ca -0.00 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.31 1n59 h GLN 226 Cb 0.70 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.34 1n59 h GLN 226 CO 0.05 0.72 0.16 -0.25 -0.67 0.00 0.00 178.83 178.83 1n59 n ASP 227 N -4.68 6.09 -4.13 1.46 8.00 -1.25 -4.84 116.55 117.19 1n59 n ASP 227 Ca -0.08 -2.98 -0.25 0.00 0.71 0.00 0.00 54.79 52.19 1n59 n ASP 227 Cb 0.36 -1.28 -0.08 0.00 -0.02 0.00 0.00 41.12 40.10 1n59 n ASP 227 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1n59 s MET 228 N -0.90 1.92 0.03 -1.24 1.75 -1.24 -4.35 119.30 115.27 1n59 s MET 228 Ca 0.59 -2.17 -0.14 0.00 -1.25 0.00 0.00 55.69 52.73 1n59 s MET 228 Cb 0.35 -0.62 0.02 0.00 2.84 0.00 0.00 34.83 37.42 1n59 s MET 228 CO -0.15 -0.47 0.30 -2.00 -0.65 0.00 0.00 175.02 172.06 1n59 s GLU 229 N -3.72 0.78 0.27 4.11 2.12 -0.17 -4.97 118.70 117.12 1n59 s GLU 229 Ca 0.24 -0.45 -0.20 0.00 0.36 0.00 0.00 54.97 54.92 1n59 s GLU 229 Cb 0.03 0.34 0.06 0.00 0.26 0.00 0.00 34.13 34.82 1n59 s GLU 229 CO 0.15 -0.25 0.90 -0.48 -0.54 0.00 0.00 175.26 175.04 1n59 s LEU 230 N -1.94 -0.05 -0.04 2.70 2.34 -1.26 -0.52 118.68 119.91 1n59 s LEU 230 Ca -0.06 -0.80 0.03 0.00 0.06 0.00 0.00 54.13 53.36 1n59 s LEU 230 Cb -0.02 2.45 0.00 0.00 -0.56 0.00 0.00 46.19 48.07 1n59 s LEU 230 CO -0.02 -1.28 -0.14 0.68 -1.06 0.00 0.00 176.35 174.53 1n59 s VAL 231 N -2.58 1.19 -0.15 1.48 -7.23 -1.07 -5.01 120.40 107.02 1n59 s VAL 231 Ca 0.17 -0.57 -0.39 0.00 -1.81 0.00 0.00 61.98 59.38 1n59 s VAL 231 Cb -0.04 -1.04 -0.16 0.00 0.56 0.00 0.00 36.38 35.70 1n59 s VAL 231 CO 0.07 0.35 1.58 -0.62 -0.31 0.00 0.00 175.10 176.18 1n59 n GLU 232 N 3.35 1.08 -0.98 4.82 1.02 -1.26 -4.56 120.64 124.11 1n59 n GLU 232 Ca -0.19 0.39 -0.31 0.00 -0.02 0.00 0.00 57.16 57.03 1n59 n GLU 232 Cb 0.53 -2.05 0.01 0.00 -0.02 0.00 0.00 31.44 29.90 1n59 n GLU 232 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1n59 n THR 233 N 3.77 0.06 -4.07 2.62 -1.04 -1.26 -4.97 114.28 109.39 1n59 n THR 233 Ca 0.24 -0.39 -0.07 0.00 -2.04 0.00 0.00 64.05 61.78 1n59 n THR 233 Cb 0.14 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.55 1n59 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1n59 s ARG 234 N -0.78 0.58 0.30 -2.82 1.70 -0.39 -4.97 118.95 112.58 1n59 s ARG 234 Ca 0.45 -1.15 -0.28 0.00 -0.47 0.00 0.00 55.73 54.28 1n59 s ARG 234 Cb -0.40 0.20 -0.09 0.00 -0.57 0.00 0.00 34.95 34.09 1n59 s ARG 234 CO 0.51 -0.11 1.03 -1.25 -1.08 0.00 0.00 175.30 174.41 1n59 s PRO 235 N -3.65 4.57 -0.19 3.89 0.04 -1.26 -1.37 135.00 137.02 1n59 s PRO 235 Ca 0.04 1.61 0.16 0.00 0.04 0.00 0.00 61.00 62.85 1n59 s PRO 235 Cb 0.06 -3.01 0.62 0.00 0.04 0.00 0.00 34.50 32.21 1n59 s PRO 235 CO -0.09 0.20 1.53 0.00 0.04 0.00 0.00 177.00 178.68 1n59 n ALA 236 N 0.88 3.26 -0.67 8.56 0.00 0.05 -4.89 120.51 127.71 1n59 n ALA 236 Ca 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 53.44 51.29 1n59 n ALA 236 Cb 0.47 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1n59 n ALA 236 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n59 n GLY 237 N -0.09 1.48 0.00 0.00 0.00 -1.26 -4.80 105.19 100.51 1n59 n GLY 237 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1n59 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n59 n ASP 238 N 0.00 1.22 0.00 1.61 5.68 -1.26 -5.00 116.55 118.80 1n59 n ASP 238 Ca 0.00 -1.55 0.00 0.00 -0.50 0.00 0.00 54.79 52.74 1n59 n ASP 238 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1n59 n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n59 n GLY 239 N -0.28 0.89 3.42 6.12 0.00 -1.26 -5.09 105.19 108.99 1n59 n GLY 239 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 1n59 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n59 s THR 240 N -2.00 1.17 0.43 2.61 -4.23 -1.26 -4.90 115.64 107.45 1n59 s THR 240 Ca 0.00 -2.02 0.06 0.00 -1.18 0.00 0.00 61.69 58.55 1n59 s THR 240 Cb 0.00 -2.69 -0.06 0.00 1.34 0.00 0.00 72.50 71.10 1n59 s THR 240 CO 0.00 -0.08 0.07 -0.36 -0.54 0.00 0.00 174.62 173.72 1n59 s PHE 241 N -3.32 2.42 0.14 3.99 0.40 0.08 -0.77 117.98 120.92 1n59 s PHE 241 Ca 0.35 -0.69 -0.15 0.00 -0.60 0.00 0.00 56.93 55.83 1n59 s PHE 241 Cb 0.08 -1.81 0.03 0.00 0.51 0.00 0.00 43.02 41.82 1n59 s PHE 241 CO 0.14 0.31 0.40 1.14 0.70 0.00 0.00 175.22 177.91 1n59 s GLN 242 N -3.81 1.12 0.03 0.44 -2.07 -0.47 -2.70 119.66 112.19 1n59 s GLN 242 Ca 0.32 -0.78 -0.22 0.00 -1.82 0.00 0.00 55.36 52.87 1n59 s GLN 242 Cb 0.07 0.47 0.05 0.00 -1.09 0.00 0.00 33.01 32.50 1n59 s GLN 242 CO 0.17 -0.44 0.50 0.21 -1.32 0.00 0.00 175.29 174.41 1n59 s LYS 243 N -3.83 0.99 0.02 9.60 2.20 -0.89 -1.26 119.74 126.58 1n59 s LYS 243 Ca 0.05 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.47 1n59 s LYS 243 Cb 0.02 0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 36.77 1n59 s LYS 243 CO -0.10 -0.34 -0.05 1.67 -0.36 0.00 0.00 175.35 176.17 1n59 s TRP 244 N -2.23 0.43 -0.03 4.03 1.48 -1.26 -1.18 118.94 120.19 1n59 s TRP 244 Ca -0.07 -0.41 0.01 0.00 -1.06 0.00 0.00 56.10 54.57 1n59 s TRP 244 Cb -0.01 -0.28 0.02 0.00 -1.16 0.00 0.00 33.47 32.05 1n59 s TRP 244 CO -0.00 -0.10 -0.01 0.00 -4.06 0.00 0.00 176.95 172.77 1n59 s ALA 245 N -1.13 0.38 0.37 2.67 0.00 -0.84 -2.59 121.76 120.62 1n59 s ALA 245 Ca -0.10 0.08 0.06 0.00 0.00 0.00 0.00 51.96 52.00 1n59 s ALA 245 Cb -0.08 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.67 1n59 s ALA 245 CO -0.00 -0.03 0.02 -1.54 0.00 0.00 0.00 175.76 174.20 1n59 s SER 246 N 0.80 3.25 -0.22 0.00 1.04 0.32 0.15 113.70 119.05 1n59 s SER 246 Ca -0.09 -1.35 -0.21 0.00 0.48 0.00 0.00 55.95 54.79 1n59 s SER 246 Cb -0.12 -0.27 0.06 0.00 0.10 0.00 0.00 66.02 65.79 1n59 s SER 246 CO -0.01 -0.48 0.60 0.54 0.98 0.00 0.00 173.24 174.86 1n59 s VAL 247 N -2.93 0.00 -0.18 5.02 0.11 -0.14 -1.00 120.40 121.28 1n59 s VAL 247 Ca 0.35 -0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 59.23 1n59 s VAL 247 Cb 0.09 -0.83 -0.04 0.00 -1.53 0.00 0.00 36.38 34.06 1n59 s VAL 247 CO 0.17 -0.00 0.43 -0.69 -3.33 0.00 0.00 175.10 171.67 1n59 s VAL 248 N 0.27 5.19 0.13 2.04 1.01 -1.26 -1.21 120.40 126.57 1n59 s VAL 248 Ca -0.00 0.79 0.05 0.00 0.00 0.00 0.00 61.98 62.82 1n59 s VAL 248 Cb -0.04 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1n59 s VAL 248 CO 0.01 0.26 -0.13 0.68 0.00 0.00 0.00 175.10 175.92 1n59 s VAL 249 N 1.20 1.28 0.46 2.92 -7.23 0.67 -4.93 120.40 114.76 1n59 s VAL 249 Ca 0.21 -1.83 -0.24 0.00 -1.81 0.00 0.00 61.98 58.31 1n59 s VAL 249 Cb -0.15 -1.63 -0.07 0.00 0.56 0.00 0.00 36.38 35.09 1n59 s VAL 249 CO 0.08 -0.53 1.26 -2.16 -0.31 0.00 0.00 175.10 173.44 1n59 s PRO 250 N -3.03 3.71 0.41 4.82 0.04 -1.26 -0.86 135.00 138.82 1n59 s PRO 250 Ca 0.12 2.02 -0.27 0.00 0.04 0.00 0.00 61.00 62.91 1n59 s PRO 250 Cb -0.02 -2.52 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 1n59 s PRO 250 CO 0.02 -0.66 1.42 -1.17 0.04 0.00 0.00 177.00 176.65 1n59 s LEU 251 N -2.89 4.23 0.00 -3.56 2.96 -0.96 -2.32 118.68 116.15 1n59 s LEU 251 Ca 0.63 2.91 0.00 0.00 -0.22 0.00 0.00 54.13 57.44 1n59 s LEU 251 Cb -0.35 -3.81 0.00 0.00 0.50 0.00 0.00 46.19 42.53 1n59 s LEU 251 CO 0.43 -0.96 0.00 0.61 -1.32 0.00 0.00 176.35 175.11 1n59 n GLY 252 N 0.57 2.81 2.28 7.98 0.00 -1.26 -4.84 105.19 112.73 1n59 n GLY 252 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1n59 n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n59 n LYS 253 N -1.98 3.35 0.01 1.61 5.02 -0.98 -4.76 118.16 120.43 1n59 n LYS 253 Ca 0.00 -4.08 0.11 0.00 -2.02 0.00 0.00 58.31 52.32 1n59 n LYS 253 Cb 0.00 -2.27 -0.13 0.00 -0.02 0.00 0.00 35.03 32.61 1n59 n LYS 253 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1n59 n GLU 254 N -0.66 0.65 0.00 1.97 0.00 -1.26 -4.04 120.64 117.30 1n59 n GLU 254 Ca 0.46 -0.12 0.08 0.00 0.00 0.00 0.00 57.16 57.58 1n59 n GLU 254 Cb 0.77 -1.59 0.36 0.00 0.00 0.00 0.00 31.44 30.98 1n59 n GLU 254 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1n59 n GLN 255 N -2.37 0.13 -0.01 3.44 6.02 -1.26 -1.13 117.38 122.19 1n59 n GLN 255 Ca -0.04 0.18 0.14 0.00 -0.01 0.00 0.00 57.00 57.27 1n59 n GLN 255 Cb 0.58 -1.50 0.65 0.00 1.02 0.00 0.00 30.24 30.99 1n59 n GLN 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1n59 n TYR 256 N -1.38 0.03 -5.06 1.08 4.01 -1.26 -4.80 117.16 109.79 1n59 n TYR 256 Ca 0.06 -0.02 -0.32 0.00 -0.16 0.00 0.00 57.90 57.46 1n59 n TYR 256 Cb 0.15 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.02 1n59 n TYR 256 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1n59 s TYR 257 N -1.97 2.61 0.16 -0.72 1.51 -0.29 -4.12 117.35 114.52 1n59 s TYR 257 Ca 0.39 -0.63 0.08 0.00 -1.01 0.00 0.00 57.07 55.91 1n59 s TYR 257 Cb 0.20 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 1n59 s TYR 257 CO 0.32 -0.16 -0.18 0.95 -1.11 0.00 0.00 175.55 175.37 1n59 s THR 258 N -0.08 1.79 -0.07 -0.71 -4.23 -0.36 -4.54 115.64 107.44 1n59 s THR 258 Ca -0.04 -1.87 -0.01 0.00 -1.18 0.00 0.00 61.69 58.58 1n59 s THR 258 Cb -0.14 -1.80 -0.03 0.00 1.34 0.00 0.00 72.50 71.86 1n59 s THR 258 CO 0.04 -0.29 0.02 0.00 -0.54 0.00 0.00 174.62 173.85 1n59 s HIS 260 N -0.96 2.00 -0.24 0.00 3.76 0.05 -0.78 115.29 119.12 1n59 s HIS 260 Ca 0.15 -1.08 -0.04 0.00 -0.15 0.00 0.00 55.06 53.95 1n59 s HIS 260 Cb -0.11 -1.50 -0.00 0.00 1.11 0.00 0.00 32.58 32.08 1n59 s HIS 260 CO 0.05 -0.61 -0.02 0.08 -0.85 0.00 0.00 174.74 173.39 1n59 s VAL 261 N 1.44 3.41 -0.38 -0.90 1.01 -0.10 -1.76 120.40 123.11 1n59 s VAL 261 Ca 0.03 -0.60 -0.09 0.00 0.00 0.00 0.00 61.98 61.32 1n59 s VAL 261 Cb -0.13 -2.62 0.05 0.00 0.00 0.00 0.00 36.38 33.68 1n59 s VAL 261 CO -0.09 0.33 0.20 -0.31 0.00 0.00 0.00 175.10 175.23 1n59 s TYR 262 N 1.46 3.29 0.06 5.22 1.51 0.45 -1.09 117.35 128.25 1n59 s TYR 262 Ca 0.04 -1.37 -0.03 0.00 -1.01 0.00 0.00 57.07 54.70 1n59 s TYR 262 Cb -0.15 -2.61 -0.03 0.00 -0.11 0.00 0.00 41.96 39.06 1n59 s TYR 262 CO -0.02 -0.76 0.04 -1.58 -1.11 0.00 0.00 175.55 172.11 1n59 s HIS 263 N 1.44 0.37 0.31 2.71 2.46 -1.26 -0.48 115.29 120.85 1n59 s HIS 263 Ca 0.01 -0.85 0.04 0.00 0.47 0.00 0.00 55.06 54.73 1n59 s HIS 263 Cb -0.21 -0.27 0.63 0.00 -0.13 0.00 0.00 32.58 32.61 1n59 s HIS 263 CO 0.03 -0.41 1.86 0.37 -2.47 0.00 0.00 174.74 174.12 1n59 h GLN 264 N 3.21 0.88 -0.28 2.88 4.15 -1.93 -0.27 115.11 123.74 1n59 h GLN 264 Ca -0.34 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.03 1n59 h GLN 264 Cb 1.16 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.66 1n59 h GLN 264 CO 0.60 0.58 0.00 0.41 -1.93 0.00 0.00 178.83 178.49 1n59 n GLY 265 N -1.38 0.27 3.08 2.39 0.00 -1.26 -4.60 105.19 103.70 1n59 n GLY 265 Ca 0.18 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1n59 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n59 s LEU 266 N -1.00 5.09 0.39 0.99 1.43 -0.11 -4.73 118.68 120.74 1n59 s LEU 266 Ca 0.18 -2.36 0.09 0.00 -1.03 0.00 0.00 54.13 51.01 1n59 s LEU 266 Cb 0.09 -1.79 0.87 0.00 0.03 0.00 0.00 46.19 45.39 1n59 s LEU 266 CO 0.12 -0.45 1.96 -0.65 0.23 0.00 0.00 176.35 177.56 1n59 h PRO 267 N 7.57 0.59 -4.70 1.29 0.11 -1.81 -3.38 132.00 131.66 1n59 h PRO 267 Ca -0.08 -0.04 -0.64 0.00 0.11 0.00 0.00 66.00 65.36 1n59 h PRO 267 Cb 1.00 -0.13 -0.37 0.00 0.11 0.00 0.00 31.00 31.61 1n59 h PRO 267 CO 0.68 0.39 -0.81 -1.21 -0.21 0.00 0.00 178.00 176.83 1n59 s GLU 268 N -5.56 2.20 0.18 1.05 2.02 -1.26 -5.09 118.70 112.24 1n59 s GLU 268 Ca -0.09 -0.96 -0.30 0.00 0.02 0.00 0.00 54.97 53.64 1n59 s GLU 268 Cb 0.20 -2.55 -0.17 0.00 0.10 0.00 0.00 34.13 31.71 1n59 s GLU 268 CO 0.76 -0.43 0.73 -2.30 0.02 0.00 0.00 175.26 174.04 1n59 n PRO 269 N 4.62 0.28 -2.39 0.39 -0.02 -1.26 -4.85 135.00 131.77 1n59 n PRO 269 Ca -0.15 0.10 -0.39 0.00 -2.02 0.00 0.00 63.50 61.04 1n59 n PRO 269 Cb 0.46 -1.27 -0.03 0.00 -0.02 0.00 0.00 33.50 32.63 1n59 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1n59 s LEU 270 N 1.97 4.30 -0.19 2.45 1.43 -0.25 -4.83 118.68 123.55 1n59 s LEU 270 Ca 0.69 2.27 -0.02 0.00 -1.03 0.00 0.00 54.13 56.04 1n59 s LEU 270 Cb -0.95 -3.93 0.06 0.00 0.03 0.00 0.00 46.19 41.40 1n59 s LEU 270 CO 0.56 -0.47 0.02 -0.89 0.23 0.00 0.00 176.35 175.80 1n59 s THR 271 N -1.38 0.67 0.19 5.49 2.01 -1.25 -0.93 115.64 120.43 1n59 s THR 271 Ca 0.53 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.95 1n59 s THR 271 Cb -0.30 -1.11 -0.05 0.00 0.01 0.00 0.00 72.50 71.05 1n59 s THR 271 CO 0.37 -0.16 -0.02 -1.48 -0.69 0.00 0.00 174.62 172.64 1n59 s LEU 272 N 1.80 2.24 0.00 4.42 0.05 0.04 -4.90 118.68 122.33 1n59 s LEU 272 Ca -0.01 -1.15 0.05 0.00 0.05 0.00 0.00 54.13 53.07 1n59 s LEU 272 Cb -0.17 -0.20 -0.02 0.00 -2.05 0.00 0.00 46.19 43.75 1n59 s LEU 272 CO -0.08 -0.49 0.19 -2.11 -0.55 0.00 0.00 176.35 173.31 1n59 n ARG 273 N -0.30 0.39 -2.65 1.48 1.85 -1.26 0.20 116.66 116.37 1n59 n ARG 273 Ca -0.07 -2.56 -0.40 0.00 -1.00 0.00 0.00 57.85 53.82 1n59 n ARG 273 Cb 0.63 1.93 -0.05 0.00 -1.05 0.00 0.00 32.46 33.92 1n59 n ARG 273 CO 0.00 0.00 0.00 -0.46 -0.01 0.00 0.00 177.63 177.16 1n59 s TRP 274 N -2.96 3.81 -0.46 2.89 -0.00 -1.26 -4.71 118.94 116.24 1n59 s TRP 274 Ca 0.27 1.80 -0.10 0.00 -0.00 0.00 0.00 56.10 58.07 1n59 s TRP 274 Cb 0.01 -3.10 0.11 0.00 -0.00 0.00 0.00 33.47 30.49 1n59 s TRP 274 CO 0.19 0.03 0.34 -2.00 -0.00 0.00 0.00 176.95 175.51 1n59 s GLU 275 N -0.88 2.60 0.00 5.86 -6.30 -1.26 -4.95 118.70 113.77 1n59 s GLU 275 Ca 0.44 -1.64 0.00 0.00 -2.50 0.00 0.00 54.97 51.27 1n59 s GLU 275 Cb -0.27 -3.93 0.00 0.00 0.00 0.00 0.00 34.13 29.92 1n59 s GLU 275 CO 0.34 -1.13 0.11 -2.30 0.02 0.00 0.00 175.26 172.30