#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vna s MET 1 N 0.00 3.81 -0.26 0.03 0.00 -1.14 -4.83 119.30 116.92 2vna s MET 1 Ca 0.00 0.69 -0.10 0.00 0.00 0.00 0.00 55.69 56.29 2vna s MET 1 Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 34.83 32.55 2vna s MET 1 CO 0.00 -0.22 0.14 0.42 0.00 0.00 0.00 175.02 175.36 2vna s ILE 2 N -2.61 4.97 0.45 3.16 1.01 -1.26 -0.44 121.20 126.48 2vna s ILE 2 Ca 0.55 0.05 0.05 0.00 0.00 0.00 0.00 60.65 61.30 2vna s ILE 2 Cb -0.10 -3.34 -0.05 0.00 0.01 0.00 0.00 42.46 38.98 2vna s ILE 2 CO 0.35 0.31 0.04 0.68 0.00 0.00 0.00 174.94 176.32 2vna s VAL 3 N 1.50 1.74 0.23 2.92 -7.23 -0.32 -4.96 120.40 114.28 2vna s VAL 3 Ca 0.07 -1.95 0.07 0.00 -1.81 0.00 0.00 61.98 58.36 2vna s VAL 3 Cb -0.15 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 2vna s VAL 3 CO 0.07 0.00 0.11 -1.10 -0.31 0.00 0.00 175.10 173.87 2vna s GLN 4 N -3.81 2.71 -0.10 4.82 1.11 -1.26 -1.37 119.66 121.76 2vna s GLN 4 Ca 0.26 -1.10 -0.19 0.00 0.01 0.00 0.00 55.36 54.34 2vna s GLN 4 Cb 0.06 -2.46 0.04 0.00 -1.01 0.00 0.00 33.01 29.64 2vna s GLN 4 CO 0.14 0.42 0.46 0.50 0.01 0.00 0.00 175.29 176.82 2vna s ARG 5 N -3.53 0.69 -0.14 2.91 3.52 -0.32 -2.15 118.95 119.93 2vna s ARG 5 Ca 0.31 0.30 -0.02 0.00 -0.13 0.00 0.00 55.73 56.20 2vna s ARG 5 Cb -0.08 0.33 -0.02 0.00 -1.56 0.00 0.00 34.95 33.61 2vna s ARG 5 CO 0.23 -0.16 -0.09 0.08 -0.81 0.00 0.00 175.30 174.55 2vna s VAL 6 N -0.56 3.44 0.27 7.11 1.01 -0.65 0.13 120.40 131.15 2vna s VAL 6 Ca -0.07 -0.52 0.10 0.00 0.00 0.00 0.00 61.98 61.49 2vna s VAL 6 Cb -0.03 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 2vna s VAL 6 CO 0.04 0.51 -0.14 0.68 0.00 0.00 0.00 175.10 176.18 2vna s VAL 7 N 0.38 2.11 -0.39 2.92 -7.23 0.31 -1.90 120.40 116.60 2vna s VAL 7 Ca -0.08 -2.27 -0.29 0.00 -1.81 0.00 0.00 61.98 57.53 2vna s VAL 7 Cb -0.15 -2.33 0.01 0.00 0.56 0.00 0.00 36.38 34.47 2vna s VAL 7 CO 0.04 -0.39 1.38 -0.22 -0.31 0.00 0.00 175.10 175.60 2vna s LEU 8 N -3.47 3.65 0.02 1.32 2.96 -1.03 -1.50 118.68 120.63 2vna s LEU 8 Ca 0.29 0.90 -0.11 0.00 -0.22 0.00 0.00 54.13 54.98 2vna s LEU 8 Cb -0.01 -3.54 -0.33 0.00 0.50 0.00 0.00 46.19 42.81 2vna s LEU 8 CO 0.13 -1.36 0.93 -1.13 -1.32 0.00 0.00 176.35 173.60 2vna h ASN 9 N 10.37 0.68 -4.56 3.68 -1.24 -0.82 0.85 115.58 124.55 2vna h ASN 9 Ca -0.27 -0.80 0.11 0.00 0.71 0.00 0.00 56.30 56.05 2vna h ASN 9 Cb 1.10 -0.22 -0.16 0.00 0.73 0.00 0.00 38.32 39.77 2vna h ASN 9 CO 1.08 1.64 0.52 -0.94 -1.29 0.00 0.00 177.43 178.44 2vna s SER 10 N -7.38 -0.35 -0.12 1.15 1.04 -0.83 -4.79 113.70 102.41 2vna s SER 10 Ca -0.10 0.06 -0.08 0.00 0.48 0.00 0.00 55.95 56.31 2vna s SER 10 Cb 0.05 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.49 2vna s SER 10 CO 0.91 -0.56 0.16 -0.13 0.98 0.00 0.00 173.24 174.60 2vna s ARG 11 N -2.80 3.56 0.00 4.02 0.52 -1.26 -4.58 118.95 118.39 2vna s ARG 11 Ca 0.04 -0.09 0.29 0.00 -0.52 0.00 0.00 55.73 55.45 2vna s ARG 11 Cb -0.01 -3.22 1.27 0.00 0.52 0.00 0.00 34.95 33.52 2vna s ARG 11 CO -0.07 0.72 1.94 -0.35 0.02 0.00 0.00 175.30 177.56 2vna n PRO 12 N 2.13 0.12 0.00 3.54 -0.04 -1.26 -5.01 135.00 134.47 2vna n PRO 12 Ca -0.19 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2vna n PRO 12 Cb 0.54 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 2vna n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vna n GLY 13 N 1.44 -1.34 0.48 0.55 0.00 -1.26 -3.63 105.19 101.43 2vna n GLY 13 Ca 0.09 -1.37 0.30 0.00 0.00 0.00 0.00 46.02 45.04 2vna n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vna h LYS 14 N 0.00 0.16 -0.52 1.61 1.57 -1.93 0.30 116.57 117.76 2vna h LYS 14 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2vna h LYS 14 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2vna h LYS 14 CO 0.00 0.11 0.00 0.09 -0.57 0.00 0.00 179.45 179.08 2vna n ASN 15 N -4.39 3.80 -4.97 0.86 3.02 -1.26 -3.73 115.26 108.60 2vna n ASN 15 Ca 0.26 -2.23 -0.21 0.00 -0.03 0.00 0.00 54.58 52.36 2vna n ASN 15 Cb 1.11 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 2vna n ASN 15 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2vna s GLY 16 N -1.08 1.52 0.12 7.41 0.00 0.10 -4.79 107.32 110.60 2vna s GLY 16 Ca 0.40 -1.19 -0.23 0.00 0.00 0.00 0.00 44.72 43.69 2vna s GLY 16 CO 0.22 -1.08 0.71 -1.31 0.00 0.00 0.00 173.10 171.63 2vna s ASN 17 N -4.16 7.27 0.07 1.64 0.01 -1.26 -4.78 114.94 113.72 2vna s ASN 17 Ca 0.45 1.50 -0.31 0.00 -0.71 0.00 0.00 52.86 53.79 2vna s ASN 17 Cb -0.10 -2.45 -0.06 0.00 0.41 0.00 0.00 41.25 39.05 2vna s ASN 17 CO 0.35 0.21 1.24 -2.16 -1.51 0.00 0.00 177.10 175.23 2vna s PRO 18 N -1.03 4.40 0.13 -0.60 0.04 -1.26 -4.79 135.00 131.89 2vna s PRO 18 Ca 0.34 1.83 0.08 0.00 0.04 0.00 0.00 61.00 63.29 2vna s PRO 18 Cb -0.22 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 2vna s PRO 18 CO 0.24 -0.30 -0.19 0.14 0.04 0.00 0.00 177.00 176.92 2vna s VAL 19 N 1.12 1.67 0.33 -0.36 -7.23 -1.26 -4.74 120.40 109.92 2vna s VAL 19 Ca 0.60 -1.68 0.07 0.00 -1.81 0.00 0.00 61.98 59.15 2vna s VAL 19 Cb -0.31 -1.63 0.40 0.00 0.56 0.00 0.00 36.38 35.40 2vna s VAL 19 CO 0.29 -0.20 1.57 0.00 -0.31 0.00 0.00 175.10 176.45 2vna h ALA 20 N 3.73 1.44 0.00 1.32 0.00 -1.93 0.18 119.26 124.00 2vna h ALA 20 Ca -0.44 0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2vna h ALA 20 Cb 1.19 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2vna h ALA 20 CO 0.45 -0.68 0.00 0.39 0.00 0.00 0.00 179.25 179.41 2vna n GLU 21 N -5.43 0.69 0.05 0.00 4.71 -1.26 -1.32 120.64 118.07 2vna n GLU 21 Ca 0.27 0.01 0.10 0.00 -0.01 0.00 0.00 57.16 57.53 2vna n GLU 21 Cb 0.91 -1.50 0.41 0.00 -1.01 0.00 0.00 31.44 30.25 2vna n GLU 21 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2vna n ASN 22 N -1.04 0.27 -4.50 1.62 5.03 0.62 -4.46 115.26 112.80 2vna n ASN 22 Ca 0.17 0.56 -0.29 0.00 0.87 0.00 0.00 54.58 55.89 2vna n ASN 22 Cb 0.10 -0.62 -0.11 0.00 -1.02 0.00 0.00 39.78 38.13 2vna n ASN 22 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2vna s PHE 23 N -3.11 2.54 -0.03 3.10 0.08 -0.44 -0.13 117.98 119.99 2vna s PHE 23 Ca 0.07 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.87 2vna s PHE 23 Cb 0.11 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 41.25 2vna s PHE 23 CO 0.36 0.41 -0.01 0.50 -0.10 0.00 0.00 175.22 176.37 2vna s ARG 24 N -2.25 0.45 0.31 0.44 3.52 -0.56 -4.72 118.95 116.14 2vna s ARG 24 Ca 0.19 0.01 -0.28 0.00 -0.13 0.00 0.00 55.73 55.52 2vna s ARG 24 Cb -0.10 -0.57 -0.09 0.00 -1.56 0.00 0.00 34.95 32.62 2vna s ARG 24 CO 0.11 -0.11 1.04 -1.64 -0.81 0.00 0.00 175.30 173.89 2vna s MET 25 N 0.92 4.55 0.18 5.12 -1.94 -1.26 -0.53 119.30 126.35 2vna s MET 25 Ca -0.10 1.61 -0.02 0.00 -1.71 0.00 0.00 55.69 55.47 2vna s MET 25 Cb -0.13 -2.99 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 2vna s MET 25 CO -0.01 0.19 0.14 -1.21 -0.01 0.00 0.00 175.02 174.11 2vna s GLU 26 N -1.74 1.14 -0.07 2.03 2.02 0.12 -4.94 118.70 117.26 2vna s GLU 26 Ca 0.48 -1.54 0.05 0.00 0.02 0.00 0.00 54.97 53.99 2vna s GLU 26 Cb -0.27 0.28 -0.01 0.00 0.10 0.00 0.00 34.13 34.23 2vna s GLU 26 CO 0.34 -0.37 -0.24 -1.21 0.02 0.00 0.00 175.26 173.80 2vna s GLU 27 N -4.11 2.66 0.28 1.61 2.02 -1.26 -1.18 118.70 118.72 2vna s GLU 27 Ca 0.33 -0.88 0.04 0.00 0.02 0.00 0.00 54.97 54.47 2vna s GLU 27 Cb 0.07 -2.21 -0.06 0.00 0.10 0.00 0.00 34.13 32.02 2vna s GLU 27 CO 0.08 0.35 0.03 0.14 0.02 0.00 0.00 175.26 175.89 2vna s VAL 28 N -0.09 1.12 0.13 2.63 -7.23 -0.47 -4.97 120.40 111.51 2vna s VAL 28 Ca -0.06 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 57.94 2vna s VAL 28 Cb -0.14 -2.61 -0.07 0.00 0.56 0.00 0.00 36.38 34.12 2vna s VAL 28 CO 0.04 -0.13 0.55 -0.31 -0.31 0.00 0.00 175.10 174.95 2vna s TYR 29 N -3.36 3.66 -0.23 2.82 1.51 -1.26 -1.17 117.35 119.32 2vna s TYR 29 Ca 0.34 1.11 -0.07 0.00 -1.01 0.00 0.00 57.07 57.44 2vna s TYR 29 Cb 0.07 -2.40 -0.03 0.00 -0.11 0.00 0.00 41.96 39.49 2vna s TYR 29 CO 0.13 0.47 0.05 -1.17 -1.11 0.00 0.00 175.55 173.92 2vna s LEU 30 N -1.73 3.39 0.92 -1.29 2.96 0.42 -4.90 118.68 118.45 2vna s LEU 30 Ca 0.35 -0.19 -0.12 0.00 -0.22 0.00 0.00 54.13 53.95 2vna s LEU 30 Cb -0.16 -1.89 0.06 0.00 0.50 0.00 0.00 46.19 44.70 2vna s LEU 30 CO 0.19 0.01 0.63 -2.65 -1.32 0.00 0.00 176.35 173.21 2vna n PRO 31 N 4.63 -0.27 0.02 0.98 -0.02 -1.26 -2.86 135.00 136.23 2vna n PRO 31 Ca -0.17 -0.03 0.11 0.00 -2.02 0.00 0.00 63.50 61.40 2vna n PRO 31 Cb 0.52 -2.01 -0.07 0.00 -0.02 0.00 0.00 33.50 31.92 2vna n PRO 31 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2vna n ASP 32 N -2.04 0.47 -4.46 2.55 8.00 -1.26 -4.81 116.55 114.99 2vna n ASP 32 Ca 0.09 -0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.15 2vna n ASP 32 Cb 0.53 1.20 -0.13 0.00 -0.02 0.00 0.00 41.12 42.70 2vna n ASP 32 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2vna s ASN 33 N -4.32 3.86 0.37 -2.24 0.01 -1.26 -5.14 114.94 106.22 2vna s ASN 33 Ca -0.01 -0.30 0.08 0.00 -0.71 0.00 0.00 52.86 51.92 2vna s ASN 33 Cb 0.14 -0.72 -0.05 0.00 0.41 0.00 0.00 41.25 41.02 2vna s ASN 33 CO 0.85 0.31 0.09 0.27 -1.51 0.00 0.00 177.10 177.11 2vna s ILE 34 N -0.79 2.52 0.48 0.60 -4.36 -1.26 -5.16 121.20 113.23 2vna s ILE 34 Ca 0.13 -1.84 0.07 0.00 -0.26 0.00 0.00 60.65 58.75 2vna s ILE 34 Cb -0.11 -2.91 0.01 0.00 1.25 0.00 0.00 42.46 40.71 2vna s ILE 34 CO 0.02 -0.11 0.44 0.20 0.24 0.00 0.00 174.94 175.74 2vna s ASN 35 N -3.80 4.92 0.63 4.36 0.01 -1.26 -5.04 114.94 114.75 2vna s ASN 35 Ca 0.37 -0.92 -0.18 0.00 -0.71 0.00 0.00 52.86 51.42 2vna s ASN 35 Cb 0.02 -0.13 -0.02 0.00 0.41 0.00 0.00 41.25 41.53 2vna s ASN 35 CO 0.21 -0.90 1.24 -0.62 -1.51 0.00 0.00 177.10 175.52 2vna n GLU 36 N -1.72 1.14 0.00 -0.60 1.02 -1.26 -2.19 120.64 117.03 2vna n GLU 36 Ca 0.04 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 2vna n GLU 36 Cb 0.63 -2.47 0.00 0.00 -0.02 0.00 0.00 31.44 29.58 2vna n GLU 36 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vna n GLY 37 N 0.98 2.39 3.90 0.62 0.00 -0.46 -4.97 105.19 107.64 2vna n GLY 37 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 2vna n GLY 37 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vna s GLN 38 N 0.00 3.20 0.04 1.61 -0.21 -0.93 -0.10 119.66 123.27 2vna s GLN 38 Ca 0.00 -0.90 -0.01 0.00 0.02 0.00 0.00 55.36 54.48 2vna s GLN 38 Cb 0.00 -2.74 -0.03 0.00 1.00 0.00 0.00 33.01 31.24 2vna s GLN 38 CO 0.00 0.42 -0.03 0.54 -2.12 0.00 0.00 175.29 174.10 2vna s VAL 39 N -2.05 0.21 -0.13 1.09 0.11 -0.59 -1.20 120.40 117.83 2vna s VAL 39 Ca 0.33 -1.54 0.01 0.00 -2.93 0.00 0.00 61.98 57.85 2vna s VAL 39 Cb -0.08 -1.15 -0.01 0.00 -1.53 0.00 0.00 36.38 33.61 2vna s VAL 39 CO 0.27 -0.84 -0.15 -1.58 -3.33 0.00 0.00 175.10 169.46 2vna s GLN 40 N -3.17 3.28 0.04 1.54 0.74 0.05 -1.15 119.66 120.99 2vna s GLN 40 Ca 0.00 -0.74 0.09 0.00 0.05 0.00 0.00 55.36 54.77 2vna s GLN 40 Cb 0.02 -2.58 -0.03 0.00 1.10 0.00 0.00 33.01 31.53 2vna s GLN 40 CO -0.07 0.15 -0.26 0.08 -0.55 0.00 0.00 175.29 174.64 2vna s VAL 41 N 0.49 2.19 -0.24 1.34 1.01 0.15 -0.89 120.40 124.46 2vna s VAL 41 Ca -0.11 -1.33 -0.16 0.00 0.00 0.00 0.00 61.98 60.39 2vna s VAL 41 Cb -0.16 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2vna s VAL 41 CO 0.05 0.40 0.40 -0.60 0.00 0.00 0.00 175.10 175.35 2vna s ARG 42 N -1.17 4.09 0.08 2.72 3.52 -0.27 -1.77 118.95 126.15 2vna s ARG 42 Ca 0.12 0.15 -0.31 0.00 -0.13 0.00 0.00 55.73 55.56 2vna s ARG 42 Cb -0.10 -3.61 -0.07 0.00 -1.56 0.00 0.00 34.95 29.62 2vna s ARG 42 CO 0.02 -0.19 1.29 0.99 -0.81 0.00 0.00 175.30 176.60 2vna s THR 43 N 1.80 3.68 -0.20 4.11 2.01 -0.20 -1.58 115.64 125.26 2vna s THR 43 Ca 0.17 1.21 -0.12 0.00 0.31 0.00 0.00 61.69 63.26 2vna s THR 43 Cb -0.15 -3.77 -0.08 0.00 0.01 0.00 0.00 72.50 68.50 2vna s THR 43 CO 0.09 0.09 -0.28 0.18 -0.69 0.00 0.00 174.62 174.01 2vna n LEU 44 N 3.98 1.60 -4.07 4.42 4.77 -0.06 -4.21 117.00 123.44 2vna n LEU 44 Ca 0.10 0.27 -0.15 0.00 -0.03 0.00 0.00 56.01 56.20 2vna n LEU 44 Cb 0.44 -0.65 -0.12 0.00 -2.33 0.00 0.00 43.42 40.76 2vna n LEU 44 CO 0.57 0.26 -0.42 -0.31 -1.33 0.00 0.00 177.39 176.16 2vna s TYR 45 N -2.48 0.79 0.02 -1.77 2.02 -0.85 -0.76 117.35 114.33 2vna s TYR 45 Ca -0.29 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.10 2vna s TYR 45 Cb 0.10 -0.47 -0.02 0.00 -0.40 0.00 0.00 41.96 41.16 2vna s TYR 45 CO 0.38 -0.03 -0.23 -0.51 -1.57 0.00 0.00 175.55 173.58 2vna s LEU 46 N -1.22 2.12 0.23 -1.29 1.43 -0.58 -1.59 118.68 117.78 2vna s LEU 46 Ca -0.05 -0.50 -0.16 0.00 -1.03 0.00 0.00 54.13 52.40 2vna s LEU 46 Cb -0.08 -1.12 -0.08 0.00 0.03 0.00 0.00 46.19 44.94 2vna s LEU 46 CO 0.01 0.23 0.66 -0.55 0.23 0.00 0.00 176.35 176.93 2vna s SER 47 N -0.97 6.86 -0.05 2.29 0.15 -0.69 -0.92 113.70 120.37 2vna s SER 47 Ca 0.09 1.23 0.05 0.00 0.70 0.00 0.00 55.95 58.02 2vna s SER 47 Cb -0.09 -2.35 -0.02 0.00 -1.71 0.00 0.00 66.02 61.85 2vna s SER 47 CO 0.01 -0.03 -0.19 0.68 1.20 0.00 0.00 173.24 174.91 2vna s VAL 48 N -1.68 2.63 0.01 4.45 -7.23 -1.24 -4.63 120.40 112.71 2vna s VAL 48 Ca 0.45 -0.88 -0.01 0.00 -1.81 0.00 0.00 61.98 59.74 2vna s VAL 48 Cb -0.14 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 2vna s VAL 48 CO 0.20 0.58 -0.00 -1.81 -0.31 0.00 0.00 175.10 173.75 2vna s ASP 49 N -0.52 0.15 0.54 4.85 1.01 -1.26 -4.70 116.67 116.74 2vna s ASP 49 Ca 0.07 -0.32 0.21 0.00 0.71 0.00 0.00 52.55 53.22 2vna s ASP 49 Cb -0.11 0.09 1.45 0.00 1.01 0.00 0.00 42.92 45.35 2vna s ASP 49 CO 0.01 -0.22 2.17 -0.65 0.21 0.00 0.00 175.17 176.69 2vna h PRO 50 N 5.04 0.00 0.00 8.23 0.11 -1.97 -1.79 132.00 141.62 2vna h PRO 50 Ca -0.30 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 2vna h PRO 50 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2vna h PRO 50 CO 0.44 0.00 -0.06 0.10 -0.21 0.00 0.00 178.00 178.27 2vna h TYR 51 N 0.00 0.00 0.00 0.65 -0.00 -2.04 -1.77 116.97 113.81 2vna h TYR 51 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.75 2vna h TYR 51 Cb 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.82 2vna h TYR 51 CO 0.00 0.06 -0.00 0.52 -0.00 0.00 0.00 178.16 178.74 2vna h MET 52 N 0.00 0.00 -0.47 0.10 2.86 -1.76 -2.93 114.93 112.73 2vna h MET 52 Ca -0.00 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2vna h MET 52 Cb 0.35 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 2vna h MET 52 CO 0.01 0.00 0.23 -0.09 1.06 0.00 0.00 176.91 178.13 2vna h ARG 53 N 0.00 0.45 -0.07 1.72 9.65 -1.48 -2.46 114.38 122.18 2vna h ARG 53 Ca -0.00 -0.03 -0.09 0.00 -1.10 0.00 0.00 59.98 58.76 2vna h ARG 53 Cb 0.13 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 2vna h ARG 53 CO 0.00 0.30 -0.36 0.00 2.80 0.00 0.00 179.97 182.71 2vna h ARG 55 N 0.13 0.00 -0.00 0.00 3.08 -1.57 -0.11 114.38 115.91 2vna h ARG 55 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2vna h ARG 55 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2vna h ARG 55 CO 0.05 0.00 -0.13 -1.33 -1.07 0.00 0.00 179.97 177.50 2vna n MET 56 N -2.72 0.14 -2.55 0.04 2.81 -0.87 -0.97 117.12 112.99 2vna n MET 56 Ca -0.01 -0.03 -0.26 0.00 -1.81 0.00 0.00 57.70 55.59 2vna n MET 56 Cb 0.12 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.16 2vna n MET 56 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2vna s ASN 57 N -2.88 5.71 0.28 7.83 0.01 -0.06 -4.47 114.94 121.36 2vna s ASN 57 Ca 0.17 0.63 0.05 0.00 -0.71 0.00 0.00 52.86 53.00 2vna s ASN 57 Cb 0.19 -1.71 0.41 0.00 0.41 0.00 0.00 41.25 40.55 2vna s ASN 57 CO 0.55 -0.94 1.68 -0.33 -1.51 0.00 0.00 177.10 176.56 2vna h GLU 58 N -0.01 0.28 -5.50 -0.60 5.08 -1.88 -3.42 114.58 108.54 2vna h GLU 58 Ca -0.46 -0.14 -0.62 0.00 -1.00 0.00 0.00 59.36 57.14 2vna h GLU 58 Cb 1.25 -0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.18 2vna h GLU 58 CO 0.60 0.66 -0.86 0.34 -1.00 0.00 0.00 179.01 178.75 2vna s ASP 59 N -6.87 2.60 0.21 1.42 2.15 -1.26 -4.78 116.67 110.14 2vna s ASP 59 Ca -0.05 -0.44 0.17 0.00 0.43 0.00 0.00 52.55 52.67 2vna s ASP 59 Cb 0.13 -0.84 0.02 0.00 -0.30 0.00 0.00 42.92 41.93 2vna s ASP 59 CO 0.78 0.18 1.21 0.71 -0.17 0.00 0.00 175.17 177.87 2vna h THR 60 N 5.32 0.55 -0.26 1.71 1.35 -1.80 -3.48 112.91 116.31 2vna h THR 60 Ca -0.30 -1.87 0.00 0.00 -0.55 0.00 0.00 66.41 63.69 2vna h THR 60 Cb 1.19 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.74 2vna h THR 60 CO 0.47 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.67 2vna n GLY 61 N 1.26 0.57 3.65 5.82 0.00 -1.26 -4.96 105.19 110.26 2vna n GLY 61 Ca -0.02 -0.81 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 2vna n GLY 61 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vna s THR 62 N -2.26 0.00 0.15 2.61 -1.32 -1.26 -4.91 115.64 108.64 2vna s THR 62 Ca 0.00 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.31 2vna s THR 62 Cb 0.00 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2vna s THR 62 CO 0.00 0.00 1.80 0.44 -2.21 0.00 0.00 174.62 174.65 2vna h ASP 63 N 3.85 0.43 0.00 8.08 3.32 -2.04 -3.04 116.42 127.02 2vna h ASP 63 Ca -0.27 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2vna h ASP 63 Cb 1.19 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2vna h ASP 63 CO 0.17 0.33 0.11 0.10 -1.72 0.00 0.00 179.24 178.22 2vna h TYR 64 N 0.50 0.00 -3.41 4.55 -0.00 -2.02 -3.38 116.97 113.21 2vna h TYR 64 Ca 0.14 0.00 -0.46 0.00 -0.00 0.00 0.00 58.73 58.40 2vna h TYR 64 Cb -0.04 0.00 -0.34 0.00 -0.00 0.00 0.00 36.73 36.35 2vna h TYR 64 CO -0.05 0.00 -0.79 0.42 -0.00 0.00 0.00 178.16 177.74 2vna s ILE 65 N -3.66 0.82 0.01 -0.90 1.01 -1.15 -5.14 121.20 112.19 2vna s ILE 65 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.35 2vna s ILE 65 Cb 0.07 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 2vna s ILE 65 CO 0.22 0.29 0.10 0.42 0.00 0.00 0.00 174.94 175.97 2vna s THR 66 N 0.94 4.80 0.38 2.92 -4.23 -1.26 -4.61 115.64 114.57 2vna s THR 66 Ca -0.10 -0.45 -0.26 0.00 -1.18 0.00 0.00 61.69 59.69 2vna s THR 66 Cb -0.15 -3.23 -0.09 0.00 1.34 0.00 0.00 72.50 70.38 2vna s THR 66 CO 0.01 0.29 1.16 -2.16 -0.54 0.00 0.00 174.62 173.38 2vna s PRO 67 N -1.92 4.17 0.61 3.99 0.04 -1.26 -4.81 135.00 135.82 2vna s PRO 67 Ca 0.25 1.84 -0.19 0.00 0.04 0.00 0.00 61.00 62.94 2vna s PRO 67 Cb -0.12 -2.77 -0.03 0.00 0.04 0.00 0.00 34.50 31.62 2vna s PRO 67 CO 0.17 -0.22 1.24 -1.58 0.04 0.00 0.00 177.00 176.65 2vna s TRP 68 N -1.38 2.27 0.06 0.56 0.51 -0.14 -5.03 118.94 115.79 2vna s TRP 68 Ca 0.55 1.50 -0.01 0.00 -2.12 0.00 0.00 56.10 56.01 2vna s TRP 68 Cb -0.31 -3.57 -0.04 0.00 -0.81 0.00 0.00 33.47 28.74 2vna s TRP 68 CO 0.39 -2.51 0.24 -0.65 -0.51 0.00 0.00 176.95 173.91 2vna s GLN 69 N -3.33 3.48 0.31 4.98 -1.52 -1.26 -4.90 119.66 117.42 2vna s GLN 69 Ca 0.79 -0.35 -0.29 0.00 -1.95 0.00 0.00 55.36 53.57 2vna s GLN 69 Cb -0.33 -3.02 -0.10 0.00 -0.22 0.00 0.00 33.01 29.33 2vna s GLN 69 CO 0.36 0.60 1.41 -0.51 -0.25 0.00 0.00 175.29 176.90 2vna s LEU 70 N -2.41 4.38 0.00 2.90 1.02 -1.26 -2.55 118.68 120.76 2vna s LEU 70 Ca 0.35 2.78 0.00 0.00 0.02 0.00 0.00 54.13 57.27 2vna s LEU 70 Cb -0.13 -3.64 0.00 0.00 0.02 0.00 0.00 46.19 42.44 2vna s LEU 70 CO 0.26 -0.69 0.00 -1.20 0.02 0.00 0.00 176.35 174.74 2vna n SER 71 N 1.35 0.00 -4.87 2.29 7.64 0.30 -4.91 113.62 115.42 2vna n SER 71 Ca 0.03 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.55 2vna n SER 71 Cb 0.40 -0.88 -0.06 0.00 -1.01 0.00 0.00 64.21 62.67 2vna n SER 71 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2vna s GLN 72 N -0.21 3.65 0.25 1.43 1.11 -1.06 -4.80 119.66 120.03 2vna s GLN 72 Ca 0.00 0.05 -0.31 0.00 0.01 0.00 0.00 55.36 55.12 2vna s GLN 72 Cb 0.00 -3.12 -0.14 0.00 -1.01 0.00 0.00 33.01 28.74 2vna s GLN 72 CO 0.00 0.67 1.32 1.55 0.01 0.00 0.00 175.29 178.84 2vna n VAL 73 N 1.43 1.23 -2.70 1.09 3.14 -1.26 -2.46 118.33 118.80 2vna n VAL 73 Ca -0.13 -0.31 -0.30 0.00 -2.96 0.00 0.00 64.34 60.64 2vna n VAL 73 Cb 0.53 -1.37 -0.03 0.00 -1.06 0.00 0.00 33.84 31.91 2vna n VAL 73 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2vna s VAL 74 N -0.35 4.74 0.05 1.55 0.11 -0.80 -4.87 120.40 120.83 2vna s VAL 74 Ca 0.66 0.72 0.01 0.00 -2.93 0.00 0.00 61.98 60.43 2vna s VAL 74 Cb -0.66 -3.75 -0.03 0.00 -1.53 0.00 0.00 36.38 30.41 2vna s VAL 74 CO 0.53 -0.61 -0.05 1.51 -3.33 0.00 0.00 175.10 173.15 2vna s ASP 75 N -3.26 0.63 0.00 3.54 -4.77 -1.26 0.27 116.67 111.82 2vna s ASP 75 Ca 0.53 -0.75 0.00 0.00 -3.30 0.00 0.00 52.55 49.03 2vna s ASP 75 Cb -0.10 0.11 0.00 0.00 -1.09 0.00 0.00 42.92 41.84 2vna s ASP 75 CO 0.33 -0.39 0.00 0.61 0.70 0.00 0.00 175.17 176.42 2vna n GLY 76 N 0.84 0.52 3.65 2.12 0.00 -0.55 -4.85 105.19 106.91 2vna n GLY 76 Ca -0.19 -0.75 -0.46 0.00 0.00 0.00 0.00 46.02 44.61 2vna n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vna n GLY 77 N 0.00 0.72 3.31 -0.02 0.00 -1.17 -0.38 105.19 107.65 2vna n GLY 77 Ca 0.00 0.57 -0.11 0.00 0.00 0.00 0.00 46.02 46.47 2vna n GLY 77 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vna s GLY 78 N 0.43 -0.24 -0.01 -0.02 0.00 -0.33 -1.70 107.32 105.45 2vna s GLY 78 Ca 0.73 0.06 0.03 0.00 0.00 0.00 0.00 44.72 45.55 2vna s GLY 78 CO 0.47 -0.19 -0.10 -1.50 0.00 0.00 0.00 173.10 171.77 2vna s ILE 79 N -3.20 0.78 0.30 0.90 2.07 -0.62 -2.33 121.20 119.10 2vna s ILE 79 Ca -0.01 -0.45 -0.20 0.00 -1.41 0.00 0.00 60.65 58.58 2vna s ILE 79 Cb 0.01 -0.66 0.03 0.00 0.13 0.00 0.00 42.46 41.96 2vna s ILE 79 CO -0.08 0.21 0.73 -0.83 -1.91 0.00 0.00 174.94 173.06 2vna s GLY 80 N -0.28 -0.02 -0.08 1.50 0.00 -0.26 -0.88 107.32 107.30 2vna s GLY 80 Ca 0.04 -0.38 0.02 0.00 0.00 0.00 0.00 44.72 44.40 2vna s GLY 80 CO -0.00 -0.12 -0.15 -1.50 0.00 0.00 0.00 173.10 171.33 2vna s ILE 81 N -3.67 2.95 0.08 0.90 2.07 -0.62 -0.78 121.20 122.14 2vna s ILE 81 Ca 0.12 -0.73 -0.31 0.00 -1.41 0.00 0.00 60.65 58.31 2vna s ILE 81 Cb -0.06 -2.18 -0.07 0.00 0.13 0.00 0.00 42.46 40.28 2vna s ILE 81 CO 0.08 0.56 1.41 -0.63 -1.91 0.00 0.00 174.94 174.44 2vna s ILE 82 N -0.23 3.41 -0.09 2.00 1.01 -0.54 -1.11 121.20 125.66 2vna s ILE 82 Ca 0.01 0.96 0.20 0.00 0.00 0.00 0.00 60.65 61.82 2vna s ILE 82 Cb -0.13 -3.62 -0.30 0.00 0.01 0.00 0.00 42.46 38.42 2vna s ILE 82 CO 0.03 0.05 0.33 -0.62 0.00 0.00 0.00 174.94 174.73 2vna n GLU 83 N 4.44 0.69 -3.57 2.79 1.02 -0.07 -1.04 120.64 124.90 2vna n GLU 83 Ca 0.12 -0.13 -0.13 0.00 -0.02 0.00 0.00 57.16 57.00 2vna n GLU 83 Cb 0.43 -1.51 -0.06 0.00 -0.02 0.00 0.00 31.44 30.28 2vna n GLU 83 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2vna s GLU 84 N -3.14 0.76 -0.06 3.49 2.12 -1.12 -4.84 118.70 115.92 2vna s GLU 84 Ca -0.08 0.33 -0.08 0.00 0.36 0.00 0.00 54.97 55.49 2vna s GLU 84 Cb 0.11 0.36 0.02 0.00 0.26 0.00 0.00 34.13 34.88 2vna s GLU 84 CO 0.86 -0.21 0.21 -1.54 -0.54 0.00 0.00 175.26 174.04 2vna s SER 85 N -0.81 -0.16 -0.20 -1.70 1.04 -1.26 -0.77 113.70 109.84 2vna s SER 85 Ca -0.04 0.26 0.12 0.00 0.48 0.00 0.00 55.95 56.76 2vna s SER 85 Cb -0.01 0.38 0.42 0.00 0.10 0.00 0.00 66.02 66.90 2vna s SER 85 CO 0.03 -0.18 1.22 0.29 0.98 0.00 0.00 173.24 175.58 2vna n LYS 86 N 2.47 1.55 -4.43 4.02 5.02 -0.35 -4.95 118.16 121.49 2vna n LYS 86 Ca -0.16 -3.26 -0.34 0.00 -2.02 0.00 0.00 58.31 52.53 2vna n LYS 86 Cb 0.58 -1.59 -0.12 0.00 -0.02 0.00 0.00 35.03 33.88 2vna n LYS 86 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2vna s HIS 87 N -3.17 3.03 0.30 2.13 2.46 -1.21 -1.36 115.29 117.48 2vna s HIS 87 Ca 0.38 -0.19 0.00 0.00 0.47 0.00 0.00 55.06 55.72 2vna s HIS 87 Cb 0.37 -1.90 0.48 0.00 -0.13 0.00 0.00 32.58 31.40 2vna s HIS 87 CO -0.07 0.08 1.89 0.00 -2.47 0.00 0.00 174.74 174.17 2vna h THR 88 N 4.89 1.21 -0.11 0.89 1.03 -1.94 -2.19 112.91 116.69 2vna h THR 88 Ca -0.36 -0.65 0.00 0.00 -0.01 0.00 0.00 66.41 65.39 2vna h THR 88 Cb 1.19 0.53 0.00 0.00 -1.07 0.00 0.00 68.15 68.80 2vna h THR 88 CO 0.60 0.26 0.00 0.59 -0.01 0.00 0.00 175.52 176.96 2vna n ASN 89 N -4.33 1.16 -3.99 0.00 5.03 -1.26 -4.85 115.26 107.02 2vna n ASN 89 Ca 0.05 -1.61 -0.17 0.00 0.87 0.00 0.00 54.58 53.72 2vna n ASN 89 Cb 0.17 -0.07 -0.14 0.00 -1.02 0.00 0.00 39.78 38.71 2vna n ASN 89 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2vna s LEU 90 N -1.60 2.02 0.12 3.41 1.43 -0.82 -5.03 118.68 118.20 2vna s LEU 90 Ca 0.31 -0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2vna s LEU 90 Cb 0.16 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 46.00 2vna s LEU 90 CO 0.25 0.08 0.01 0.42 0.23 0.00 0.00 176.35 177.35 2vna s THR 91 N -0.18 0.29 0.12 5.49 -4.23 -1.26 -4.46 115.64 111.41 2vna s THR 91 Ca 0.02 -1.90 -0.35 0.00 -1.18 0.00 0.00 61.69 58.28 2vna s THR 91 Cb -0.03 -1.90 -0.17 0.00 1.34 0.00 0.00 72.50 71.75 2vna s THR 91 CO -0.00 -0.63 1.18 1.17 -0.54 0.00 0.00 174.62 175.80 2vna n LYS 92 N -0.07 0.95 0.00 3.99 4.81 -1.26 -2.04 118.16 124.54 2vna n LYS 92 Ca -0.08 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 2vna n LYS 92 Cb 0.63 -1.87 0.00 0.00 0.02 0.00 0.00 35.03 33.81 2vna n LYS 92 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2vna n GLY 93 N 2.12 1.50 3.76 3.14 0.00 -0.20 -4.99 105.19 110.52 2vna n GLY 93 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2vna n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vna s ASP 94 N -2.03 5.63 -0.19 1.61 1.01 -0.87 -4.77 116.67 117.06 2vna s ASP 94 Ca 0.00 2.69 -0.08 0.00 0.71 0.00 0.00 52.55 55.86 2vna s ASP 94 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 2vna s ASP 94 CO 0.00 -1.32 0.09 -0.36 0.21 0.00 0.00 175.17 173.79 2vna s PHE 95 N -1.33 3.32 0.09 4.23 0.08 -1.26 -1.47 117.98 121.64 2vna s PHE 95 Ca 0.67 0.19 0.02 0.00 0.12 0.00 0.00 56.93 57.93 2vna s PHE 95 Cb -0.38 -2.10 -0.04 0.00 -0.57 0.00 0.00 43.02 39.92 2vna s PHE 95 CO 0.47 0.22 -0.07 0.14 -0.10 0.00 0.00 175.22 175.88 2vna s VAL 96 N 0.32 0.73 0.20 -0.44 -7.23 0.04 -0.31 120.40 113.70 2vna s VAL 96 Ca 0.05 -1.78 0.04 0.00 -1.81 0.00 0.00 61.98 58.48 2vna s VAL 96 Cb -0.12 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.28 2vna s VAL 96 CO -0.01 -0.76 -0.05 0.42 -0.31 0.00 0.00 175.10 174.40 2vna s THR 97 N -3.14 1.13 -0.08 5.32 -4.23 0.06 -1.10 115.64 113.59 2vna s THR 97 Ca 0.08 -2.05 -0.22 0.00 -1.18 0.00 0.00 61.69 58.31 2vna s THR 97 Cb 0.02 -2.14 0.05 0.00 1.34 0.00 0.00 72.50 71.77 2vna s THR 97 CO -0.03 -0.50 0.52 -0.55 -0.54 0.00 0.00 174.62 173.52 2vna s SER 98 N -3.25 -0.48 0.01 3.99 0.15 -0.98 -1.59 113.70 111.55 2vna s SER 98 Ca 0.24 0.62 0.27 0.00 0.70 0.00 0.00 55.95 57.77 2vna s SER 98 Cb 0.04 0.63 0.91 0.00 -1.71 0.00 0.00 66.02 65.89 2vna s SER 98 CO 0.05 -0.44 1.71 0.33 1.20 0.00 0.00 173.24 176.09 2vna n PHE 99 N 1.55 0.06 -2.71 3.44 7.35 -1.26 -1.19 117.46 124.71 2vna n PHE 99 Ca -0.18 0.02 -0.24 0.00 -0.76 0.00 0.00 57.45 56.28 2vna n PHE 99 Cb 0.56 -0.43 -0.01 0.00 0.35 0.00 0.00 39.48 39.95 2vna n PHE 99 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2vna n TYR 100 N -1.55 3.10 -2.81 -5.13 4.01 -1.24 -3.03 117.16 110.50 2vna n TYR 100 Ca 0.06 -3.42 -0.42 0.00 -0.16 0.00 0.00 57.90 53.96 2vna n TYR 100 Cb 0.35 -0.28 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 2vna n TYR 100 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 2vna s TRP 101 N -3.38 3.37 0.39 -0.72 -0.11 0.49 -4.67 118.94 114.30 2vna s TRP 101 Ca 0.45 1.30 -0.27 0.00 1.22 0.00 0.00 56.10 58.80 2vna s TRP 101 Cb 0.36 -3.11 -0.09 0.00 -1.50 0.00 0.00 33.47 29.13 2vna s TRP 101 CO -0.14 -0.36 1.33 -2.14 -4.62 0.00 0.00 176.95 171.02 2vna s PRO 102 N 2.68 4.07 -0.98 5.86 0.02 -1.26 -1.48 135.00 143.90 2vna s PRO 102 Ca 0.39 2.23 -0.24 0.00 0.02 0.00 0.00 61.00 63.41 2vna s PRO 102 Cb -0.16 -2.86 -0.01 0.00 0.02 0.00 0.00 34.50 31.50 2vna s PRO 102 CO 0.09 -0.43 1.76 -1.58 -0.33 0.00 0.00 177.00 176.51 2vna s TRP 103 N -1.21 2.12 -0.11 6.54 0.52 0.14 -4.83 118.94 122.12 2vna s TRP 103 Ca 0.55 -0.02 -0.28 0.00 0.02 0.00 0.00 56.10 56.37 2vna s TRP 103 Cb -0.40 -4.31 0.07 0.00 -1.15 0.00 0.00 33.47 27.68 2vna s TRP 103 CO 0.52 -1.78 0.66 -1.14 0.02 0.00 0.00 176.95 175.23 2vna s GLN 104 N 6.11 0.96 0.09 4.98 0.74 -1.26 -1.64 119.66 129.64 2vna s GLN 104 Ca 0.61 0.43 -0.14 0.00 0.05 0.00 0.00 55.36 56.31 2vna s GLN 104 Cb -0.03 0.46 -0.19 0.00 1.10 0.00 0.00 33.01 34.35 2vna s GLN 104 CO -0.03 -0.25 1.26 1.79 -0.55 0.00 0.00 175.29 177.51 2vna h THR 105 N 3.35 1.28 -4.05 -0.34 1.35 -1.75 -3.42 112.91 109.33 2vna h THR 105 Ca -0.28 -2.06 -0.43 0.00 -0.55 0.00 0.00 66.41 63.09 2vna h THR 105 Cb 1.15 2.14 -0.26 0.00 -1.73 0.00 0.00 68.15 69.45 2vna h THR 105 CO 0.30 0.65 -0.79 -0.54 -0.25 0.00 0.00 175.52 174.89 2vna s LYS 106 N -3.59 0.91 -0.03 4.72 1.02 -1.26 -1.04 119.74 120.47 2vna s LYS 106 Ca -0.10 -0.66 -0.18 0.00 0.02 0.00 0.00 55.97 55.05 2vna s LYS 106 Cb 0.08 -0.89 0.03 0.00 -0.52 0.00 0.00 37.83 36.53 2vna s LYS 106 CO 0.91 0.23 0.38 0.54 -0.92 0.00 0.00 175.35 176.48 2vna s VAL 107 N -0.72 0.04 -0.18 3.17 0.11 -0.73 -4.96 120.40 117.14 2vna s VAL 107 Ca 0.02 -0.37 -0.06 0.00 -2.93 0.00 0.00 61.98 58.64 2vna s VAL 107 Cb -0.07 -0.68 -0.03 0.00 -1.53 0.00 0.00 36.38 34.07 2vna s VAL 107 CO 0.01 -0.20 0.02 -0.63 -3.33 0.00 0.00 175.10 170.96 2vna s ILE 108 N -1.24 4.36 0.23 7.04 1.01 -1.26 -0.67 121.20 130.66 2vna s ILE 108 Ca -0.13 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.37 2vna s ILE 108 Cb -0.04 -2.95 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 2vna s ILE 108 CO 0.05 0.46 -0.00 -0.76 0.00 0.00 0.00 174.94 174.69 2vna s LEU 109 N 0.50 2.19 -0.14 2.97 1.43 -0.30 -4.99 118.68 120.35 2vna s LEU 109 Ca 0.00 -1.21 -0.29 0.00 -1.03 0.00 0.00 54.13 51.60 2vna s LEU 109 Cb -0.13 -0.26 -0.01 0.00 0.03 0.00 0.00 46.19 45.82 2vna s LEU 109 CO 0.02 -0.51 1.01 -0.62 0.23 0.00 0.00 176.35 176.47 2vna s ASP 110 N -3.30 7.20 0.50 2.29 -1.08 -1.26 -1.54 116.67 119.48 2vna s ASP 110 Ca 0.28 1.48 0.26 0.00 -0.52 0.00 0.00 52.55 54.05 2vna s ASP 110 Cb 0.06 -2.55 1.39 0.00 -1.46 0.00 0.00 42.92 40.36 2vna s ASP 110 CO 0.08 -0.50 1.76 1.23 0.52 0.00 0.00 175.17 178.26 2vna h GLY 111 N 8.37 0.00 1.60 2.66 0.00 -0.81 -1.44 103.07 113.46 2vna h GLY 111 Ca -0.28 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.90 2vna h GLY 111 CO 0.88 0.00 -0.93 3.43 0.00 0.00 0.00 176.54 179.93 2vna h ASN 112 N 0.00 0.00 0.28 0.19 2.35 -1.92 -3.26 115.58 113.22 2vna h ASN 112 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2vna h ASN 112 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2vna h ASN 112 CO 0.00 0.61 0.00 -1.54 -1.65 0.00 0.00 177.43 174.85 2vna n SER 113 N -3.11 0.00 -4.82 5.81 3.41 -0.54 -4.80 113.62 109.56 2vna n SER 113 Ca -0.03 -0.28 -0.26 0.00 -0.26 0.00 0.00 58.87 58.03 2vna n SER 113 Cb 0.81 -0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.52 2vna n SER 113 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2vna s LEU 114 N -2.37 3.89 -0.05 1.04 1.43 -1.23 -4.60 118.68 116.79 2vna s LEU 114 Ca 0.27 -0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 2vna s LEU 114 Cb 0.16 -2.49 0.01 0.00 0.03 0.00 0.00 46.19 43.89 2vna s LEU 114 CO 0.32 0.06 -0.11 -1.61 0.23 0.00 0.00 176.35 175.25 2vna s GLU 115 N -3.13 1.46 0.05 1.70 8.01 -0.62 -4.96 118.70 121.20 2vna s GLU 115 Ca 0.32 -0.38 -0.31 0.00 0.01 0.00 0.00 54.97 54.61 2vna s GLU 115 Cb -0.10 -1.25 -0.06 0.00 -4.31 0.00 0.00 34.13 28.40 2vna s GLU 115 CO 0.24 0.06 1.37 0.21 0.01 0.00 0.00 175.26 177.14 2vna s LYS 116 N 0.53 4.32 0.14 1.61 2.47 -1.26 -0.77 119.74 126.78 2vna s LYS 116 Ca -0.11 1.97 0.05 0.00 -1.56 0.00 0.00 55.97 56.32 2vna s LYS 116 Cb -0.14 -3.43 -0.04 0.00 -1.46 0.00 0.00 37.83 32.76 2vna s LYS 116 CO 0.02 -0.48 0.09 0.14 0.16 0.00 0.00 175.35 175.28 2vna s VAL 117 N 1.78 4.34 -0.54 4.02 -7.23 0.57 -4.96 120.40 118.38 2vna s VAL 117 Ca 0.63 -1.04 -0.09 0.00 -1.81 0.00 0.00 61.98 59.67 2vna s VAL 117 Cb -0.33 -3.16 0.14 0.00 0.56 0.00 0.00 36.38 33.59 2vna s VAL 117 CO 0.28 -0.03 0.41 -0.62 -0.31 0.00 0.00 175.10 174.84 2vna s ASP 118 N -2.82 5.75 0.66 4.85 2.15 -1.26 -4.53 116.67 121.46 2vna s ASP 118 Ca 0.29 -2.18 0.18 0.00 0.43 0.00 0.00 52.55 51.27 2vna s ASP 118 Cb -0.11 -2.01 0.95 0.00 -0.30 0.00 0.00 42.92 41.45 2vna s ASP 118 CO 0.22 -0.62 1.53 1.55 -0.17 0.00 0.00 175.17 177.68 2vna h PRO 119 N 8.11 0.00 0.00 4.34 0.13 -1.98 0.49 132.00 143.10 2vna h PRO 119 Ca -0.14 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.99 2vna h PRO 119 Cb 1.05 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 2vna h PRO 119 CO 0.82 0.00 -0.00 1.96 -0.23 0.00 0.00 178.00 180.55 2vna h GLN 120 N 0.00 0.00 0.00 0.86 7.50 -1.96 -0.79 115.11 120.72 2vna h GLN 120 Ca 0.02 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.10 2vna h GLN 120 Cb 1.28 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.80 2vna h GLN 120 CO -0.00 0.00 -0.34 -0.07 -1.50 0.00 0.00 178.83 176.92 2vna h LEU 121 N 0.00 0.00 -3.02 1.46 3.38 -0.43 -3.14 115.31 113.56 2vna h LEU 121 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vna h LEU 121 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2vna h LEU 121 CO 0.00 0.34 0.00 1.33 0.09 0.00 0.00 178.44 180.20 2vna n VAL 122 N -3.97 1.52 -3.81 1.22 0.24 -0.77 -4.74 118.33 108.01 2vna n VAL 122 Ca -0.02 -1.60 -0.26 0.00 -2.04 0.00 0.00 64.34 60.42 2vna n VAL 122 Cb 0.40 0.12 0.03 0.00 -1.47 0.00 0.00 33.84 32.92 2vna n VAL 122 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2vna n ASP 123 N -0.72 -3.75 0.00 -1.34 8.00 -0.58 -1.31 116.55 116.85 2vna n ASP 123 Ca 0.11 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.84 2vna n ASP 123 Cb 0.51 -4.08 0.00 0.00 -0.02 0.00 0.00 41.12 37.53 2vna n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vna n GLY 124 N -1.68 0.94 3.18 0.44 0.00 -0.41 -4.92 105.19 102.74 2vna n GLY 124 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2vna n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2vna n HIS 125 N -2.00 4.03 -0.27 1.61 8.25 -0.43 -4.87 115.22 121.54 2vna n HIS 125 Ca 0.00 -3.05 0.14 0.00 -0.26 0.00 0.00 57.72 54.55 2vna n HIS 125 Cb 0.00 -2.18 0.42 0.00 1.12 0.00 0.00 29.99 29.35 2vna n HIS 125 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2vna h LEU 126 N 9.33 0.58 -2.15 2.41 3.38 -1.91 -1.35 115.31 125.60 2vna h LEU 126 Ca 0.39 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.45 2vna h LEU 126 Cb 0.76 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2vna h LEU 126 CO 1.47 0.27 0.15 0.77 0.09 0.00 0.00 178.44 181.19 2vna h SER 127 N 0.60 0.00 -0.03 -0.43 4.64 -1.97 -0.86 113.55 115.50 2vna h SER 127 Ca 0.47 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.79 2vna h SER 127 Cb 0.88 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2vna h SER 127 CO -0.21 0.00 0.04 1.88 -0.87 0.00 0.00 176.83 177.66 2vna h TYR 128 N 0.00 0.00 0.00 4.77 0.05 -1.62 0.09 116.97 120.26 2vna h TYR 128 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 2vna h TYR 128 Cb 0.38 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.12 2vna h TYR 128 CO 0.00 0.00 0.00 1.19 -1.05 0.00 0.00 178.16 178.30 2vna n PHE 129 N -3.62 0.55 0.42 4.88 3.72 -0.33 -0.94 117.46 122.15 2vna n PHE 129 Ca -0.02 0.26 0.08 0.00 -0.05 0.00 0.00 57.45 57.72 2vna n PHE 129 Cb 0.12 -0.92 0.11 0.00 -0.94 0.00 0.00 39.48 37.84 2vna n PHE 129 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2vna n LEU 130 N -2.05 2.58 0.00 4.37 4.77 0.02 -3.83 117.00 122.87 2vna n LEU 130 Ca 0.00 -1.26 0.00 0.00 -0.03 0.00 0.00 56.01 54.72 2vna n LEU 130 Cb 0.09 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2vna n LEU 130 CO 0.11 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 2vna n GLY 131 N 0.90 2.52 0.22 -0.72 0.00 -0.71 -4.61 105.19 102.79 2vna n GLY 131 Ca 0.11 -0.29 0.07 0.00 0.00 0.00 0.00 46.02 45.90 2vna n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vna h ALA 132 N 1.00 1.42 -0.69 4.61 0.00 -1.87 0.49 119.26 124.22 2vna h ALA 132 Ca 0.00 -0.22 -0.44 0.00 0.00 0.00 0.00 54.91 54.25 2vna h ALA 132 Cb 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 17.79 17.49 2vna h ALA 132 CO 0.00 0.30 0.03 -0.89 0.00 0.00 0.00 179.25 178.69 2vna n ILE 133 N -3.98 2.89 -2.07 0.00 2.08 -0.11 -4.12 119.36 114.04 2vna n ILE 133 Ca -0.02 -3.12 0.00 0.00 0.56 0.00 0.00 62.75 60.17 2vna n ILE 133 Cb 0.32 -0.77 0.00 0.00 -0.75 0.00 0.00 39.64 38.44 2vna n ILE 133 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2vna n GLY 134 N -0.97 5.28 0.22 7.39 0.00 0.10 -4.29 105.19 112.92 2vna n GLY 134 Ca 0.46 -1.14 -0.01 0.00 0.00 0.00 0.00 46.02 45.33 2vna n GLY 134 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2vna h MET 135 N 0.00 0.09 -0.17 1.61 1.85 -1.76 -0.40 114.93 116.15 2vna h MET 135 Ca 0.00 -0.01 -0.08 0.00 -0.61 0.00 0.00 59.70 59.00 2vna h MET 135 Cb 0.00 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.00 2vna h MET 135 CO 0.00 0.06 -0.27 -1.35 -0.40 0.00 0.00 176.91 174.95 2vna h PRO 136 N 0.09 0.31 -0.17 0.39 0.11 -1.81 0.14 132.00 131.07 2vna h PRO 136 Ca 0.28 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 66.24 2vna h PRO 136 Cb 0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 2vna h PRO 136 CO -0.49 0.57 -0.06 0.78 -0.21 0.00 0.00 178.00 178.58 2vna h GLY 137 N 1.02 0.36 0.59 -0.55 0.00 -0.66 -2.41 103.07 101.42 2vna h GLY 137 Ca 0.04 -0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.11 2vna h GLY 137 CO 0.05 0.29 0.03 1.41 0.00 0.00 0.00 176.54 178.31 2vna h LEU 138 N 0.03 -0.06 -0.55 3.11 3.38 -1.01 -0.50 115.31 119.70 2vna h LEU 138 Ca 0.04 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.16 2vna h LEU 138 Cb 0.52 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.28 2vna h LEU 138 CO 0.02 0.00 0.13 0.74 0.09 0.00 0.00 178.44 179.42 2vna h THR 139 N 0.12 0.69 0.08 0.22 2.02 -0.86 0.39 112.91 115.58 2vna h THR 139 Ca 0.14 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 2vna h THR 139 Cb 0.17 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2vna h THR 139 CO -0.21 0.05 -0.04 0.28 0.37 0.00 0.00 175.52 175.97 2vna h SER 140 N 0.27 -0.09 -0.18 4.18 0.02 -1.07 0.11 113.55 116.79 2vna h SER 140 Ca 0.28 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2vna h SER 140 Cb 0.39 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 2vna h SER 140 CO -0.35 0.13 -0.00 0.25 -1.14 0.00 0.00 176.83 175.71 2vna h LEU 141 N -0.30 0.31 -0.45 5.07 5.85 -0.63 -0.76 115.31 124.40 2vna h LEU 141 Ca -0.01 -0.31 -0.12 0.00 0.84 0.00 0.00 57.88 58.27 2vna h LEU 141 Cb 0.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2vna h LEU 141 CO 0.02 0.55 -0.20 0.40 -0.34 0.00 0.00 178.44 178.87 2vna h ILE 142 N 0.06 1.27 0.01 4.05 2.04 -0.30 -1.26 117.51 123.39 2vna h ILE 142 Ca 0.05 -1.35 0.02 0.00 1.00 0.00 0.00 64.86 64.58 2vna h ILE 142 Cb 0.39 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2vna h ILE 142 CO 0.01 0.46 -0.15 1.23 0.00 0.00 0.00 178.15 179.70 2vna h GLY 143 N 0.76 -0.20 0.84 5.37 0.00 -0.72 0.30 103.07 109.42 2vna h GLY 143 Ca 0.10 0.18 0.04 0.00 0.00 0.00 0.00 47.33 47.65 2vna h GLY 143 CO 0.06 -0.15 0.56 -2.22 0.00 0.00 0.00 176.54 174.79 2vna h ILE 144 N -0.26 1.12 0.02 2.60 2.04 -1.09 0.94 117.51 122.88 2vna h ILE 144 Ca 0.05 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 2vna h ILE 144 Cb 0.31 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2vna h ILE 144 CO -0.14 0.20 -0.01 -0.61 0.00 0.00 0.00 178.15 177.59 2vna h GLN 145 N 1.07 -0.02 0.00 2.37 5.75 -0.75 -0.02 115.11 123.51 2vna h GLN 145 Ca 0.36 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.75 2vna h GLN 145 Cb 0.05 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 2vna h GLN 145 CO -0.13 0.12 -0.88 0.93 -2.65 0.00 0.00 178.83 176.22 2vna h GLU 146 N -0.17 0.00 0.00 1.69 4.39 -0.26 -3.40 114.58 116.83 2vna h GLU 146 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2vna h GLU 146 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2vna h GLU 146 CO 0.00 0.34 -0.38 1.63 -1.16 0.00 0.00 179.01 179.44 2vna n LYS 147 N -3.03 3.33 0.08 2.33 4.76 0.31 -4.79 118.16 121.15 2vna n LYS 147 Ca -0.03 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.29 2vna n LYS 147 Cb 0.75 -0.63 -0.13 0.00 -1.84 0.00 0.00 35.03 33.18 2vna n LYS 147 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2vna h GLY 148 N 0.00 0.17 -6.29 0.72 0.00 -0.90 -3.44 103.07 93.33 2vna h GLY 148 Ca 0.00 -0.44 -0.47 0.00 0.00 0.00 0.00 47.33 46.41 2vna h GLY 148 CO 0.00 0.39 -0.77 1.42 0.00 0.00 0.00 176.54 177.58 2vna n HIS 149 N -3.45 -2.23 -2.92 5.60 8.25 -1.24 -4.80 115.22 114.43 2vna n HIS 149 Ca -0.05 0.89 -0.41 0.00 -0.26 0.00 0.00 57.72 57.90 2vna n HIS 149 Cb 0.99 -4.00 -0.04 0.00 1.12 0.00 0.00 29.99 28.05 2vna n HIS 149 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2vna s ILE 150 N -3.36 4.95 0.08 1.59 1.01 -1.26 -5.06 121.20 119.14 2vna s ILE 150 Ca 0.57 1.64 0.05 0.00 0.00 0.00 0.00 60.65 62.91 2vna s ILE 150 Cb -0.28 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 2vna s ILE 150 CO 0.83 0.14 -0.02 -0.89 0.00 0.00 0.00 174.94 175.00 2vna s THR 151 N 1.38 3.88 0.16 2.92 2.01 -1.26 -5.06 115.64 119.66 2vna s THR 151 Ca 0.41 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.10 2vna s THR 151 Cb -0.18 -2.82 -0.07 0.00 0.01 0.00 0.00 72.50 69.43 2vna s THR 151 CO 0.18 0.15 1.15 0.00 -0.69 0.00 0.00 174.62 175.41 2vna s ALA 152 N -1.26 3.40 0.00 7.40 0.00 -1.26 -2.71 121.76 127.32 2vna s ALA 152 Ca 0.24 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.07 2vna s ALA 152 Cb -0.12 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2vna s ALA 152 CO 0.16 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2vna n GLY 153 N 2.33 0.38 3.96 0.00 0.00 -1.26 -5.07 105.19 105.52 2vna n GLY 153 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 2vna n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vna s SER 154 N -2.03 6.26 -0.43 1.61 1.04 -1.10 -5.04 113.70 114.00 2vna s SER 154 Ca 0.00 0.23 0.10 0.00 0.48 0.00 0.00 55.95 56.76 2vna s SER 154 Cb 0.00 -1.87 0.39 0.00 0.10 0.00 0.00 66.02 64.63 2vna s SER 154 CO 0.00 -0.23 0.92 0.59 0.98 0.00 0.00 173.24 175.50 2vna n ASN 155 N -1.63 2.83 -4.79 7.02 3.02 -1.26 -4.68 115.26 115.78 2vna n ASN 155 Ca -0.06 -3.29 -0.34 0.00 -0.03 0.00 0.00 54.58 50.86 2vna n ASN 155 Cb 0.57 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2vna n ASN 155 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2vna s LYS 156 N -3.12 3.35 -0.12 3.52 1.02 -1.26 -4.37 119.74 118.77 2vna s LYS 156 Ca 0.41 1.39 -0.13 0.00 0.02 0.00 0.00 55.97 57.66 2vna s LYS 156 Cb 0.36 -2.03 -0.05 0.00 -0.52 0.00 0.00 37.83 35.60 2vna s LYS 156 CO -0.09 -0.81 0.30 0.99 -0.92 0.00 0.00 175.35 174.82 2vna s THR 157 N -2.12 5.28 -0.02 2.17 2.01 -1.26 -1.79 115.64 119.89 2vna s THR 157 Ca 0.68 0.57 0.04 0.00 0.31 0.00 0.00 61.69 63.28 2vna s THR 157 Cb -0.19 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.67 2vna s THR 157 CO 0.31 0.46 -0.13 -0.32 -0.69 0.00 0.00 174.62 174.24 2vna s MET 158 N -0.07 2.44 -0.05 4.92 1.75 0.42 -1.06 119.30 127.66 2vna s MET 158 Ca 0.18 -0.75 0.05 0.00 -1.25 0.00 0.00 55.69 53.93 2vna s MET 158 Cb -0.14 -2.37 -0.02 0.00 2.84 0.00 0.00 34.83 35.14 2vna s MET 158 CO 0.06 0.61 -0.20 0.08 -0.65 0.00 0.00 175.02 174.91 2vna s VAL 159 N -0.82 2.52 -0.16 10.11 1.01 0.12 -1.08 120.40 132.11 2vna s VAL 159 Ca 0.13 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.20 2vna s VAL 159 Cb -0.11 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.33 2vna s VAL 159 CO 0.03 0.58 -0.16 -0.69 0.00 0.00 0.00 175.10 174.85 2vna s VAL 160 N -0.49 2.56 0.59 2.92 1.01 0.18 -0.14 120.40 127.02 2vna s VAL 160 Ca 0.06 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 2vna s VAL 160 Cb -0.11 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.21 2vna s VAL 160 CO 0.01 0.52 0.87 -0.94 0.00 0.00 0.00 175.10 175.56 2vna s SER 161 N 0.87 5.37 -1.63 3.32 1.04 -0.17 -0.94 113.70 121.57 2vna s SER 161 Ca -0.04 0.45 -0.15 0.00 0.48 0.00 0.00 55.95 56.69 2vna s SER 161 Cb -0.15 -1.37 0.12 0.00 0.10 0.00 0.00 66.02 64.72 2vna s SER 161 CO -0.01 -1.16 0.77 0.61 0.98 0.00 0.00 173.24 174.42 2vna n GLY 162 N -2.55 -0.42 0.00 7.32 0.00 -1.01 -4.23 105.19 104.31 2vna n GLY 162 Ca 0.06 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.33 2vna n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vna n ALA 163 N -4.44 2.06 -0.45 4.61 0.00 -0.88 -1.80 120.51 119.61 2vna n ALA 163 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 53.44 53.41 2vna n ALA 163 Cb 0.53 -1.36 0.08 0.00 0.00 0.00 0.00 19.45 18.69 2vna n ALA 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vna n ALA 164 N -1.43 2.17 -1.64 0.00 0.00 -1.26 -1.86 120.51 116.49 2vna n ALA 164 Ca 0.07 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.85 2vna n ALA 164 Cb 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2vna n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vna n GLY 165 N -0.74 0.06 0.10 0.00 0.00 -0.74 0.13 105.19 104.00 2vna n GLY 165 Ca 0.08 -1.82 -0.04 0.00 0.00 0.00 0.00 46.02 44.24 2vna n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vna h ALA 166 N -1.22 -1.04 -0.38 4.61 0.00 -1.85 -1.87 119.26 117.50 2vna h ALA 166 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.92 2vna h ALA 166 Cb 0.00 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2vna h ALA 166 CO 0.00 -1.02 0.03 0.00 0.00 0.00 0.00 179.25 178.26 2vna h GLY 168 N 0.14 0.95 1.54 0.00 0.00 -1.64 0.17 103.07 104.23 2vna h GLY 168 Ca 0.19 -0.91 -0.05 0.00 0.00 0.00 0.00 47.33 46.55 2vna h GLY 168 CO -0.28 0.83 0.02 1.48 0.00 0.00 0.00 176.54 178.59 2vna h SER 169 N 0.73 0.54 0.04 0.19 4.64 -0.58 -2.41 113.55 116.70 2vna h SER 169 Ca 0.08 -0.10 -0.20 0.00 -0.47 0.00 0.00 61.79 61.10 2vna h SER 169 Cb 0.89 -0.14 0.02 0.00 -0.31 0.00 0.00 62.40 62.85 2vna h SER 169 CO 0.08 0.60 -0.80 0.58 -0.87 0.00 0.00 176.83 176.41 2vna h VAL 170 N 0.56 1.39 -0.79 0.95 2.07 -1.51 -3.29 116.25 115.63 2vna h VAL 170 Ca 0.12 -2.23 0.08 0.00 0.82 0.00 0.00 66.70 65.50 2vna h VAL 170 Cb 0.32 2.66 -0.07 0.00 -1.52 0.00 0.00 31.29 32.68 2vna h VAL 170 CO 0.01 0.66 0.45 0.00 0.02 0.00 0.00 177.57 178.71 2vna h ALA 171 N 0.29 1.11 0.00 1.67 0.00 -0.35 -1.73 119.26 120.25 2vna h ALA 171 Ca -0.11 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2vna h ALA 171 Cb 1.52 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2vna h ALA 171 CO 0.16 0.10 -0.36 0.78 0.00 0.00 0.00 179.25 179.94 2vna h GLY 172 N 0.78 0.00 1.03 0.00 0.00 -1.55 -0.55 103.07 102.79 2vna h GLY 172 Ca 0.37 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.43 2vna h GLY 172 CO -0.23 0.00 -1.15 1.46 0.00 0.00 0.00 176.54 176.62 2vna h GLN 173 N 0.00 0.48 -0.80 4.80 4.20 -1.49 -3.25 115.11 119.04 2vna h GLN 173 Ca -0.00 -0.74 0.08 0.00 0.06 0.00 0.00 58.65 58.04 2vna h GLN 173 Cb 0.89 0.27 -0.05 0.00 0.30 0.00 0.00 27.48 28.88 2vna h GLN 173 CO 0.05 1.34 0.52 0.82 -0.67 0.00 0.00 178.83 180.89 2vna h ILE 174 N -0.01 1.00 -0.44 2.54 2.04 -1.10 -0.80 117.51 120.75 2vna h ILE 174 Ca -0.19 -0.28 0.08 0.00 1.00 0.00 0.00 64.86 65.47 2vna h ILE 174 Cb 1.88 0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 38.01 2vna h ILE 174 CO 0.22 0.15 0.02 1.23 0.00 0.00 0.00 178.15 179.77 2vna h GLY 175 N 0.82 0.47 0.85 5.37 0.00 -1.16 -0.35 103.07 109.08 2vna h GLY 175 Ca 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 2vna h GLY 175 CO -0.13 -0.10 -0.14 0.45 0.00 0.00 0.00 176.54 176.61 2vna h HIS 176 N 0.14 -0.37 -1.10 5.60 3.86 -1.24 -1.42 115.15 120.62 2vna h HIS 176 Ca 0.22 -0.01 0.32 0.00 -1.16 0.00 0.00 60.37 59.74 2vna h HIS 176 Cb 0.31 0.12 -0.12 0.00 1.06 0.00 0.00 27.41 28.79 2vna h HIS 176 CO -0.27 -0.13 0.69 0.74 0.86 0.00 0.00 177.93 179.82 2vna h PHE 177 N -0.56 0.71 -0.61 2.45 0.04 -0.82 0.27 116.94 118.41 2vna h PHE 177 Ca -0.04 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2vna h PHE 177 Cb 0.41 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.37 2vna h PHE 177 CO -0.02 -0.05 0.00 1.28 -0.60 0.00 0.00 178.31 178.92 2vna n LEU 178 N -4.74 3.40 0.00 1.54 4.77 -0.18 -4.94 117.00 116.85 2vna n LEU 178 Ca 0.30 -1.70 0.00 0.00 -0.03 0.00 0.00 56.01 54.58 2vna n LEU 178 Cb 1.02 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2vna n LEU 178 CO 0.21 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2vna n GLY 179 N 1.44 1.37 3.79 -0.72 0.00 0.96 -4.48 105.19 107.55 2vna n GLY 179 Ca 0.21 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2vna n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vna n SER 181 N -0.65 0.63 -3.67 0.00 3.41 -0.74 -4.67 113.62 107.94 2vna n SER 181 Ca 0.08 -0.44 -0.08 0.00 -0.26 0.00 0.00 58.87 58.17 2vna n SER 181 Cb 0.52 0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 64.84 2vna n SER 181 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2vna s ARG 182 N -3.01 0.44 -0.10 4.33 3.52 -1.19 -5.04 118.95 117.91 2vna s ARG 182 Ca 0.10 1.06 0.03 0.00 -0.13 0.00 0.00 55.73 56.78 2vna s ARG 182 Cb 0.17 0.28 0.01 0.00 -1.56 0.00 0.00 34.95 33.85 2vna s ARG 182 CO 0.75 -0.20 -0.18 0.08 -0.81 0.00 0.00 175.30 174.94 2vna s VAL 183 N 2.15 1.66 -0.04 7.11 1.01 -1.26 -0.43 120.40 130.59 2vna s VAL 183 Ca -0.06 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.20 2vna s VAL 183 Cb -0.10 -1.48 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 2vna s VAL 183 CO -0.15 0.47 -0.17 -0.69 0.00 0.00 0.00 175.10 174.57 2vna s VAL 184 N 0.72 1.38 -0.05 2.92 1.01 -0.24 -0.67 120.40 125.47 2vna s VAL 184 Ca -0.12 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2vna s VAL 184 Cb -0.16 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 2vna s VAL 184 CO 0.02 0.40 -0.10 -0.83 0.00 0.00 0.00 175.10 174.59 2vna s GLY 185 N 0.02 1.64 -0.15 4.51 0.00 0.46 -0.65 107.32 113.15 2vna s GLY 185 Ca -0.03 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.76 2vna s GLY 185 CO 0.02 -0.75 -0.20 -0.42 0.00 0.00 0.00 173.10 171.75 2vna s ILE 186 N -0.81 1.96 0.29 0.90 1.01 -0.12 0.72 121.20 125.15 2vna s ILE 186 Ca 0.13 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.91 2vna s ILE 186 Cb -0.11 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 2vna s ILE 186 CO 0.02 0.53 0.27 0.00 0.00 0.00 0.00 174.94 175.76 2vna n GLY 188 N -0.50 2.40 3.13 0.00 0.00 -1.26 -1.78 105.19 107.18 2vna n GLY 188 Ca 0.05 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 2vna n GLY 188 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vna s THR 189 N -1.06 0.13 0.15 2.61 -4.23 -1.26 -4.71 115.64 107.27 2vna s THR 189 Ca 0.43 -1.10 -0.12 0.00 -1.18 0.00 0.00 61.69 59.71 2vna s THR 189 Cb 0.23 -0.94 0.03 0.00 1.34 0.00 0.00 72.50 73.16 2vna s THR 189 CO 0.30 -0.61 1.63 0.45 -0.54 0.00 0.00 174.62 175.85 2vna h HIS 190 N 3.58 0.93 -0.84 3.99 -0.00 -1.99 -2.27 115.15 118.55 2vna h HIS 190 Ca -0.33 -0.14 0.09 0.00 -0.00 0.00 0.00 60.37 60.00 2vna h HIS 190 Cb 1.18 -0.25 -0.06 0.00 -0.00 0.00 0.00 27.41 28.28 2vna h HIS 190 CO 0.53 0.84 0.54 1.49 -0.00 0.00 0.00 177.93 181.34 2vna h GLU 191 N 0.75 0.80 -0.37 2.45 4.81 -2.01 -1.98 114.58 119.03 2vna h GLU 191 Ca 0.15 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 2vna h GLU 191 Cb 0.43 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 2vna h GLU 191 CO 0.01 0.53 -0.35 0.87 -0.73 0.00 0.00 179.01 179.34 2vna h LYS 192 N 0.83 0.86 -0.67 1.92 1.57 -1.89 -2.86 116.57 116.33 2vna h LYS 192 Ca 0.38 -0.43 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2vna h LYS 192 Cb 0.38 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 2vna h LYS 192 CO -0.15 1.07 0.44 0.00 -0.57 0.00 0.00 179.45 180.24 2vna h ILE 194 N 0.72 1.31 -0.71 0.00 2.04 -1.26 -2.38 117.51 117.23 2vna h ILE 194 Ca 0.28 -1.05 0.16 0.00 1.00 0.00 0.00 64.86 65.25 2vna h ILE 194 Cb 0.20 1.77 -0.12 0.00 -0.74 0.00 0.00 36.82 37.92 2vna h ILE 194 CO -0.09 0.30 0.03 0.25 0.00 0.00 0.00 178.15 178.64 2vna h LEU 195 N -0.10 -0.27 -0.16 1.44 5.85 -1.31 0.58 115.31 121.33 2vna h LEU 195 Ca 0.03 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2vna h LEU 195 Cb 0.49 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 2vna h LEU 195 CO 0.02 -0.14 0.01 -0.07 -0.34 0.00 0.00 178.44 177.91 2vna h LEU 196 N 0.13 0.28 0.02 2.25 3.38 -1.15 0.17 115.31 120.39 2vna h LEU 196 Ca 0.39 -0.30 -0.22 0.00 0.09 0.00 0.00 57.88 57.84 2vna h LEU 196 Cb 0.67 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2vna h LEU 196 CO -0.61 0.51 -1.06 0.71 0.09 0.00 0.00 178.44 178.09 2vna h THR 197 N 0.04 1.66 0.00 0.22 1.35 -1.15 0.18 112.91 115.22 2vna h THR 197 Ca 0.05 -3.35 -0.26 0.00 -0.55 0.00 0.00 66.41 62.29 2vna h THR 197 Cb 0.36 2.86 -0.05 0.00 -1.73 0.00 0.00 68.15 69.59 2vna h THR 197 CO 0.01 0.96 -2.24 -1.54 -0.25 0.00 0.00 175.52 172.45 2vna n SER 198 N -3.38 0.04 -0.06 5.36 3.41 0.17 -4.18 113.62 114.99 2vna n SER 198 Ca -0.02 0.02 -0.12 0.00 -0.26 0.00 0.00 58.87 58.50 2vna n SER 198 Cb 0.96 1.22 -0.04 0.00 -0.26 0.00 0.00 64.21 66.08 2vna n SER 198 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2vna n GLU 199 N -2.63 0.25 -0.07 4.33 1.02 0.45 -4.67 120.64 119.33 2vna n GLU 199 Ca -0.24 0.10 0.11 0.00 -0.02 0.00 0.00 57.16 57.11 2vna n GLU 199 Cb 0.99 -0.98 0.39 0.00 -0.02 0.00 0.00 31.44 31.82 2vna n GLU 199 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2vna n LEU 200 N -3.38 1.63 -2.18 -4.62 4.77 -0.39 -4.95 117.00 107.87 2vna n LEU 200 Ca -0.22 -0.67 -0.20 0.00 -0.03 0.00 0.00 56.01 54.88 2vna n LEU 200 Cb 0.67 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 2vna n LEU 200 CO 0.03 0.34 -0.24 0.61 -1.33 0.00 0.00 177.39 176.80 2vna n GLY 201 N 1.13 0.16 3.77 -0.72 0.00 -0.43 -4.67 105.19 104.42 2vna n GLY 201 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2vna n GLY 201 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vna s PHE 202 N -2.92 2.81 0.35 1.61 2.99 0.52 -4.89 117.98 118.45 2vna s PHE 202 Ca 0.00 1.27 0.19 0.00 0.00 0.00 0.00 56.93 58.40 2vna s PHE 202 Cb 0.00 -3.86 1.00 0.00 0.00 0.00 0.00 43.02 40.16 2vna s PHE 202 CO 0.00 -2.47 1.91 -0.44 -0.00 0.00 0.00 175.22 174.22 2vna h ASP 203 N 3.24 0.00 -5.00 1.36 3.32 -1.21 -3.38 116.42 114.75 2vna h ASP 203 Ca -0.50 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.47 2vna h ASP 203 Cb 1.23 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.59 2vna h ASP 203 CO 0.65 0.26 0.00 0.00 -1.72 0.00 0.00 179.24 178.43 2vna s ALA 204 N -4.11 -1.35 -0.04 3.45 0.00 -1.11 -5.01 121.76 113.58 2vna s ALA 204 Ca -0.02 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.81 2vna s ALA 204 Cb 0.13 0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.36 2vna s ALA 204 CO 0.66 -0.35 -0.07 0.00 0.00 0.00 0.00 175.76 176.00 2vna s ALA 205 N -1.44 0.80 -0.01 0.00 0.00 -1.26 -0.40 121.76 119.45 2vna s ALA 205 Ca -0.11 -0.18 0.08 0.00 0.00 0.00 0.00 51.96 51.75 2vna s ALA 205 Cb -0.02 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 2vna s ALA 205 CO 0.06 0.05 -0.24 0.42 0.00 0.00 0.00 175.76 176.05 2vna s ILE 206 N 0.66 1.93 -0.36 0.00 1.01 0.22 -4.93 121.20 119.72 2vna s ILE 206 Ca -0.10 -1.09 -0.14 0.00 0.00 0.00 0.00 60.65 59.33 2vna s ILE 206 Cb -0.13 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.72 2vna s ILE 206 CO 0.01 0.50 0.26 0.21 0.00 0.00 0.00 174.94 175.93 2vna s ASN 207 N -0.68 6.08 0.06 3.58 3.84 -1.26 -0.90 114.94 125.66 2vna s ASN 207 Ca 0.10 -0.54 0.24 0.00 0.21 0.00 0.00 52.86 52.86 2vna s ASN 207 Cb -0.09 -2.15 0.97 0.00 -0.55 0.00 0.00 41.25 39.43 2vna s ASN 207 CO -0.00 -0.30 1.75 0.00 -2.79 0.00 0.00 177.10 175.75 2vna n TYR 208 N 5.14 0.22 -0.00 0.43 0.18 -0.73 -1.24 117.16 121.15 2vna n TYR 208 Ca -0.12 0.07 -0.10 0.00 1.88 0.00 0.00 57.90 59.63 2vna n TYR 208 Cb 0.49 -0.62 -0.14 0.00 -0.38 0.00 0.00 39.34 38.70 2vna n TYR 208 CO 0.00 0.00 0.00 0.87 -2.08 0.00 0.00 176.86 175.65 2vna h LYS 209 N 0.00 0.05 0.00 -3.48 1.57 -1.84 -3.41 116.57 109.46 2vna h LYS 209 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2vna h LYS 209 Cb 0.45 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2vna h LYS 209 CO 0.00 0.68 0.00 1.63 -0.57 0.00 0.00 179.45 181.19 2vna n LYS 210 N -3.16 2.39 -4.24 3.15 4.01 -1.18 -5.05 118.16 114.08 2vna n LYS 210 Ca -0.16 -0.21 -0.24 0.00 -0.51 0.00 0.00 58.31 57.18 2vna n LYS 210 Cb 1.04 -0.67 -0.08 0.00 -0.51 0.00 0.00 35.03 34.81 2vna n LYS 210 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2vna s ASP 211 N -0.40 4.36 -0.55 4.39 1.01 -0.37 -5.06 116.67 120.05 2vna s ASP 211 Ca 0.00 -0.95 -0.20 0.00 0.71 0.00 0.00 52.55 52.11 2vna s ASP 211 Cb 0.00 -0.58 0.07 0.00 1.01 0.00 0.00 42.92 43.42 2vna s ASP 211 CO 0.00 -0.31 0.71 0.54 0.21 0.00 0.00 175.17 176.32 2vna s ASN 212 N -3.78 6.22 0.17 0.27 2.20 -1.26 -4.80 114.94 113.95 2vna s ASN 212 Ca 0.37 -0.99 -0.14 0.00 -0.94 0.00 0.00 52.86 51.15 2vna s ASN 212 Cb 0.00 -2.32 0.05 0.00 -2.00 0.00 0.00 41.25 36.98 2vna s ASN 212 CO 0.21 -1.03 1.80 0.58 -2.94 0.00 0.00 177.10 175.71 2vna h VAL 213 N 5.90 1.16 -0.06 3.54 2.07 -1.91 -1.88 116.25 125.07 2vna h VAL 213 Ca -0.28 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 2vna h VAL 213 Cb 1.09 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2vna h VAL 213 CO 1.03 0.16 0.03 0.00 0.02 0.00 0.00 177.57 178.81 2vna h ALA 214 N 1.15 0.07 -0.83 1.67 0.00 -1.94 0.18 119.26 119.56 2vna h ALA 214 Ca 0.18 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2vna h ALA 214 Cb -0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2vna h ALA 214 CO -0.03 -0.35 0.55 1.05 0.00 0.00 0.00 179.25 180.46 2vna h GLU 215 N -0.05 1.07 -0.38 0.00 -0.00 -1.98 -1.33 114.58 111.92 2vna h GLU 215 Ca 0.02 -0.06 -0.10 0.00 -0.00 0.00 0.00 59.36 59.21 2vna h GLU 215 Cb 0.14 -0.24 -0.02 0.00 -0.00 0.00 0.00 28.75 28.63 2vna h GLU 215 CO -0.00 0.71 -0.19 1.96 -0.00 0.00 0.00 179.01 181.48 2vna h GLN 216 N 1.10 0.72 -0.33 1.06 1.08 -0.71 -2.24 115.11 115.79 2vna h GLN 216 Ca 0.32 -0.27 -0.15 0.00 -1.45 0.00 0.00 58.65 57.10 2vna h GLN 216 Cb -0.08 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 2vna h GLN 216 CO -0.08 0.86 -0.40 -0.07 -0.95 0.00 0.00 178.83 178.19 2vna h LEU 217 N 0.63 0.86 -0.62 1.46 3.38 -0.26 -1.72 115.31 119.04 2vna h LEU 217 Ca 0.10 -0.39 0.09 0.00 0.09 0.00 0.00 57.88 57.77 2vna h LEU 217 Cb 0.68 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 2vna h LEU 217 CO 0.05 1.15 0.24 0.03 0.09 0.00 0.00 178.44 180.00 2vna h ARG 218 N 0.66 0.42 -0.44 1.13 3.08 -0.83 0.96 114.38 119.35 2vna h ARG 218 Ca 0.05 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.94 2vna h ARG 218 Cb 0.96 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 2vna h ARG 218 CO 0.09 0.28 -0.28 0.93 -1.07 0.00 0.00 179.97 179.91 2vna h GLU 219 N 0.43 0.97 0.00 0.04 3.07 -1.24 -3.24 114.58 114.61 2vna h GLU 219 Ca 0.31 -0.45 -0.11 0.00 -0.50 0.00 0.00 59.36 58.61 2vna h GLU 219 Cb 0.38 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 2vna h GLU 219 CO -0.30 1.12 -1.03 0.77 -1.40 0.00 0.00 179.01 178.17 2vna h SER 220 N 0.82 0.00 -2.08 1.42 0.02 -0.74 -3.36 113.55 109.63 2vna h SER 220 Ca 0.09 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.47 2vna h SER 220 Cb 0.87 0.00 -0.42 0.00 0.14 0.00 0.00 62.40 62.99 2vna h SER 220 CO 0.08 0.42 -0.75 0.00 -1.14 0.00 0.00 176.83 175.43 2vna h PRO 222 N 2.92 0.00 -0.64 0.00 0.13 -1.72 0.27 132.00 132.96 2vna h PRO 222 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2vna h PRO 222 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2vna h PRO 222 CO 0.77 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 2vna n ALA 223 N -2.24 2.68 -0.01 -0.56 0.00 -1.26 -5.09 120.51 114.03 2vna n ALA 223 Ca 0.03 -1.45 0.00 0.00 0.00 0.00 0.00 53.44 52.02 2vna n ALA 223 Cb 0.44 -0.89 -0.00 0.00 0.00 0.00 0.00 19.45 18.99 2vna n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vna n GLY 224 N 1.21 -2.08 3.57 0.00 0.00 0.95 -4.92 105.19 103.92 2vna n GLY 224 Ca 0.23 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 44.41 2vna n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vna s VAL 225 N -2.21 4.80 -0.18 1.61 1.01 -0.95 -4.50 120.40 119.98 2vna s VAL 225 Ca 0.00 -0.01 0.13 0.00 0.00 0.00 0.00 61.98 62.09 2vna s VAL 225 Cb 0.00 -3.22 -0.23 0.00 0.00 0.00 0.00 36.38 32.93 2vna s VAL 225 CO 0.00 0.37 0.13 0.47 0.00 0.00 0.00 175.10 176.07 2vna n ASP 226 N 4.34 0.63 -4.02 3.32 8.00 -0.22 -0.99 116.55 127.60 2vna n ASP 226 Ca -0.16 0.06 -0.26 0.00 0.71 0.00 0.00 54.79 55.14 2vna n ASP 226 Cb 0.52 0.46 -0.17 0.00 -0.02 0.00 0.00 41.12 41.91 2vna n ASP 226 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2vna s VAL 227 N -2.52 1.21 -0.30 2.53 1.01 -0.35 -0.42 120.40 121.56 2vna s VAL 227 Ca -0.14 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 2vna s VAL 227 Cb 0.07 -1.12 0.06 0.00 0.00 0.00 0.00 36.38 35.40 2vna s VAL 227 CO 0.78 0.38 -0.00 -0.47 0.00 0.00 0.00 175.10 175.79 2vna s TYR 228 N 0.83 3.34 -0.60 5.22 5.04 0.47 0.15 117.35 131.80 2vna s TYR 228 Ca -0.11 -2.14 -0.26 0.00 -2.44 0.00 0.00 57.07 52.12 2vna s TYR 228 Cb -0.15 -2.24 0.04 0.00 0.35 0.00 0.00 41.96 39.95 2vna s TYR 228 CO 0.02 -0.85 1.06 0.12 -1.34 0.00 0.00 175.55 174.56 2vna s PHE 229 N 1.17 2.65 -0.32 4.97 5.36 0.80 -0.01 117.98 132.61 2vna s PHE 229 Ca -0.03 0.04 -0.09 0.00 -0.96 0.00 0.00 56.93 55.89 2vna s PHE 229 Cb -0.20 -4.31 0.01 0.00 -0.34 0.00 0.00 43.02 38.18 2vna s PHE 229 CO -0.03 -1.56 0.14 0.34 -1.46 0.00 0.00 175.22 172.65 2vna s ASP 230 N 3.10 5.45 0.00 6.13 2.15 -0.38 -0.99 116.67 132.12 2vna s ASP 230 Ca 0.34 -0.69 0.15 0.00 0.43 0.00 0.00 52.55 52.78 2vna s ASP 230 Cb -0.11 -1.96 -0.10 0.00 -0.30 0.00 0.00 42.92 40.44 2vna s ASP 230 CO 0.19 -0.23 0.73 0.59 -0.17 0.00 0.00 175.17 176.28 2vna n ASN 231 N 4.94 1.07 0.00 -0.34 3.02 -1.20 -1.16 115.26 121.59 2vna n ASN 231 Ca -0.14 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 2vna n ASN 231 Cb 0.48 0.79 0.00 0.00 -0.61 0.00 0.00 39.78 40.44 2vna n ASN 231 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2vna n VAL 232 N -0.88 0.00 -4.36 2.41 0.24 -0.90 -1.81 118.33 113.03 2vna n VAL 232 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2vna n VAL 232 Cb 0.28 -0.51 0.00 0.00 -1.47 0.00 0.00 33.84 32.14 2vna n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2vna n GLY 233 N 3.20 -0.42 7.00 7.63 0.00 -1.26 -1.68 105.19 119.66 2vna n GLY 233 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2vna n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vna n GLY 234 N 0.00 1.90 0.21 -0.02 0.00 -1.26 -2.82 105.19 103.20 2vna n GLY 234 Ca 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 45.59 2vna n GLY 234 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vna h ASN 235 N 6.19 0.24 -0.25 1.61 2.35 -1.99 -2.15 115.58 121.58 2vna h ASN 235 Ca 0.00 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2vna h ASN 235 Cb 0.00 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 2vna h ASN 235 CO 0.00 0.56 0.03 0.40 -1.65 0.00 0.00 177.43 176.77 2vna h ILE 236 N 0.21 1.24 -0.27 2.81 2.04 -1.96 -1.94 117.51 119.63 2vna h ILE 236 Ca 0.03 -0.80 0.02 0.00 1.00 0.00 0.00 64.86 65.10 2vna h ILE 236 Cb 0.68 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2vna h ILE 236 CO 0.05 0.25 0.18 0.28 0.00 0.00 0.00 178.15 178.91 2vna h SER 237 N 0.22 0.26 -0.26 1.72 0.02 -1.27 -1.02 113.55 113.21 2vna h SER 237 Ca 0.07 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2vna h SER 237 Cb 0.35 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2vna h SER 237 CO 0.01 0.18 0.04 0.44 -1.14 0.00 0.00 176.83 176.36 2vna h ASP 238 N 0.30 0.40 -0.30 3.07 3.32 -0.88 -0.23 116.42 122.11 2vna h ASP 238 Ca 0.11 -0.26 0.03 0.00 0.02 0.00 0.00 57.03 56.92 2vna h ASP 238 Cb 0.06 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2vna h ASP 238 CO -0.02 0.56 0.12 0.74 -1.72 0.00 0.00 179.24 178.92 2vna h THR 239 N 0.23 0.95 -0.55 0.35 2.02 -0.87 -2.56 112.91 112.49 2vna h THR 239 Ca 0.08 -0.09 -0.08 0.00 0.77 0.00 0.00 66.41 67.09 2vna h THR 239 Cb 0.33 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2vna h THR 239 CO 0.00 0.05 0.05 0.58 0.37 0.00 0.00 175.52 176.57 2vna h VAL 240 N 0.27 1.26 -0.35 3.16 2.07 -0.75 -2.95 116.25 118.96 2vna h VAL 240 Ca 0.13 -1.04 -0.09 0.00 0.82 0.00 0.00 66.70 66.51 2vna h VAL 240 Cb 0.08 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 2vna h VAL 240 CO -0.11 0.38 -0.17 0.40 0.02 0.00 0.00 177.57 178.09 2vna h ILE 241 N 0.83 1.26 0.00 4.57 2.04 -1.03 -1.38 117.51 123.80 2vna h ILE 241 Ca 0.16 -1.19 0.00 0.00 1.00 0.00 0.00 64.86 64.84 2vna h ILE 241 Cb 0.48 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2vna h ILE 241 CO 0.02 0.39 0.08 -1.20 0.00 0.00 0.00 178.15 177.44 2vna n SER 242 N -4.15 0.34 -0.07 1.72 7.64 -0.97 -1.70 113.62 116.44 2vna n SER 242 Ca 0.01 0.62 0.04 0.00 1.01 0.00 0.00 58.87 60.55 2vna n SER 242 Cb 0.38 -0.65 0.06 0.00 -1.01 0.00 0.00 64.21 62.99 2vna n SER 242 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vna n GLN 243 N -1.96 1.84 -3.01 1.43 6.02 -0.53 -5.03 117.38 116.14 2vna n GLN 243 Ca -0.01 -1.85 -0.38 0.00 -0.01 0.00 0.00 57.00 54.75 2vna n GLN 243 Cb 0.10 -1.14 -0.06 0.00 1.02 0.00 0.00 30.24 30.16 2vna n GLN 243 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 2vna s MET 244 N -1.66 4.42 1.04 -1.09 -1.94 -0.69 -2.24 119.30 117.15 2vna s MET 244 Ca 0.14 1.05 -0.15 0.00 -1.71 0.00 0.00 55.69 55.01 2vna s MET 244 Cb 0.12 -3.02 0.21 0.00 2.01 0.00 0.00 34.83 34.15 2vna s MET 244 CO 0.01 0.45 1.15 -0.80 -0.01 0.00 0.00 175.02 175.82 2vna s ASN 245 N -1.45 2.34 0.29 3.03 0.01 -0.16 -4.82 114.94 114.17 2vna s ASN 245 Ca 0.41 0.77 -0.29 0.00 -0.71 0.00 0.00 52.86 53.04 2vna s ASN 245 Cb -0.19 -1.16 -0.10 0.00 0.41 0.00 0.00 41.25 40.21 2vna s ASN 245 CO 0.23 -3.26 1.29 -0.70 -1.51 0.00 0.00 177.10 173.15 2vna s GLU 246 N -5.36 4.40 -1.36 -0.60 2.56 -1.26 -2.71 118.70 114.36 2vna s GLU 246 Ca 0.68 2.12 0.00 0.00 0.00 0.00 0.00 54.97 57.78 2vna s GLU 246 Cb -0.12 -3.12 0.00 0.00 2.00 0.00 0.00 34.13 32.89 2vna s GLU 246 CO 0.55 -0.16 0.00 0.09 -0.56 0.00 0.00 175.26 175.18 2vna n ASN 247 N 1.41 -5.14 -3.84 -1.70 3.02 0.12 -4.98 115.26 104.16 2vna n ASN 247 Ca 0.02 0.32 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 2vna n ASN 247 Cb 0.42 -3.77 0.24 0.00 -0.61 0.00 0.00 39.78 36.06 2vna n ASN 247 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2vna s SER 248 N -2.62 0.93 -0.05 6.41 1.04 -1.10 -4.81 113.70 113.50 2vna s SER 248 Ca 0.00 0.66 0.01 0.00 0.48 0.00 0.00 55.95 57.09 2vna s SER 248 Cb 0.00 -0.92 0.02 0.00 0.10 0.00 0.00 66.02 65.22 2vna s SER 248 CO 0.00 -4.12 -0.04 -1.00 0.98 0.00 0.00 173.24 169.06 2vna s HIS 249 N -2.99 0.76 -0.26 5.02 3.76 0.44 -2.34 115.29 119.68 2vna s HIS 249 Ca 0.71 -0.22 -0.14 0.00 -0.15 0.00 0.00 55.06 55.26 2vna s HIS 249 Cb -0.10 -0.70 -0.04 0.00 1.11 0.00 0.00 32.58 32.85 2vna s HIS 249 CO 0.56 -0.22 0.32 0.42 -0.85 0.00 0.00 174.74 174.97 2vna s ILE 250 N 1.09 5.22 -0.50 0.60 1.01 -0.02 -0.40 121.20 128.21 2vna s ILE 250 Ca -0.08 0.47 -0.23 0.00 0.00 0.00 0.00 60.65 60.80 2vna s ILE 250 Cb -0.14 -3.65 0.04 0.00 0.01 0.00 0.00 42.46 38.72 2vna s ILE 250 CO -0.01 0.20 0.84 -0.63 0.00 0.00 0.00 174.94 175.35 2vna s ILE 251 N 1.83 4.55 -1.05 2.92 1.01 0.99 -4.22 121.20 127.23 2vna s ILE 251 Ca 0.13 0.29 -0.17 0.00 0.00 0.00 0.00 60.65 60.90 2vna s ILE 251 Cb -0.15 -4.42 0.15 0.00 0.01 0.00 0.00 42.46 38.05 2vna s ILE 251 CO 0.09 -0.90 1.25 -0.22 0.00 0.00 0.00 174.94 175.17 2vna s LEU 252 N 3.53 5.07 -0.05 2.97 2.96 -1.26 -1.24 118.68 130.65 2vna s LEU 252 Ca 0.29 -2.46 -0.03 0.00 -0.22 0.00 0.00 54.13 51.71 2vna s LEU 252 Cb -0.13 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.15 2vna s LEU 252 CO 0.20 -0.92 -0.05 0.00 -1.32 0.00 0.00 176.35 174.26 2vna s GLY 254 N -3.07 1.33 -0.45 0.00 0.00 -0.42 -4.92 107.32 99.78 2vna s GLY 254 Ca -0.04 -1.65 0.09 0.00 0.00 0.00 0.00 44.72 43.12 2vna s GLY 254 CO 0.07 -1.44 0.93 -1.06 0.00 0.00 0.00 173.10 171.60 2vna n GLN 255 N -0.25 2.38 0.06 2.90 1.13 -1.20 -2.13 117.38 120.27 2vna n GLN 255 Ca -0.02 -4.15 0.14 0.00 -1.94 0.00 0.00 57.00 51.04 2vna n GLN 255 Cb 0.65 -1.95 0.63 0.00 0.11 0.00 0.00 30.24 29.68 2vna n GLN 255 CO 0.00 0.00 0.00 0.97 -1.44 0.00 0.00 177.06 176.59 2vna h ILE 256 N 2.40 0.86 0.00 5.09 2.10 -1.04 -0.53 117.51 126.39 2vna h ILE 256 Ca 0.12 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 66.03 2vna h ILE 256 Cb 0.83 0.74 0.00 0.00 -1.09 0.00 0.00 36.82 37.30 2vna h ILE 256 CO 0.69 0.02 0.00 0.77 -1.08 0.00 0.00 178.15 178.55 2vna h SER 257 N 0.11 0.00 0.15 2.19 4.64 -1.60 -1.96 113.55 117.07 2vna h SER 257 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2vna h SER 257 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2vna h SER 257 CO -0.02 0.00 -0.38 0.00 -0.87 0.00 0.00 176.83 175.56 2vna n GLN 258 N -2.67 0.89 0.23 4.77 1.13 -0.21 -4.63 117.38 116.90 2vna n GLN 258 Ca -0.02 -0.63 0.09 0.00 -1.94 0.00 0.00 57.00 54.51 2vna n GLN 258 Cb 0.08 -1.49 0.54 0.00 0.11 0.00 0.00 30.24 29.49 2vna n GLN 258 CO 0.00 0.00 0.00 1.88 -1.44 0.00 0.00 177.06 177.50 2vna h TYR 259 N 1.53 0.00 -0.39 1.08 -1.99 -1.46 -1.59 116.97 114.14 2vna h TYR 259 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2vna h TYR 259 Cb 0.60 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.33 2vna h TYR 259 CO 0.00 0.22 0.00 0.09 -0.00 0.00 0.00 178.16 178.47 2vna n ASN 260 N -3.66 3.69 -4.44 3.88 3.02 -1.26 -4.84 115.26 111.65 2vna n ASN 260 Ca -0.01 -2.46 -0.28 0.00 -0.03 0.00 0.00 54.58 51.80 2vna n ASN 260 Cb 0.35 -0.55 -0.12 0.00 -0.61 0.00 0.00 39.78 38.85 2vna n ASN 260 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2vna s LYS 261 N -1.95 1.60 -1.17 3.52 1.02 -0.60 -3.91 119.74 118.24 2vna s LYS 261 Ca 0.34 -1.37 -0.17 0.00 0.02 0.00 0.00 55.97 54.79 2vna s LYS 261 Cb 0.24 -1.95 0.12 0.00 -0.52 0.00 0.00 37.83 35.72 2vna s LYS 261 CO 0.13 0.43 1.49 0.34 -0.92 0.00 0.00 175.35 176.83 2vna s ASP 262 N -2.40 6.86 -0.06 2.83 -1.08 -1.25 -4.84 116.67 116.73 2vna s ASP 262 Ca 0.19 -2.47 -0.16 0.00 -0.52 0.00 0.00 52.55 49.58 2vna s ASP 262 Cb -0.09 -2.48 0.03 0.00 -1.46 0.00 0.00 42.92 38.92 2vna s ASP 262 CO 0.09 -1.03 0.38 0.68 0.52 0.00 0.00 175.17 175.81 2vna s VAL 263 N 3.07 0.03 0.79 1.11 -7.23 -1.26 -5.10 120.40 111.81 2vna s VAL 263 Ca 0.45 -0.27 -0.11 0.00 -1.81 0.00 0.00 61.98 60.24 2vna s VAL 263 Cb -0.00 -0.64 0.07 0.00 0.56 0.00 0.00 36.38 36.37 2vna s VAL 263 CO -0.00 -0.15 1.12 -2.84 -0.31 0.00 0.00 175.10 172.92 2vna s PRO 264 N -0.82 2.01 -0.09 4.82 0.02 -1.26 -4.90 135.00 134.78 2vna s PRO 264 Ca -0.09 1.34 0.03 0.00 0.02 0.00 0.00 61.00 62.30 2vna s PRO 264 Cb -0.04 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.61 2vna s PRO 264 CO 0.04 -1.86 -0.19 -0.47 -0.33 0.00 0.00 177.00 174.19 2vna s TYR 265 N -2.69 2.62 0.47 6.54 5.04 -1.26 -2.37 117.35 125.70 2vna s TYR 265 Ca 0.64 -0.69 -0.19 0.00 -2.44 0.00 0.00 57.07 54.39 2vna s TYR 265 Cb -0.20 -1.71 -0.10 0.00 0.35 0.00 0.00 41.96 40.31 2vna s TYR 265 CO 0.54 -0.20 0.96 -1.25 -1.34 0.00 0.00 175.55 174.26 2vna s PRO 266 N 0.04 4.10 0.60 4.97 0.04 -1.26 -5.12 135.00 138.36 2vna s PRO 266 Ca -0.07 1.03 -0.16 0.00 0.04 0.00 0.00 61.00 61.84 2vna s PRO 266 Cb -0.15 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.19 2vna s PRO 266 CO 0.05 -0.14 1.07 -2.14 0.04 0.00 0.00 177.00 175.88 2vna s PRO 267 N -3.59 3.26 0.25 0.56 0.02 -1.00 -5.02 135.00 129.49 2vna s PRO 267 Ca 0.60 1.26 -0.20 0.00 0.02 0.00 0.00 61.00 62.69 2vna s PRO 267 Cb -0.09 -2.02 -0.09 0.00 0.02 0.00 0.00 34.50 32.32 2vna s PRO 267 CO 0.22 -0.86 0.75 -1.25 -0.33 0.00 0.00 177.00 175.52 2vna s PRO 268 N -4.00 4.24 0.75 5.54 0.04 -1.26 -5.05 135.00 135.27 2vna s PRO 268 Ca 0.65 0.89 -0.15 0.00 0.04 0.00 0.00 61.00 62.42 2vna s PRO 268 Cb -0.17 -2.80 0.01 0.00 0.04 0.00 0.00 34.50 31.58 2vna s PRO 268 CO 0.36 0.34 0.83 1.28 0.04 0.00 0.00 177.00 179.85 2vna n LEU 269 N 0.53 2.54 -4.75 -3.56 4.77 -1.26 -4.98 117.00 110.29 2vna n LEU 269 Ca -0.01 0.60 -0.35 0.00 -0.03 0.00 0.00 56.01 56.22 2vna n LEU 269 Cb 0.51 -1.35 0.04 0.00 -2.33 0.00 0.00 43.42 40.29 2vna n LEU 269 CO 0.43 -2.44 0.82 -0.94 -1.33 0.00 0.00 177.39 173.93 2vna s SER 270 N -1.69 5.11 0.29 -1.43 1.04 -1.26 -4.66 113.70 111.09 2vna s SER 270 Ca 0.70 2.33 -0.02 0.00 0.48 0.00 0.00 55.95 59.44 2vna s SER 270 Cb -0.33 -2.59 0.64 0.00 0.10 0.00 0.00 66.02 63.84 2vna s SER 270 CO 0.54 -1.64 1.60 -0.65 0.98 0.00 0.00 173.24 174.06 2vna h PRO 271 N 0.69 0.05 -0.52 4.02 0.11 -1.98 0.35 132.00 134.72 2vna h PRO 271 Ca -0.50 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 2vna h PRO 271 Cb 1.29 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 2vna h PRO 271 CO 0.54 0.03 -0.14 0.00 -0.21 0.00 0.00 178.00 178.22 2vna h ALA 272 N 1.89 0.72 -0.03 -0.75 0.00 -1.99 -1.79 119.26 117.30 2vna h ALA 272 Ca 0.53 -0.37 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2vna h ALA 272 Cb 1.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2vna h ALA 272 CO -0.83 0.66 -0.78 0.82 0.00 0.00 0.00 179.25 179.12 2vna h ILE 273 N 0.89 1.45 -0.25 0.00 1.08 -1.27 -2.58 117.51 116.82 2vna h ILE 273 Ca 0.13 -2.37 -0.07 0.00 -0.39 0.00 0.00 64.86 62.16 2vna h ILE 273 Cb 0.72 2.29 -0.01 0.00 -3.07 0.00 0.00 36.82 36.74 2vna h ILE 273 CO 0.06 0.70 -0.13 -0.08 -0.69 0.00 0.00 178.15 178.00 2vna h GLU 274 N 0.14 0.42 -0.14 2.37 4.81 -0.39 -1.75 114.58 120.04 2vna h GLU 274 Ca -0.03 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 2vna h GLU 274 Cb 1.36 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.69 2vna h GLU 274 CO 0.12 0.55 0.01 0.00 -0.73 0.00 0.00 179.01 178.96 2vna h ALA 275 N 1.48 0.19 -0.83 2.92 0.00 -1.01 -1.34 119.26 120.67 2vna h ALA 275 Ca 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2vna h ALA 275 Cb 0.46 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 2vna h ALA 275 CO 0.03 -0.13 0.55 0.82 0.00 0.00 0.00 179.25 180.52 2vna h ILE 276 N -0.00 1.20 -0.08 0.00 2.04 -1.36 0.78 117.51 120.08 2vna h ILE 276 Ca 0.04 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 2vna h ILE 276 Cb 0.34 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2vna h ILE 276 CO 0.01 0.20 0.04 -0.61 0.00 0.00 0.00 178.15 177.79 2vna h GLN 277 N 1.10 0.12 -0.48 2.37 4.15 -1.09 -1.98 115.11 119.30 2vna h GLN 277 Ca 0.31 -0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.59 2vna h GLN 277 Cb -0.10 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 2vna h GLN 277 CO -0.07 0.18 -0.19 0.87 -1.93 0.00 0.00 178.83 177.69 2vna h LYS 278 N 0.02 0.97 -0.01 1.69 1.57 -0.92 -1.64 116.57 118.26 2vna h LYS 278 Ca 0.03 -0.41 -0.06 0.00 -1.87 0.00 0.00 60.65 58.34 2vna h LYS 278 Cb 0.10 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2vna h LYS 278 CO -0.00 1.08 -0.26 0.93 -0.57 0.00 0.00 179.45 180.62 2vna h GLU 279 N 0.82 0.01 -0.66 3.15 4.39 -0.76 -2.75 114.58 118.79 2vna h GLU 279 Ca 0.11 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2vna h GLU 279 Cb 0.77 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2vna h GLU 279 CO 0.06 0.27 0.00 0.54 -1.16 0.00 0.00 179.01 178.73 2vna n ARG 280 N -4.22 2.99 -3.88 2.33 1.74 -0.75 -4.95 116.66 109.90 2vna n ARG 280 Ca -0.02 -2.64 -0.28 0.00 -0.77 0.00 0.00 57.85 54.14 2vna n ARG 280 Cb 0.32 -1.61 -0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2vna n ARG 280 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2vna n ASN 281 N 1.34 -1.69 -4.76 0.55 5.15 -1.04 0.16 115.26 114.97 2vna n ASN 281 Ca 0.23 -1.02 -0.38 0.00 -0.60 0.00 0.00 54.58 52.81 2vna n ASN 281 Cb 0.66 -3.10 -0.06 0.00 -0.53 0.00 0.00 39.78 36.75 2vna n ASN 281 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2vna s ILE 282 N -3.82 5.03 -0.09 -1.44 1.01 -0.63 -2.92 121.20 118.35 2vna s ILE 282 Ca 0.14 1.06 -0.15 0.00 0.00 0.00 0.00 60.65 61.70 2vna s ILE 282 Cb -0.05 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 2vna s ILE 282 CO 0.88 0.41 0.38 -0.89 0.00 0.00 0.00 174.94 175.73 2vna s THR 283 N -0.05 5.18 -0.39 2.92 2.01 -0.99 -4.81 115.64 119.51 2vna s THR 283 Ca 0.28 0.76 0.03 0.00 0.31 0.00 0.00 61.69 63.07 2vna s THR 283 Cb -0.17 -3.71 0.16 0.00 0.01 0.00 0.00 72.50 68.79 2vna s THR 283 CO 0.14 0.44 0.35 -0.60 -0.69 0.00 0.00 174.62 174.26 2vna s ARG 284 N -0.07 0.74 0.18 4.92 3.52 -1.26 -0.84 118.95 126.15 2vna s ARG 284 Ca 0.22 -1.45 0.06 0.00 -0.13 0.00 0.00 55.73 54.43 2vna s ARG 284 Cb -0.15 -1.06 -0.04 0.00 -1.56 0.00 0.00 34.95 32.14 2vna s ARG 284 CO 0.09 -1.28 0.11 -1.21 -0.81 0.00 0.00 175.30 172.20 2vna s GLU 285 N 0.80 2.77 0.20 5.12 2.02 -1.26 -5.03 118.70 123.31 2vna s GLU 285 Ca 0.24 -0.97 -0.30 0.00 0.02 0.00 0.00 54.97 53.96 2vna s GLU 285 Cb -0.09 -2.55 -0.09 0.00 0.10 0.00 0.00 34.13 31.50 2vna s GLU 285 CO -0.08 0.46 1.27 0.50 0.02 0.00 0.00 175.26 177.44 2vna s ARG 286 N -3.20 4.42 -0.18 1.61 3.52 -1.26 -4.04 118.95 119.82 2vna s ARG 286 Ca 0.30 2.00 0.01 0.00 -0.13 0.00 0.00 55.73 57.91 2vna s ARG 286 Cb -0.09 -3.21 0.03 0.00 -1.56 0.00 0.00 34.95 30.12 2vna s ARG 286 CO 0.22 -0.20 -0.16 0.12 -0.81 0.00 0.00 175.30 174.47 2vna s PHE 287 N 0.04 2.65 -0.24 5.12 5.36 -1.22 -5.00 117.98 124.69 2vna s PHE 287 Ca 0.55 -1.62 0.02 0.00 -0.96 0.00 0.00 56.93 54.92 2vna s PHE 287 Cb -0.35 -1.81 0.05 0.00 -0.34 0.00 0.00 43.02 40.57 2vna s PHE 287 CO 0.38 -0.78 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.73 2vna s LEU 288 N 1.33 3.08 0.38 6.12 1.43 -1.26 -4.80 118.68 124.96 2vna s LEU 288 Ca 0.03 -1.22 0.09 0.00 -1.03 0.00 0.00 54.13 52.00 2vna s LEU 288 Cb -0.14 -1.49 0.85 0.00 0.03 0.00 0.00 46.19 45.43 2vna s LEU 288 CO -0.11 -0.16 1.94 1.62 0.23 0.00 0.00 176.35 179.87 2vna h VAL 289 N 6.59 0.93 0.00 -1.59 3.04 -1.98 -0.92 116.25 122.33 2vna h VAL 289 Ca -0.24 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 2vna h VAL 289 Cb 1.06 0.24 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 2vna h VAL 289 CO 0.49 0.12 0.00 0.18 -1.01 0.00 0.00 177.57 177.35 2vna n LEU 290 N -4.49 0.60 0.00 3.16 4.77 -1.26 0.06 117.00 119.83 2vna n LEU 290 Ca 0.12 0.76 0.13 0.00 -0.03 0.00 0.00 56.01 56.99 2vna n LEU 290 Cb 0.34 -0.81 0.75 0.00 -2.33 0.00 0.00 43.42 41.37 2vna n LEU 290 CO 0.33 -0.92 0.95 0.59 -1.33 0.00 0.00 177.39 177.01 2vna n ASN 291 N -2.29 0.00 -1.89 -1.43 3.02 -0.35 -3.87 115.26 108.46 2vna n ASN 291 Ca -0.01 -0.94 -0.06 0.00 -0.03 0.00 0.00 54.58 53.53 2vna n ASN 291 Cb 0.06 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.30 2vna n ASN 291 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2vna n TYR 292 N -0.96 1.31 -0.31 3.10 4.02 0.11 -4.88 117.16 119.55 2vna n TYR 292 Ca 0.19 -1.77 0.16 0.00 -0.01 0.00 0.00 57.90 56.47 2vna n TYR 292 Cb 0.09 -0.26 0.40 0.00 -0.02 0.00 0.00 39.34 39.55 2vna n TYR 292 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 2vna h LYS 293 N 1.87 0.60 -0.21 -0.72 1.57 -1.71 -0.43 116.57 117.53 2vna h LYS 293 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2vna h LYS 293 Cb 1.41 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2vna h LYS 293 CO 0.33 0.39 0.00 -0.40 -0.57 0.00 0.00 179.45 179.20 2vna n ASP 294 N -4.65 0.21 -0.09 0.86 5.75 -1.26 -1.79 116.55 115.59 2vna n ASP 294 Ca 0.22 -1.86 0.01 0.00 -0.01 0.00 0.00 54.79 53.15 2vna n ASP 294 Cb 0.64 -0.11 0.01 0.00 -1.03 0.00 0.00 41.12 40.62 2vna n ASP 294 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2vna n LYS 295 N -0.38 1.25 -0.23 0.11 5.02 -0.17 -4.69 118.16 119.06 2vna n LYS 295 Ca 0.00 -0.50 -0.03 0.00 -2.02 0.00 0.00 58.31 55.76 2vna n LYS 295 Cb 0.05 -0.94 0.08 0.00 -0.02 0.00 0.00 35.03 34.20 2vna n LYS 295 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2vna h PHE 296 N 0.44 0.75 0.17 2.13 -1.00 -1.41 -0.81 116.94 117.21 2vna h PHE 296 Ca 0.00 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 2vna h PHE 296 Cb 0.11 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 2vna h PHE 296 CO 0.00 0.42 -0.21 1.49 -1.61 0.00 0.00 178.31 178.39 2vna h GLU 297 N 0.78 -0.37 -0.78 1.51 4.81 -1.84 0.21 114.58 118.90 2vna h GLU 297 Ca 0.27 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.64 2vna h GLU 297 Cb 0.05 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.44 2vna h GLU 297 CO -0.12 -0.25 0.40 -1.35 -0.73 0.00 0.00 179.01 176.96 2vna h PRO 298 N -0.39 0.61 0.06 0.92 0.11 -1.88 -0.23 132.00 131.21 2vna h PRO 298 Ca -0.02 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.08 2vna h PRO 298 Cb 0.35 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.28 2vna h PRO 298 CO -0.05 0.41 -0.29 0.78 -0.21 0.00 0.00 178.00 178.64 2vna h GLY 299 N 0.63 -0.50 1.02 -0.55 0.00 -0.90 0.22 103.07 102.99 2vna h GLY 299 Ca 0.40 0.34 -0.02 0.00 0.00 0.00 0.00 47.33 48.05 2vna h GLY 299 CO -0.31 -0.23 0.39 -2.22 0.00 0.00 0.00 176.54 174.17 2vna h ILE 300 N -0.47 1.24 -0.86 2.60 1.08 -0.01 -1.28 117.51 119.81 2vna h ILE 300 Ca 0.05 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.89 2vna h ILE 300 Cb 0.53 0.26 -0.04 0.00 -3.07 0.00 0.00 36.82 34.50 2vna h ILE 300 CO -0.21 0.27 0.55 -0.07 -0.69 0.00 0.00 178.15 178.00 2vna h LEU 301 N 1.06 1.01 -0.09 1.44 3.38 -0.63 -0.65 115.31 120.83 2vna h LEU 301 Ca 0.26 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 2vna h LEU 301 Cb 0.08 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2vna h LEU 301 CO -0.04 0.75 -0.09 -0.61 0.09 0.00 0.00 178.44 178.54 2vna h GLN 302 N 1.18 0.22 -0.14 1.13 5.75 -0.04 -1.66 115.11 121.55 2vna h GLN 302 Ca 0.31 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2vna h GLN 302 Cb -0.10 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 2vna h GLN 302 CO -0.06 0.65 0.07 -0.07 -2.65 0.00 0.00 178.83 176.77 2vna h LEU 303 N -0.21 0.18 -0.52 -2.39 3.38 -1.11 0.44 115.31 115.08 2vna h LEU 303 Ca 0.01 -0.10 0.09 0.00 0.09 0.00 0.00 57.88 57.97 2vna h LEU 303 Cb 0.61 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2vna h LEU 303 CO 0.02 0.23 0.12 -1.28 0.09 0.00 0.00 178.44 177.62 2vna h SER 304 N 0.12 0.03 -0.46 -0.43 0.87 -1.19 0.01 113.55 112.49 2vna h SER 304 Ca 0.05 0.09 0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2vna h SER 304 Cb 0.09 0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 2vna h SER 304 CO -0.01 0.04 0.27 -0.61 -0.53 0.00 0.00 176.83 175.99 2vna h GLN 305 N 0.26 0.52 -0.34 2.24 4.15 -0.74 0.28 115.11 121.47 2vna h GLN 305 Ca 0.26 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.57 2vna h GLN 305 Cb 0.36 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 2vna h GLN 305 CO -0.33 0.34 -0.13 -1.49 -1.93 0.00 0.00 178.83 175.29 2vna h TRP 306 N 0.53 0.65 -0.02 3.99 6.55 -0.49 -1.40 115.95 125.76 2vna h TRP 306 Ca 0.19 -0.11 -0.00 0.00 0.95 0.00 0.00 58.89 59.92 2vna h TRP 306 Cb 0.03 -0.17 -0.00 0.00 -0.86 0.00 0.00 29.16 28.16 2vna h TRP 306 CO -0.07 0.70 -0.01 0.35 -1.05 0.00 0.00 178.44 178.36 2vna h PHE 307 N 0.55 0.04 0.00 0.49 3.57 -0.42 0.49 116.94 121.65 2vna h PHE 307 Ca 0.10 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2vna h PHE 307 Cb 0.54 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.27 2vna h PHE 307 CO 0.02 0.41 0.00 0.87 -2.23 0.00 0.00 178.31 177.38 2vna h LYS 308 N -0.34 0.00 -0.01 1.11 1.57 -0.32 -0.53 116.57 118.05 2vna h LYS 308 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2vna h LYS 308 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2vna h LYS 308 CO 0.00 0.00 -0.15 0.39 -0.57 0.00 0.00 179.45 179.12 2vna n GLU 309 N -2.54 0.86 -0.99 3.15 1.02 -0.54 -4.92 120.64 116.69 2vna n GLU 309 Ca 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 57.16 56.74 2vna n GLU 309 Cb 0.18 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2vna n GLU 309 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vna n GLY 310 N 1.28 0.81 0.10 0.62 0.00 -0.21 -4.95 105.19 102.85 2vna n GLY 310 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.13 2vna n GLY 310 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vna h LYS 311 N 2.27 -0.20 -6.26 1.61 1.57 -1.27 -3.44 116.57 110.86 2vna h LYS 311 Ca 0.00 0.01 -0.56 0.00 -1.87 0.00 0.00 60.65 58.24 2vna h LYS 311 Cb 0.01 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2vna h LYS 311 CO 0.00 -0.13 0.84 -1.17 -0.57 0.00 0.00 179.45 178.42 2vna s LEU 312 N -6.82 4.25 -0.21 2.94 2.96 -0.01 -4.96 118.68 116.84 2vna s LEU 312 Ca -0.03 1.86 -0.12 0.00 -0.22 0.00 0.00 54.13 55.62 2vna s LEU 312 Cb 0.00 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 2vna s LEU 312 CO 0.09 -0.71 0.22 -0.54 -1.32 0.00 0.00 176.35 174.09 2vna s LYS 313 N 2.90 4.15 -0.21 1.98 -0.14 -1.26 -4.39 119.74 122.76 2vna s LYS 313 Ca 0.58 -0.11 -0.06 0.00 -1.36 0.00 0.00 55.97 55.03 2vna s LYS 313 Cb -0.26 -3.49 -0.03 0.00 -1.68 0.00 0.00 37.83 32.37 2vna s LYS 313 CO 0.21 0.13 0.03 0.42 -0.76 0.00 0.00 175.35 175.37 2vna s ILE 314 N 0.85 4.17 -0.05 2.17 1.01 -1.26 -4.89 121.20 123.21 2vna s ILE 314 Ca 0.11 -0.24 0.05 0.00 0.00 0.00 0.00 60.65 60.58 2vna s ILE 314 Cb -0.13 -2.90 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 2vna s ILE 314 CO 0.04 0.41 -0.20 -0.54 0.00 0.00 0.00 174.94 174.65 2vna s LYS 315 N 1.03 2.46 0.04 2.79 -0.14 -1.26 -5.11 119.74 119.55 2vna s LYS 315 Ca 0.03 -0.81 -0.06 0.00 -1.36 0.00 0.00 55.97 53.77 2vna s LYS 315 Cb -0.14 -2.25 -0.01 0.00 -1.68 0.00 0.00 37.83 33.74 2vna s LYS 315 CO 0.02 0.53 0.11 -1.83 -0.76 0.00 0.00 175.35 173.42 2vna s GLU 316 N -0.50 0.62 -0.14 1.68 -1.05 -1.25 -1.80 118.70 116.26 2vna s GLU 316 Ca 0.06 -0.77 0.02 0.00 -0.15 0.00 0.00 54.97 54.14 2vna s GLU 316 Cb -0.11 0.25 0.01 0.00 -0.44 0.00 0.00 34.13 33.83 2vna s GLU 316 CO 0.01 -0.16 -0.21 0.99 0.95 0.00 0.00 175.26 176.84 2vna s THR 317 N -2.74 1.97 -0.14 1.83 2.01 0.15 -4.82 115.64 113.90 2vna s THR 317 Ca -0.04 -0.92 -0.02 0.00 0.31 0.00 0.00 61.69 61.02 2vna s THR 317 Cb -0.00 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 2vna s THR 317 CO -0.05 0.53 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.64 2vna s VAL 318 N 0.92 3.46 0.04 3.82 1.01 -1.26 -0.59 120.40 127.80 2vna s VAL 318 Ca -0.05 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2vna s VAL 318 Cb -0.15 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 2vna s VAL 318 CO -0.04 0.51 -0.16 -0.51 0.00 0.00 0.00 175.10 174.90 2vna s ILE 319 N 0.36 2.94 -0.13 2.22 1.10 -0.50 -4.96 121.20 122.23 2vna s ILE 319 Ca -0.08 -1.14 -0.08 0.00 -0.51 0.00 0.00 60.65 58.84 2vna s ILE 319 Cb -0.15 -2.26 -0.04 0.00 0.15 0.00 0.00 42.46 40.16 2vna s ILE 319 CO 0.04 0.33 0.15 0.20 -2.11 0.00 0.00 174.94 173.55 2vna s ASN 320 N -1.50 6.37 0.00 4.50 0.01 -1.26 -0.51 114.94 122.56 2vna s ASN 320 Ca 0.15 0.44 0.00 0.00 -0.71 0.00 0.00 52.86 52.74 2vna s ASN 320 Cb -0.11 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.47 2vna s ASN 320 CO 0.06 0.35 0.00 0.61 -1.51 0.00 0.00 177.10 176.61 2vna n GLY 321 N 2.34 2.06 0.32 0.66 0.00 0.32 -4.66 105.19 106.22 2vna n GLY 321 Ca -0.19 -1.33 0.14 0.00 0.00 0.00 0.00 46.02 44.64 2vna n GLY 321 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2vna h LEU 322 N 0.00 0.00 0.00 0.99 5.85 -1.84 0.12 115.31 120.43 2vna h LEU 322 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2vna h LEU 322 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2vna h LEU 322 CO 0.00 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 176.26 2vna n GLU 323 N -4.17 0.82 -0.04 1.25 0.00 -1.26 -2.49 120.64 114.75 2vna n GLU 323 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.18 2vna n GLU 323 Cb 0.27 -1.00 0.03 0.00 0.00 0.00 0.00 31.44 30.74 2vna n GLU 323 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2vna n ASN 324 N -0.50 2.12 0.23 -1.84 3.02 0.42 -4.72 115.26 113.99 2vna n ASN 324 Ca 0.00 -1.93 -0.15 0.00 -0.03 0.00 0.00 54.58 52.47 2vna n ASN 324 Cb 0.00 -0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.05 2vna n ASN 324 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2vna h MET 325 N 0.45 -0.61 -0.11 3.52 2.86 -1.60 0.11 114.93 119.54 2vna h MET 325 Ca 0.00 0.04 0.04 0.00 -2.06 0.00 0.00 59.70 57.72 2vna h MET 325 Cb 0.51 0.14 -0.05 0.00 0.06 0.00 0.00 31.60 32.26 2vna h MET 325 CO 0.00 -0.41 -0.22 0.78 1.06 0.00 0.00 176.91 178.12 2vna h GLY 326 N -0.64 -0.23 0.97 8.32 0.00 -1.84 0.11 103.07 109.77 2vna h GLY 326 Ca -0.03 0.27 0.04 0.00 0.00 0.00 0.00 47.33 47.61 2vna h GLY 326 CO 0.00 -0.19 0.59 0.00 0.00 0.00 0.00 176.54 176.94 2vna h ALA 327 N 0.66 1.45 -0.26 3.60 0.00 -1.80 -1.49 119.26 121.42 2vna h ALA 327 Ca 0.09 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2vna h ALA 327 Cb 0.43 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2vna h ALA 327 CO -0.28 0.46 -0.37 0.00 0.00 0.00 0.00 179.25 179.06 2vna h ALA 328 N 1.48 0.86 -0.37 0.00 0.00 0.08 0.56 119.26 121.87 2vna h ALA 328 Ca 0.36 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2vna h ALA 328 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2vna h ALA 328 CO -0.11 0.64 0.05 0.35 0.00 0.00 0.00 179.25 180.18 2vna h PHE 329 N 0.50 0.66 -0.21 0.00 3.04 -0.59 -0.27 116.94 120.07 2vna h PHE 329 Ca 0.05 -0.09 0.00 0.00 3.98 0.00 0.00 57.97 61.90 2vna h PHE 329 Cb 0.87 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 2vna h PHE 329 CO 0.04 0.67 0.13 0.37 -2.02 0.00 0.00 178.31 177.50 2vna h GLN 330 N 0.45 0.27 -0.94 1.11 4.15 -1.08 0.31 115.11 119.38 2vna h GLN 330 Ca 0.11 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.54 2vna h GLN 330 Cb 0.38 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 27.95 2vna h GLN 330 CO 0.01 0.20 0.62 1.03 -1.93 0.00 0.00 178.83 178.75 2vna h SER 331 N 0.27 1.04 -0.29 -0.69 0.87 -0.76 -2.32 113.55 111.67 2vna h SER 331 Ca 0.07 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 2vna h SER 331 Cb -0.01 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2vna h SER 331 CO -0.02 0.73 -0.02 -0.03 -0.53 0.00 0.00 176.83 176.96 2vna h MET 332 N 1.22 0.52 0.00 2.24 1.85 -0.67 0.51 114.93 120.60 2vna h MET 332 Ca 0.36 -0.18 -0.00 0.00 -0.61 0.00 0.00 59.70 59.28 2vna h MET 332 Cb -0.05 -0.04 -0.00 0.00 0.43 0.00 0.00 31.60 31.94 2vna h MET 332 CO -0.11 0.69 -0.00 0.52 -0.40 0.00 0.00 176.91 177.61 2vna h MET 333 N 0.30 0.00 -0.08 0.39 2.07 -0.43 -2.64 114.93 114.55 2vna h MET 333 Ca 0.08 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.68 2vna h MET 333 Cb 0.46 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.18 2vna h MET 333 CO 0.02 0.00 -0.19 0.25 1.07 0.00 0.00 176.91 178.07 2vna n THR 334 N -3.35 2.14 -1.18 2.22 -2.24 -0.92 -4.98 114.28 105.97 2vna n THR 334 Ca -0.03 -2.64 -0.03 0.00 -2.27 0.00 0.00 64.05 59.09 2vna n THR 334 Cb 0.09 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.05 2vna n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vna n GLY 335 N -1.18 0.54 0.23 3.38 0.00 -0.96 -4.93 105.19 102.27 2vna n GLY 335 Ca 0.20 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.38 2vna n GLY 335 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vna h GLY 336 N 0.00 0.00 -4.89 -0.02 0.00 -0.20 -3.45 103.07 94.51 2vna h GLY 336 Ca -0.05 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.71 2vna h GLY 336 CO 0.07 0.00 -0.00 0.54 0.00 0.00 0.00 176.54 177.15 2vna s ASN 337 N -6.10 6.99 -0.24 0.19 4.22 -1.26 -4.96 114.94 113.78 2vna s ASN 337 Ca 0.01 1.18 -0.12 0.00 -2.14 0.00 0.00 52.86 51.79 2vna s ASN 337 Cb 0.09 -2.37 -0.05 0.00 1.28 0.00 0.00 41.25 40.21 2vna s ASN 337 CO 0.63 0.09 0.24 -0.63 -2.04 0.00 0.00 177.10 175.39 2vna s ILE 338 N -0.16 5.30 0.00 0.54 1.09 -1.26 -4.80 121.20 121.91 2vna s ILE 338 Ca 0.32 0.35 0.00 0.00 -1.10 0.00 0.00 60.65 60.21 2vna s ILE 338 Cb -0.18 -3.58 0.00 0.00 -1.06 0.00 0.00 42.46 37.64 2vna s ILE 338 CO 0.18 0.29 0.00 0.61 -0.10 0.00 0.00 174.94 175.92 2vna n GLY 339 N 4.32 0.63 3.69 6.18 0.00 0.12 -3.00 105.19 117.13 2vna n GLY 339 Ca -0.13 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 2vna n GLY 339 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vna s LYS 340 N 0.00 4.23 -0.35 1.61 2.47 -0.74 -3.99 119.74 122.97 2vna s LYS 340 Ca 0.00 2.22 -0.29 0.00 -1.56 0.00 0.00 55.97 56.34 2vna s LYS 340 Cb 0.00 -3.54 0.01 0.00 -1.46 0.00 0.00 37.83 32.84 2vna s LYS 340 CO 0.00 -0.66 1.18 -1.14 0.16 0.00 0.00 175.35 174.88 2vna s GLN 341 N 2.38 3.93 0.02 4.03 2.00 -1.26 0.32 119.66 131.08 2vna s GLN 341 Ca 0.70 1.03 0.07 0.00 -2.00 0.00 0.00 55.36 55.16 2vna s GLN 341 Cb -0.38 -3.83 -0.02 0.00 0.80 0.00 0.00 33.01 29.58 2vna s GLN 341 CO 0.30 -1.10 -0.20 0.42 -0.50 0.00 0.00 175.29 174.22 2vna s ILE 342 N 4.13 1.59 -0.24 -2.34 -1.09 0.24 -3.59 121.20 119.90 2vna s ILE 342 Ca 0.50 -1.03 -0.02 0.00 -2.23 0.00 0.00 60.65 57.87 2vna s ILE 342 Cb -0.13 -1.36 0.02 0.00 -1.58 0.00 0.00 42.46 39.41 2vna s ILE 342 CO 0.22 0.30 -0.06 -0.69 -1.23 0.00 0.00 174.94 173.48 2vna s VAL 343 N -0.65 2.96 -0.31 2.92 1.01 -0.10 -1.41 120.40 124.82 2vna s VAL 343 Ca 0.07 -0.90 -0.27 0.00 0.00 0.00 0.00 61.98 60.88 2vna s VAL 343 Cb -0.08 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.85 2vna s VAL 343 CO 0.01 0.26 0.99 0.00 0.00 0.00 0.00 175.10 176.35 2vna n ILE 345 N 5.74 0.32 -4.40 0.00 2.08 0.06 -0.52 119.36 122.65 2vna n ILE 345 Ca 0.10 -0.42 -0.28 0.00 0.56 0.00 0.00 62.75 62.70 2vna n ILE 345 Cb 0.47 -0.07 -0.12 0.00 -0.75 0.00 0.00 39.64 39.17 2vna n ILE 345 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2vna s SER 346 N -4.64 3.45 0.00 4.38 0.15 -1.22 -4.70 113.70 111.12 2vna s SER 346 Ca -0.01 -0.79 0.22 0.00 0.70 0.00 0.00 55.95 56.08 2vna s SER 346 Cb 0.12 -0.28 1.01 0.00 -1.71 0.00 0.00 66.02 65.17 2vna s SER 346 CO 0.82 0.15 1.71 -1.84 1.20 0.00 0.00 173.24 175.28 2vna n GLU 347 N 0.57 0.12 0.00 5.44 0.00 -1.26 -5.01 120.64 120.49 2vna n GLU 347 Ca -0.15 0.11 0.07 0.00 0.00 0.00 0.00 57.16 57.18 2vna n GLU 347 Cb 0.54 -1.50 0.39 0.00 0.00 0.00 0.00 31.44 30.87 2vna n GLU 347 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52