#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvl s ARG 2 N 0.00 4.23 0.20 2.12 0.52 -0.79 -1.09 118.95 124.14 2wvl s ARG 2 Ca 0.00 0.07 0.11 0.00 -0.52 0.00 0.00 55.73 55.39 2wvl s ARG 2 Cb 0.00 -3.42 -0.04 0.00 0.52 0.00 0.00 34.95 32.01 2wvl s ARG 2 CO 0.00 0.26 -0.23 -0.51 0.02 0.00 0.00 175.30 174.85 2wvl s LEU 3 N 0.40 2.45 0.65 2.53 1.43 -0.14 0.60 118.68 126.61 2wvl s LEU 3 Ca 0.16 -0.88 -0.17 0.00 -1.03 0.00 0.00 54.13 52.20 2wvl s LEU 3 Cb -0.13 -1.10 -0.00 0.00 0.03 0.00 0.00 46.19 44.99 2wvl s LEU 3 CO 0.03 0.08 1.22 -1.61 0.23 0.00 0.00 176.35 176.31 2wvl s GLU 4 N -2.78 2.61 0.02 1.70 2.02 -0.02 -0.44 118.70 121.82 2wvl s GLU 4 Ca 0.21 1.83 -0.24 0.00 0.02 0.00 0.00 54.97 56.78 2wvl s GLU 4 Cb -0.07 -1.88 -0.05 0.00 0.10 0.00 0.00 34.13 32.22 2wvl s GLU 4 CO 0.10 -1.49 0.73 0.42 0.02 0.00 0.00 175.26 175.04 2wvl s ILE 5 N -1.73 4.80 0.10 -1.63 1.01 -1.26 -4.66 121.20 117.83 2wvl s ILE 5 Ca 0.77 1.55 -0.33 0.00 0.00 0.00 0.00 60.65 62.64 2wvl s ILE 5 Cb -0.31 -4.08 -0.12 0.00 0.01 0.00 0.00 42.46 37.97 2wvl s ILE 5 CO 0.39 0.36 1.76 -0.81 0.00 0.00 0.00 174.94 176.64 2wvl n PRO 6 N 2.92 2.47 0.00 2.79 -0.04 -1.26 -4.80 135.00 137.08 2wvl n PRO 6 Ca -0.03 0.90 0.13 0.00 -0.04 0.00 0.00 63.50 64.46 2wvl n PRO 6 Cb 0.50 -2.74 0.73 0.00 -0.04 0.00 0.00 33.50 31.95 2wvl n PRO 6 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2wvl n ASN 7 N 5.05 0.00 -3.71 3.54 0.23 -1.26 -4.81 115.26 114.31 2wvl n ASN 7 Ca 0.18 -0.54 -0.05 0.00 -0.53 0.00 0.00 54.58 53.65 2wvl n ASN 7 Cb 0.33 -0.11 -0.01 0.00 -2.08 0.00 0.00 39.78 37.91 2wvl n ASN 7 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 2wvl s HIS 8 N -2.22 -0.12 -0.24 -2.53 -3.43 -1.26 -5.06 115.29 100.42 2wvl s HIS 8 Ca 0.34 -0.28 -0.02 0.00 -0.80 0.00 0.00 55.06 54.29 2wvl s HIS 8 Cb 0.18 0.69 0.13 0.00 -1.43 0.00 0.00 32.58 32.14 2wvl s HIS 8 CO 0.34 -1.04 0.35 0.99 -2.00 0.00 0.00 174.74 173.37 2wvl s THR 9 N -3.37 -0.55 0.01 -5.38 2.01 -1.26 -1.39 115.64 105.72 2wvl s THR 9 Ca 0.13 -0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.69 2wvl s THR 9 Cb -0.03 -0.82 -0.05 0.00 0.01 0.00 0.00 72.50 71.61 2wvl s THR 9 CO 0.05 -0.18 1.19 -1.61 -0.69 0.00 0.00 174.62 173.38 2wvl s GLU 10 N 2.50 4.41 -0.21 4.92 0.41 -0.44 -4.91 118.70 125.38 2wvl s GLU 10 Ca 0.11 1.71 -0.08 0.00 -0.41 0.00 0.00 54.97 56.30 2wvl s GLU 10 Cb -0.15 -3.44 -0.04 0.00 -1.78 0.00 0.00 34.13 28.72 2wvl s GLU 10 CO -0.18 -0.32 0.09 1.03 -0.49 0.00 0.00 175.26 175.39 2wvl s ARG 11 N 1.52 3.97 -0.16 1.61 0.52 -1.26 -1.67 118.95 123.48 2wvl s ARG 11 Ca 0.57 -0.34 -0.05 0.00 -0.52 0.00 0.00 55.73 55.40 2wvl s ARG 11 Cb -0.27 -3.32 0.06 0.00 0.52 0.00 0.00 34.95 31.94 2wvl s ARG 11 CO 0.26 0.17 0.10 0.12 0.02 0.00 0.00 175.30 175.97 2wvl s PHE 12 N 0.69 0.12 0.00 -0.53 2.19 -0.09 -5.01 117.98 115.35 2wvl s PHE 12 Ca 0.05 -0.18 0.00 0.00 0.33 0.00 0.00 56.93 57.13 2wvl s PHE 12 Cb -0.13 -0.63 0.00 0.00 -1.31 0.00 0.00 43.02 40.95 2wvl s PHE 12 CO 0.02 -0.48 0.00 0.41 1.83 0.00 0.00 175.22 177.00 2wvl n GLY 13 N 5.29 2.73 0.48 13.12 0.00 -0.96 0.92 105.19 126.78 2wvl n GLY 13 Ca -0.06 0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2wvl n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wvl n VAL 14 N 0.00 0.21 -2.65 1.61 0.24 -0.32 -4.87 118.33 112.56 2wvl n VAL 14 Ca 0.00 -0.31 -0.41 0.00 -2.04 0.00 0.00 64.34 61.58 2wvl n VAL 14 Cb 0.00 0.26 -0.05 0.00 -1.47 0.00 0.00 33.84 32.58 2wvl n VAL 14 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2wvl s VAL 15 N -1.79 4.13 -0.29 3.34 1.01 0.26 -1.84 120.40 125.22 2wvl s VAL 15 Ca 0.30 1.89 0.03 0.00 0.00 0.00 0.00 61.98 64.19 2wvl s VAL 15 Cb 0.16 -4.20 0.08 0.00 0.00 0.00 0.00 36.38 32.41 2wvl s VAL 15 CO 0.24 0.35 -0.03 -0.13 0.00 0.00 0.00 175.10 175.52 2wvl s ARG 16 N -0.48 1.81 -0.18 2.72 3.00 0.26 -0.91 118.95 125.17 2wvl s ARG 16 Ca 0.46 -1.48 -0.27 0.00 0.00 0.00 0.00 55.73 54.44 2wvl s ARG 16 Cb -0.26 -2.93 -0.01 0.00 0.00 0.00 0.00 34.95 31.75 2wvl s ARG 16 CO 0.33 -0.73 0.91 -0.51 0.00 0.00 0.00 175.30 175.30 2wvl s LEU 17 N 1.09 4.16 0.16 2.53 1.02 -0.67 -0.83 118.68 126.14 2wvl s LEU 17 Ca -0.00 1.28 -0.26 0.00 0.02 0.00 0.00 54.13 55.16 2wvl s LEU 17 Cb -0.19 -3.36 -0.08 0.00 0.02 0.00 0.00 46.19 42.58 2wvl s LEU 17 CO -0.07 -0.48 0.81 -1.00 0.02 0.00 0.00 176.35 175.63 2wvl s HIS 18 N 2.43 3.90 0.75 0.29 3.76 0.51 -1.33 115.29 125.60 2wvl s HIS 18 Ca 0.41 1.67 -0.15 0.00 -0.15 0.00 0.00 55.06 56.83 2wvl s HIS 18 Cb -0.16 -2.82 0.00 0.00 1.11 0.00 0.00 32.58 30.71 2wvl s HIS 18 CO 0.12 0.46 0.79 -1.91 -0.85 0.00 0.00 174.74 173.35 2wvl n GLU 19 N 1.78 0.31 -1.50 1.40 4.07 -0.48 -4.31 120.64 121.92 2wvl n GLU 19 Ca -0.04 0.16 -0.44 0.00 -0.06 0.00 0.00 57.16 56.78 2wvl n GLU 19 Cb 0.49 -2.08 -0.01 0.00 -0.06 0.00 0.00 31.44 29.78 2wvl n GLU 19 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2wvl n VAL 20 N -2.67 1.92 -4.32 6.31 0.31 -1.26 -4.56 118.33 114.06 2wvl n VAL 20 Ca 0.11 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.65 2wvl n VAL 20 Cb 0.50 -0.64 -0.17 0.00 -0.91 0.00 0.00 33.84 32.63 2wvl n VAL 20 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2wvl s GLN 21 N -1.49 2.34 0.15 5.55 -0.21 -0.10 -4.65 119.66 121.24 2wvl s GLN 21 Ca 0.62 -0.59 -0.30 0.00 0.02 0.00 0.00 55.36 55.10 2wvl s GLN 21 Cb -0.69 -2.03 -0.07 0.00 1.00 0.00 0.00 33.01 31.22 2wvl s GLN 21 CO 0.58 -0.12 1.11 1.03 -2.12 0.00 0.00 175.29 175.77 2wvl s ARG 22 N 1.15 4.57 0.08 2.91 0.52 -1.26 -0.97 118.95 125.93 2wvl s ARG 22 Ca -0.02 1.71 -0.31 0.00 -0.52 0.00 0.00 55.73 56.59 2wvl s ARG 22 Cb -0.14 -3.30 -0.08 0.00 0.52 0.00 0.00 34.95 31.94 2wvl s ARG 22 CO -0.05 0.01 1.65 0.42 0.02 0.00 0.00 175.30 177.35 2wvl s ILE 23 N 0.05 3.01 -0.19 1.52 1.01 -1.15 -0.84 121.20 124.62 2wvl s ILE 23 Ca 0.51 0.48 0.12 0.00 0.00 0.00 0.00 60.65 61.76 2wvl s ILE 23 Cb -0.29 -3.31 -0.23 0.00 0.01 0.00 0.00 42.46 38.64 2wvl s ILE 23 CO 0.33 0.00 0.10 0.18 0.00 0.00 0.00 174.94 175.55 2wvl n LEU 24 N 5.50 1.05 -3.77 2.97 4.77 0.20 -4.83 117.00 122.88 2wvl n LEU 24 Ca 0.16 0.04 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 2wvl n LEU 24 Cb 0.40 -0.01 -0.16 0.00 -2.33 0.00 0.00 43.42 41.32 2wvl n LEU 24 CO 0.63 0.62 -0.35 -0.70 -1.33 0.00 0.00 177.39 176.25 2wvl s GLU 25 N -2.52 -0.01 0.37 3.23 2.12 -0.94 -5.00 118.70 115.95 2wvl s GLU 25 Ca -0.16 0.18 0.11 0.00 0.36 0.00 0.00 54.97 55.46 2wvl s GLU 25 Cb 0.07 -0.27 0.71 0.00 0.26 0.00 0.00 34.13 34.90 2wvl s GLU 25 CO 0.77 -0.17 1.83 -0.07 -0.54 0.00 0.00 175.26 177.08 2wvl h LEU 26 N 7.30 0.08 -6.44 2.70 3.38 -1.91 -2.09 115.31 118.32 2wvl h LEU 26 Ca -0.46 -0.02 -0.30 0.00 0.09 0.00 0.00 57.88 57.19 2wvl h LEU 26 Cb 1.12 -0.02 -0.32 0.00 0.09 0.00 0.00 40.66 41.53 2wvl h LEU 26 CO 0.48 0.40 -0.62 -0.62 0.09 0.00 0.00 178.44 178.17 2wvl s ASP 27 N -6.92 1.33 0.00 -0.43 2.15 -1.26 -4.11 116.67 107.42 2wvl s ASP 27 Ca -0.04 -0.78 0.32 0.00 0.43 0.00 0.00 52.55 52.48 2wvl s ASP 27 Cb 0.14 0.65 1.85 0.00 -0.30 0.00 0.00 42.92 45.26 2wvl s ASP 27 CO 0.73 -0.37 2.20 -1.54 -0.17 0.00 0.00 175.17 176.02 2wvl n SER 28 N 5.19 0.10 0.00 -0.34 3.41 -1.26 -4.67 113.62 116.04 2wvl n SER 28 Ca 0.00 -1.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 2wvl n SER 28 Cb 0.47 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2wvl n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvl n GLY 29 N 1.02 -1.62 3.59 5.00 0.00 -1.26 -4.78 105.19 107.13 2wvl n GLY 29 Ca 0.24 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.51 2wvl n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvl s ARG 30 N 0.00 3.90 0.00 1.61 0.52 -1.26 -2.30 118.95 121.42 2wvl s ARG 30 Ca 0.00 -0.12 0.18 0.00 -0.52 0.00 0.00 55.73 55.27 2wvl s ARG 30 Cb 0.00 -3.69 0.98 0.00 0.52 0.00 0.00 34.95 32.76 2wvl s ARG 30 CO 0.00 -0.32 1.51 0.28 0.02 0.00 0.00 175.30 176.79 2wvl n VAL 31 N 5.14 0.27 0.00 3.52 0.31 -1.26 -4.91 118.33 121.40 2wvl n VAL 31 Ca -0.09 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2wvl n VAL 31 Cb 0.51 -0.78 0.00 0.00 -0.91 0.00 0.00 33.84 32.66 2wvl n VAL 31 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2wvl n ARG 32 N -1.16 0.00 -0.98 5.55 1.85 -1.26 0.11 116.66 120.77 2wvl n ARG 32 Ca 0.11 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.93 2wvl n ARG 32 Cb 0.11 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.50 2wvl n ARG 32 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2wvl n ASP 33 N 0.00 -5.22 -4.70 2.89 9.92 -1.26 -4.93 116.55 113.24 2wvl n ASP 33 Ca 0.00 0.07 -0.41 0.00 -0.53 0.00 0.00 54.79 53.91 2wvl n ASP 33 Cb 0.00 -3.32 -0.03 0.00 -0.64 0.00 0.00 41.12 37.13 2wvl n ASP 33 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2wvl s GLU 34 N -2.03 4.46 -0.86 -1.24 2.02 0.12 -4.96 118.70 116.22 2wvl s GLU 34 Ca 0.00 1.23 -0.31 0.00 0.02 0.00 0.00 54.97 55.91 2wvl s GLU 34 Cb 0.00 -3.49 -0.19 0.00 0.10 0.00 0.00 34.13 30.55 2wvl s GLU 34 CO 0.00 -0.13 2.59 0.45 0.02 0.00 0.00 175.26 178.20 2wvl n SER 35 N 4.32 0.73 0.00 -0.19 2.88 -1.26 -4.95 113.62 115.15 2wvl n SER 35 Ca 0.05 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2wvl n SER 35 Cb 0.50 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 2wvl n SER 35 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2wvl n PRO 36 N 8.50 0.72 0.00 -1.46 -0.04 -1.26 -4.98 135.00 136.48 2wvl n PRO 36 Ca 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 2wvl n PRO 36 Cb 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.58 2wvl n PRO 36 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wvl n ALA 37 N -3.00 0.00 -1.32 0.55 0.00 -1.26 -5.04 120.51 110.44 2wvl n ALA 37 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 2wvl n ALA 37 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2wvl n ALA 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvl n VAL 38 N 0.00 0.00 -1.07 0.00 0.31 -1.26 -4.41 118.33 111.91 2wvl n VAL 38 Ca 0.00 0.04 -0.24 0.00 -0.01 0.00 0.00 64.34 64.13 2wvl n VAL 38 Cb 0.00 -0.49 0.14 0.00 -0.91 0.00 0.00 33.84 32.58 2wvl n VAL 38 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wvl n GLY 39 N -3.91 4.61 3.31 2.92 0.00 -1.26 -4.90 105.19 105.96 2wvl n GLY 39 Ca 0.00 -1.29 -0.16 0.00 0.00 0.00 0.00 46.02 44.57 2wvl n GLY 39 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wvl s LEU 40 N -3.09 1.78 -0.30 0.99 0.05 -1.26 -4.02 118.68 112.83 2wvl s LEU 40 Ca 0.53 -1.34 -0.11 0.00 0.05 0.00 0.00 54.13 53.26 2wvl s LEU 40 Cb 0.44 -0.03 -0.03 0.00 -2.05 0.00 0.00 46.19 44.52 2wvl s LEU 40 CO 0.07 -0.68 0.18 -0.13 -0.55 0.00 0.00 176.35 175.24 2wvl s ARG 41 N -4.00 3.67 -0.18 1.48 1.81 0.42 -4.91 118.95 117.24 2wvl s ARG 41 Ca 0.35 -0.51 -0.08 0.00 -1.72 0.00 0.00 55.73 53.77 2wvl s ARG 41 Cb 0.07 -3.65 -0.04 0.00 -0.45 0.00 0.00 34.95 30.88 2wvl s ARG 41 CO 0.12 -0.30 0.07 0.50 -0.68 0.00 0.00 175.30 175.00 2wvl s ARG 42 N 1.71 4.00 -0.20 3.54 3.52 -1.26 -0.96 118.95 129.29 2wvl s ARG 42 Ca 0.06 -0.33 0.01 0.00 -0.13 0.00 0.00 55.73 55.34 2wvl s ARG 42 Cb -0.17 -3.23 0.03 0.00 -1.56 0.00 0.00 34.95 30.02 2wvl s ARG 42 CO 0.09 0.28 -0.17 -0.51 -0.81 0.00 0.00 175.30 174.18 2wvl s LEU 43 N 0.36 2.45 0.19 -0.88 1.43 -0.25 -4.99 118.68 116.98 2wvl s LEU 43 Ca 0.04 -0.78 -0.32 0.00 -1.03 0.00 0.00 54.13 52.04 2wvl s LEU 43 Cb -0.12 -1.51 -0.12 0.00 0.03 0.00 0.00 46.19 44.46 2wvl s LEU 43 CO -0.00 -0.04 1.70 -0.67 0.23 0.00 0.00 176.35 177.57 2wvl n ASP 44 N 4.60 3.80 -0.30 2.29 2.03 -1.26 -2.11 116.55 125.59 2wvl n ASP 44 Ca -0.19 1.06 -0.01 0.00 0.52 0.00 0.00 54.79 56.17 2wvl n ASP 44 Cb 0.49 -1.54 0.05 0.00 -0.72 0.00 0.00 41.12 39.40 2wvl n ASP 44 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2wvl h ASP 45 N 6.71 -1.13 -0.26 1.67 3.58 -1.84 -0.80 116.42 124.35 2wvl h ASP 45 Ca -0.44 0.27 0.06 0.00 0.42 0.00 0.00 57.03 57.34 2wvl h ASP 45 Cb 1.22 0.62 -0.06 0.00 1.72 0.00 0.00 39.33 42.83 2wvl h ASP 45 CO 0.94 -0.29 -0.14 0.00 -2.88 0.00 0.00 179.24 176.87 2wvl h ALA 46 N 1.43 0.06 -0.70 -0.78 0.00 -1.92 -1.25 119.26 116.10 2wvl h ALA 46 Ca 0.33 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.38 2wvl h ALA 46 Cb 0.59 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2wvl h ALA 46 CO -0.86 -0.55 0.46 -0.44 0.00 0.00 0.00 179.25 177.86 2wvl h ASP 47 N -0.11 0.70 -0.46 0.00 3.32 -1.78 -0.96 116.42 117.14 2wvl h ASP 47 Ca 0.14 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.13 2wvl h ASP 47 Cb 0.32 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 2wvl h ASP 47 CO -0.33 0.48 0.09 -0.07 -1.72 0.00 0.00 179.24 177.68 2wvl h LEU 48 N 0.81 0.72 -0.31 1.55 3.38 -0.08 -2.27 115.31 119.12 2wvl h LEU 48 Ca 0.28 -0.25 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 2wvl h LEU 48 Cb 0.10 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2wvl h LEU 48 CO -0.08 0.79 -0.65 0.03 0.09 0.00 0.00 178.44 178.62 2wvl h ARG 49 N 0.62 0.73 0.00 1.13 3.08 -0.95 -1.75 114.38 117.25 2wvl h ARG 49 Ca 0.14 -0.52 -0.00 0.00 0.07 0.00 0.00 59.98 59.67 2wvl h ARG 49 Cb 0.37 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 2wvl h ARG 49 CO 0.01 1.14 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.60 2wvl h ASP 50 N 0.54 0.00 0.08 7.04 3.32 -1.07 0.15 116.42 126.47 2wvl h ASP 50 Ca -0.01 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.76 2wvl h ASP 50 Cb 1.25 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.82 2wvl h ASP 50 CO 0.13 0.01 -1.10 0.58 -1.72 0.00 0.00 179.24 177.14 2wvl h VAL 51 N 0.00 1.29 -0.22 -1.35 2.07 -1.05 -3.27 116.25 113.72 2wvl h VAL 51 Ca -0.00 -2.34 -0.10 0.00 0.82 0.00 0.00 66.70 65.07 2wvl h VAL 51 Cb 0.03 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 2wvl h VAL 51 CO 0.00 0.72 -0.31 -0.07 0.02 0.00 0.00 177.57 177.93 2wvl h LEU 52 N 0.34 0.46 -2.13 2.57 3.38 -0.26 -0.96 115.31 118.71 2wvl h LEU 52 Ca -0.14 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.67 2wvl h LEU 52 Cb 1.76 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.38 2wvl h LEU 52 CO 0.21 0.75 0.30 -0.33 0.09 0.00 0.00 178.44 179.46 2wvl h GLU 53 N 0.39 0.00 -0.69 1.13 5.08 -0.82 0.45 114.58 120.12 2wvl h GLU 53 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wvl h GLU 53 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2wvl h GLU 53 CO 0.06 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.11 2wvl n GLN 54 N -3.06 3.51 -4.96 2.33 6.02 -0.37 -4.93 117.38 115.92 2wvl n GLN 54 Ca -0.01 -2.84 -0.33 0.00 -0.01 0.00 0.00 57.00 53.81 2wvl n GLN 54 Cb 0.37 -1.83 -0.15 0.00 1.02 0.00 0.00 30.24 29.65 2wvl n GLN 54 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2wvl s THR 55 N -1.64 2.64 -0.06 5.09 2.01 0.16 -0.34 115.64 123.49 2wvl s THR 55 Ca 0.51 -0.81 -0.16 0.00 0.31 0.00 0.00 61.69 61.54 2wvl s THR 55 Cb 0.32 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.70 2wvl s THR 55 CO 0.27 0.54 0.42 0.00 -0.69 0.00 0.00 174.62 175.16 2wvl s ALA 56 N 0.34 3.61 -0.25 7.40 0.00 0.15 -1.67 121.76 131.35 2wvl s ALA 56 Ca -0.14 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 51.61 2wvl s ALA 56 Cb -0.17 -2.48 0.06 0.00 0.00 0.00 0.00 23.12 20.53 2wvl s ALA 56 CO 0.07 0.27 -0.11 0.42 0.00 0.00 0.00 175.76 176.40 2wvl s ILE 57 N -0.30 2.08 -0.12 0.00 -1.09 0.30 0.48 121.20 122.55 2wvl s ILE 57 Ca 0.24 -1.50 -0.21 0.00 -2.23 0.00 0.00 60.65 56.95 2wvl s ILE 57 Cb -0.16 -2.17 -0.03 0.00 -1.58 0.00 0.00 42.46 38.52 2wvl s ILE 57 CO 0.11 0.03 0.60 -0.69 -1.23 0.00 0.00 174.94 173.77 2wvl s VAL 58 N 1.16 5.09 -0.46 2.92 1.01 0.11 -1.16 120.40 129.07 2wvl s VAL 58 Ca -0.07 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.13 2wvl s VAL 58 Cb -0.19 -3.94 0.12 0.00 0.00 0.00 0.00 36.38 32.37 2wvl s VAL 58 CO -0.06 0.24 0.21 -0.69 0.00 0.00 0.00 175.10 174.80 2wvl s VAL 59 N 1.06 2.82 0.21 2.92 1.01 0.17 -1.71 120.40 126.87 2wvl s VAL 59 Ca 0.31 -2.69 -0.30 0.00 0.00 0.00 0.00 61.98 59.30 2wvl s VAL 59 Cb -0.16 -2.96 -0.08 0.00 0.00 0.00 0.00 36.38 33.17 2wvl s VAL 59 CO 0.13 -0.73 1.06 -2.16 0.00 0.00 0.00 175.10 173.41 2wvl s PRO 60 N 0.43 4.66 -0.14 2.72 0.04 -1.26 -2.27 135.00 139.18 2wvl s PRO 60 Ca 0.13 1.67 -0.07 0.00 0.04 0.00 0.00 61.00 62.78 2wvl s PRO 60 Cb -0.22 -3.27 0.06 0.00 0.04 0.00 0.00 34.50 31.11 2wvl s PRO 60 CO -0.04 0.20 0.32 -0.08 0.04 0.00 0.00 177.00 177.43 2wvl s THR 61 N -0.60 -0.14 -0.30 1.26 -1.32 -0.25 -3.97 115.64 110.32 2wvl s THR 61 Ca 0.46 0.15 -0.04 0.00 -1.21 0.00 0.00 61.69 61.06 2wvl s THR 61 Cb -0.29 -0.49 0.04 0.00 -1.51 0.00 0.00 72.50 70.25 2wvl s THR 61 CO 0.35 0.06 0.03 -0.60 -2.21 0.00 0.00 174.62 172.26 2wvl s ARG 62 N 1.59 2.60 -1.20 7.08 3.52 -1.26 -0.95 118.95 130.34 2wvl s ARG 62 Ca -0.07 -1.16 -0.21 0.00 -0.13 0.00 0.00 55.73 54.16 2wvl s ARG 62 Cb -0.10 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 30.04 2wvl s ARG 62 CO -0.10 -0.59 0.71 0.09 -0.81 0.00 0.00 175.30 174.60 2wvl n ASN 63 N 4.71 -4.31 -4.59 -2.12 3.02 -1.26 -4.90 115.26 105.81 2wvl n ASN 63 Ca -0.14 -1.08 -0.32 0.00 -0.03 0.00 0.00 54.58 53.02 2wvl n ASN 63 Cb 0.45 -2.98 -0.10 0.00 -0.61 0.00 0.00 39.78 36.53 2wvl n ASN 63 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2wvl s GLU 64 N -6.37 2.47 0.08 3.52 2.56 -1.26 -5.07 118.70 114.64 2wvl s GLU 64 Ca 0.41 -0.78 -0.36 0.00 0.00 0.00 0.00 54.97 54.23 2wvl s GLU 64 Cb -0.16 -2.46 -0.18 0.00 2.00 0.00 0.00 34.13 33.33 2wvl s GLU 64 CO 0.89 0.58 1.04 0.54 -0.56 0.00 0.00 175.26 177.76 2wvl n ARG 65 N 1.42 0.43 -0.26 4.30 1.74 -1.26 -4.83 116.66 118.20 2wvl n ARG 65 Ca -0.15 0.15 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 2wvl n ARG 65 Cb 0.52 -1.60 0.10 0.00 -1.02 0.00 0.00 32.46 30.47 2wvl n ARG 65 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2wvl h LEU 66 N 3.01 1.03 -1.29 0.55 3.38 -2.00 -2.37 115.31 117.62 2wvl h LEU 66 Ca -0.45 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.40 2wvl h LEU 66 Cb 1.40 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 2wvl h LEU 66 CO 0.67 0.92 0.51 0.11 0.09 0.00 0.00 178.44 180.74 2wvl h LYS 67 N 1.09 0.88 -0.86 1.13 6.56 -1.99 0.18 116.57 123.56 2wvl h LYS 67 Ca 0.25 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.79 2wvl h LYS 67 Cb 0.22 -0.20 -0.04 0.00 -0.57 0.00 0.00 32.23 31.64 2wvl h LYS 67 CO -0.02 0.58 0.54 -0.07 -2.06 0.00 0.00 179.45 178.42 2wvl h LEU 68 N 0.91 1.01 -0.02 2.94 3.38 -1.77 -2.31 115.31 119.45 2wvl h LEU 68 Ca 0.32 -0.05 -0.26 0.00 0.09 0.00 0.00 57.88 57.97 2wvl h LEU 68 Cb 0.11 -0.25 0.02 0.00 0.09 0.00 0.00 40.66 40.63 2wvl h LEU 68 CO -0.10 0.76 -1.06 0.25 0.09 0.00 0.00 178.44 178.38 2wvl h LEU 69 N 1.17 0.79 -0.12 1.67 5.85 -0.65 -1.65 115.31 122.36 2wvl h LEU 69 Ca 0.31 -0.65 0.03 0.00 0.84 0.00 0.00 57.88 58.41 2wvl h LEU 69 Cb -0.08 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 2wvl h LEU 69 CO -0.06 1.46 -0.09 -0.08 -0.34 0.00 0.00 178.44 179.33 2wvl h GLU 70 N 0.32 -0.09 -0.50 1.25 4.81 -0.77 -0.75 114.58 118.84 2wvl h GLU 70 Ca -0.13 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.18 2wvl h GLU 70 Cb 1.72 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 31.02 2wvl h GLU 70 CO 0.20 -0.06 -0.45 0.78 -0.73 0.00 0.00 179.01 178.75 2wvl h GLY 71 N -0.10 -0.57 0.63 1.92 0.00 -1.17 -0.19 103.07 103.60 2wvl h GLY 71 Ca 0.08 0.58 0.04 0.00 0.00 0.00 0.00 47.33 48.03 2wvl h GLY 71 CO -0.18 -0.16 -0.02 -2.08 0.00 0.00 0.00 176.54 174.10 2wvl h VAL 72 N -0.28 0.82 -0.48 4.60 2.07 -0.98 -1.63 116.25 120.37 2wvl h VAL 72 Ca 0.15 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.74 2wvl h VAL 72 Cb 0.57 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.06 2wvl h VAL 72 CO -0.64 0.01 0.10 -0.07 0.02 0.00 0.00 177.57 176.99 2wvl h LEU 73 N 0.04 0.01 -2.20 2.57 3.38 -0.53 -1.46 115.31 117.12 2wvl h LEU 73 Ca 0.10 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2wvl h LEU 73 Cb 0.14 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2wvl h LEU 73 CO -0.19 0.03 0.00 0.77 0.09 0.00 0.00 178.44 179.14 2wvl h SER 74 N 0.23 0.00 0.08 -0.43 4.64 -0.09 -1.49 113.55 116.50 2wvl h SER 74 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2wvl h SER 74 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2wvl h SER 74 CO -0.31 0.00 -0.74 0.61 -0.87 0.00 0.00 176.83 175.52 2wvl n GLY 75 N -1.17 -0.74 3.68 -0.77 0.00 -0.56 -4.91 105.19 100.73 2wvl n GLY 75 Ca -0.02 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 2wvl n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvl s ILE 76 N -2.83 4.23 0.18 -0.61 1.01 -0.56 -3.08 121.20 119.54 2wvl s ILE 76 Ca 0.12 1.55 -0.32 0.00 0.00 0.00 0.00 60.65 62.00 2wvl s ILE 76 Cb 0.17 -4.00 -0.15 0.00 0.01 0.00 0.00 42.46 38.49 2wvl s ILE 76 CO 0.74 -0.02 1.17 -2.65 0.00 0.00 0.00 174.94 174.18 2wvl n PRO 77 N 5.41 1.23 -0.32 2.79 -0.02 -1.26 -4.82 135.00 138.00 2wvl n PRO 77 Ca 0.11 0.44 0.23 0.00 -2.02 0.00 0.00 63.50 62.26 2wvl n PRO 77 Cb 0.46 -1.94 0.45 0.00 -0.02 0.00 0.00 33.50 32.45 2wvl n PRO 77 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2wvl h HIS 78 N 3.36 0.69 0.00 6.00 2.76 -1.97 -1.82 115.15 124.18 2wvl h HIS 78 Ca -0.43 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.78 2wvl h HIS 78 Cb 1.34 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 30.16 2wvl h HIS 78 CO 0.54 -0.28 0.00 0.93 -1.30 0.00 0.00 177.93 177.81 2wvl h GLU 79 N 0.19 0.00 -5.83 5.26 3.07 -1.88 -3.44 114.58 111.95 2wvl h GLU 79 Ca 0.71 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.98 2wvl h GLU 79 Cb 1.66 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.49 2wvl h GLU 79 CO -0.69 0.00 -0.17 0.00 -1.40 0.00 0.00 179.01 176.75 2wvl s ALA 80 N -3.46 3.56 0.12 3.43 0.00 -0.68 -3.96 121.76 120.77 2wvl s ALA 80 Ca 0.02 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.46 2wvl s ALA 80 Cb 0.09 -2.54 -0.09 0.00 0.00 0.00 0.00 23.12 20.58 2wvl s ALA 80 CO 0.37 0.19 1.55 -1.17 0.00 0.00 0.00 175.76 176.70 2wvl s LEU 81 N -0.04 4.37 -0.23 0.00 2.96 -0.67 -4.88 118.68 120.19 2wvl s LEU 81 Ca 0.24 2.50 -0.13 0.00 -0.22 0.00 0.00 54.13 56.53 2wvl s LEU 81 Cb -0.16 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.91 2wvl s LEU 81 CO 0.11 -0.81 0.26 -0.63 -1.32 0.00 0.00 176.35 173.96 2wvl s ILE 82 N 1.63 5.29 -0.22 6.68 1.01 -1.22 -0.54 121.20 133.83 2wvl s ILE 82 Ca 0.70 0.39 0.02 0.00 0.00 0.00 0.00 60.65 61.76 2wvl s ILE 82 Cb -0.41 -3.59 0.04 0.00 0.01 0.00 0.00 42.46 38.51 2wvl s ILE 82 CO 0.31 0.30 -0.15 -0.76 0.00 0.00 0.00 174.94 174.64 2wvl s LEU 83 N 1.19 2.75 -0.40 2.97 1.43 -0.31 -0.46 118.68 125.86 2wvl s LEU 83 Ca 0.12 -1.02 -0.19 0.00 -1.03 0.00 0.00 54.13 52.01 2wvl s LEU 83 Cb -0.14 -1.49 0.01 0.00 0.03 0.00 0.00 46.19 44.60 2wvl s LEU 83 CO 0.06 -0.10 0.57 -0.69 0.23 0.00 0.00 176.35 176.42 2wvl s VAL 84 N 1.21 4.94 -0.48 -1.59 1.01 -0.32 0.41 120.40 125.58 2wvl s VAL 84 Ca -0.02 0.17 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 2wvl s VAL 84 Cb -0.17 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.18 2wvl s VAL 84 CO -0.09 -0.41 0.60 0.00 0.00 0.00 0.00 175.10 175.20 2wvl s ALA 85 N 2.56 3.38 0.02 5.51 0.00 -0.96 -2.13 121.76 130.14 2wvl s ALA 85 Ca 0.20 -1.58 -0.01 0.00 0.00 0.00 0.00 51.96 50.57 2wvl s ALA 85 Cb -0.15 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2wvl s ALA 85 CO 0.16 -1.88 0.17 0.45 0.00 0.00 0.00 175.76 174.65 2wvl s SER 86 N 2.37 6.20 0.00 0.00 0.15 0.18 -1.09 113.70 121.51 2wvl s SER 86 Ca 0.16 0.27 0.18 0.00 0.70 0.00 0.00 55.95 57.26 2wvl s SER 86 Cb -0.18 -1.89 0.29 0.00 -1.71 0.00 0.00 66.02 62.53 2wvl s SER 86 CO 0.14 0.23 1.11 -3.20 1.20 0.00 0.00 173.24 172.72 2wvl n ASN 87 N 0.76 0.67 -4.75 5.45 4.05 -0.13 0.58 115.26 121.90 2wvl n ASN 87 Ca -0.09 -1.99 -0.29 0.00 0.45 0.00 0.00 54.58 52.65 2wvl n ASN 87 Cb 0.52 -0.26 0.14 0.00 1.23 0.00 0.00 39.78 41.41 2wvl n ASN 87 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 2wvl s SER 88 N -1.68 3.37 0.42 1.20 0.01 -1.24 -4.70 113.70 111.09 2wvl s SER 88 Ca 0.23 1.15 -0.26 0.00 1.31 0.00 0.00 55.95 58.39 2wvl s SER 88 Cb 0.27 -1.79 -0.08 0.00 0.21 0.00 0.00 66.02 64.62 2wvl s SER 88 CO -0.12 -2.66 1.33 -0.94 0.41 0.00 0.00 173.24 171.26 2wvl s SER 89 N -3.75 6.17 0.05 2.44 1.04 -1.26 -4.64 113.70 113.75 2wvl s SER 89 Ca 0.64 2.70 -0.07 0.00 0.48 0.00 0.00 55.95 59.70 2wvl s SER 89 Cb -0.16 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.33 2wvl s SER 89 CO 0.55 -0.95 0.43 -2.65 0.98 0.00 0.00 173.24 171.60 2wvl n PRO 90 N -0.01 -0.10 0.20 4.02 -0.02 -1.26 -0.93 135.00 136.91 2wvl n PRO 90 Ca 0.04 0.42 -0.15 0.00 -2.02 0.00 0.00 63.50 61.80 2wvl n PRO 90 Cb 0.43 -0.63 -0.08 0.00 -0.02 0.00 0.00 33.50 33.21 2wvl n PRO 90 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2wvl h ASP 91 N 0.00 -1.21 -0.58 2.55 1.82 -2.01 -2.99 116.42 113.99 2wvl h ASP 91 Ca 0.07 0.11 0.09 0.00 -0.39 0.00 0.00 57.03 56.91 2wvl h ASP 91 Cb 0.14 0.41 -0.07 0.00 0.68 0.00 0.00 39.33 40.49 2wvl h ASP 91 CO -0.27 -0.53 0.18 0.03 -1.61 0.00 0.00 179.24 177.04 2wvl h ARG 92 N -0.78 0.34 -0.87 0.28 3.08 -1.39 -1.61 114.38 113.43 2wvl h ARG 92 Ca -0.04 -0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.18 2wvl h ARG 92 Cb 0.70 -0.08 -0.11 0.00 0.08 0.00 0.00 29.97 30.57 2wvl h ARG 92 CO -0.11 0.22 0.39 0.35 -1.07 0.00 0.00 179.97 179.76 2wvl h PHE 93 N 0.35 0.66 0.53 3.04 3.57 -1.11 0.22 116.94 124.20 2wvl h PHE 93 Ca 0.29 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.81 2wvl h PHE 93 Cb 0.38 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 2wvl h PHE 93 CO -0.19 0.03 -0.50 0.37 -2.23 0.00 0.00 178.31 175.79 2wvl h GLN 94 N 0.46 -0.98 -1.01 1.11 5.75 -1.15 -0.19 115.11 119.10 2wvl h GLN 94 Ca 0.52 0.07 0.24 0.00 -0.15 0.00 0.00 58.65 59.32 2wvl h GLN 94 Cb 0.90 0.22 -0.11 0.00 1.07 0.00 0.00 27.48 29.56 2wvl h GLN 94 CO -0.47 -0.65 0.63 0.52 -2.65 0.00 0.00 178.83 176.20 2wvl h MET 95 N -1.02 0.52 -0.43 1.69 2.86 -0.54 0.13 114.93 118.15 2wvl h MET 95 Ca -0.07 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.48 2wvl h MET 95 Cb 0.87 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 2wvl h MET 95 CO -0.04 0.34 0.04 0.93 1.06 0.00 0.00 176.91 179.25 2wvl h GLU 96 N 0.54 0.73 -0.31 1.72 5.08 -0.20 -0.01 114.58 122.12 2wvl h GLU 96 Ca 0.60 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.76 2wvl h GLU 96 Cb 1.27 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 2wvl h GLU 96 CO -0.37 0.78 0.19 0.00 -1.00 0.00 0.00 179.01 178.61 2wvl h ARG 97 N 0.57 0.39 0.14 2.33 3.08 0.11 -1.20 114.38 119.80 2wvl h ARG 97 Ca 0.13 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2wvl h ARG 97 Cb 0.42 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2wvl h ARG 97 CO 0.01 0.26 -0.14 -0.44 -1.07 0.00 0.00 179.97 178.59 2wvl h ASP 98 N 0.40 -0.38 -0.44 7.04 3.32 -1.20 -0.94 116.42 124.22 2wvl h ASP 98 Ca 0.12 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.29 2wvl h ASP 98 Cb -0.03 0.14 -0.10 0.00 0.22 0.00 0.00 39.33 39.56 2wvl h ASP 98 CO -0.04 -0.22 -0.36 0.25 -1.72 0.00 0.00 179.24 177.15 2wvl h LEU 99 N -0.32 -1.22 -0.44 1.55 6.46 -0.63 -0.66 115.31 120.06 2wvl h LEU 99 Ca 0.00 0.21 -0.02 0.00 -0.12 0.00 0.00 57.88 57.96 2wvl h LEU 99 Cb 0.30 0.56 -0.02 0.00 -0.73 0.00 0.00 40.66 40.78 2wvl h LEU 99 CO -0.04 -0.33 0.21 0.25 -0.62 0.00 0.00 178.44 177.91 2wvl h LEU 100 N -0.26 0.57 0.10 2.25 5.85 -1.19 -1.34 115.31 121.29 2wvl h LEU 100 Ca 0.17 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2wvl h LEU 100 Cb 0.56 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 2wvl h LEU 100 CO -0.58 0.53 -0.26 -0.08 -0.34 0.00 0.00 178.44 177.72 2wvl h GLU 101 N 0.56 -0.44 -0.43 1.25 4.81 -0.50 0.24 114.58 120.07 2wvl h GLU 101 Ca 0.15 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.48 2wvl h GLU 101 Cb 0.12 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.50 2wvl h GLU 101 CO -0.02 -0.29 -0.41 0.93 -0.73 0.00 0.00 179.01 178.49 2wvl h GLU 102 N -0.45 -0.29 0.02 1.92 4.39 -1.07 -1.21 114.58 117.89 2wvl h GLU 102 Ca 0.04 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.77 2wvl h GLU 102 Cb 0.49 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2wvl h GLU 102 CO -0.16 -0.19 -0.10 0.35 -1.16 0.00 0.00 179.01 177.75 2wvl h PHE 103 N -0.30 -0.26 -0.54 4.33 3.57 -0.57 -0.55 116.94 122.63 2wvl h PHE 103 Ca 0.15 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.59 2wvl h PHE 103 Cb 0.57 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 2wvl h PHE 103 CO -0.62 -0.15 0.04 0.00 -2.23 0.00 0.00 178.31 175.35 2wvl h ALA 104 N 0.77 1.06 0.88 2.41 0.00 -0.37 -1.61 119.26 122.40 2wvl h ALA 104 Ca 0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2wvl h ALA 104 Cb 0.22 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2wvl h ALA 104 CO -0.09 0.60 -0.42 1.25 0.00 0.00 0.00 179.25 180.59 2wvl h HIS 105 N 0.83 -1.09 -0.89 0.00 -0.00 -1.09 -0.71 115.15 112.20 2wvl h HIS 105 Ca 0.16 -0.03 0.19 0.00 -0.00 0.00 0.00 60.37 60.70 2wvl h HIS 105 Cb 0.44 0.36 -0.07 0.00 -0.00 0.00 0.00 27.41 28.14 2wvl h HIS 105 CO 0.03 -0.68 0.58 -0.07 -0.00 0.00 0.00 177.93 177.79 2wvl h LEU 106 N -1.23 0.45 -3.12 0.26 3.38 -0.92 -1.69 115.31 112.43 2wvl h LEU 106 Ca -0.12 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2wvl h LEU 106 Cb 0.91 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2wvl h LEU 106 CO 0.20 0.19 0.00 0.35 0.09 0.00 0.00 178.44 179.27 2wvl n THR 107 N -4.52 1.78 -4.05 0.22 -2.24 -0.62 -5.02 114.28 99.83 2wvl n THR 107 Ca 0.19 -1.44 -0.44 0.00 -2.27 0.00 0.00 64.05 60.09 2wvl n THR 107 Cb 0.65 0.07 0.02 0.00 -2.10 0.00 0.00 70.33 68.97 2wvl n THR 107 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wvl n GLU 108 N 0.16 -0.36 -3.82 -0.78 1.02 -0.39 -4.98 120.64 111.50 2wvl n GLU 108 Ca 0.19 0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 57.31 2wvl n GLU 108 Cb 0.74 -2.27 -0.10 0.00 -0.02 0.00 0.00 31.44 29.78 2wvl n GLU 108 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2wvl s ARG 109 N -7.14 0.42 0.28 3.49 1.70 -0.53 -5.05 118.95 112.12 2wvl s ARG 109 Ca 0.43 -0.04 -0.29 0.00 -0.47 0.00 0.00 55.73 55.35 2wvl s ARG 109 Cb -0.24 0.19 -0.10 0.00 -0.57 0.00 0.00 34.95 34.23 2wvl s ARG 109 CO 0.93 -0.09 1.36 -1.25 -1.08 0.00 0.00 175.30 175.18 2wvl s PRO 110 N -0.70 4.32 0.19 3.89 0.04 -1.26 -4.67 135.00 136.80 2wvl s PRO 110 Ca -0.08 2.23 0.02 0.00 0.04 0.00 0.00 61.00 63.21 2wvl s PRO 110 Cb -0.04 -3.10 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 2wvl s PRO 110 CO 0.02 -0.30 0.00 0.00 0.04 0.00 0.00 177.00 176.76 2wvl s ALA 111 N -0.48 1.47 0.09 8.56 0.00 -1.26 -3.40 121.76 126.74 2wvl s ALA 111 Ca 0.54 -1.64 0.03 0.00 0.00 0.00 0.00 51.96 50.89 2wvl s ALA 111 Cb -0.40 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2wvl s ALA 111 CO 0.47 -0.31 -0.08 -0.51 0.00 0.00 0.00 175.76 175.33 2wvl s LEU 112 N -3.21 2.44 -0.15 0.00 1.43 0.39 -2.64 118.68 116.94 2wvl s LEU 112 Ca 0.26 -0.87 -0.18 0.00 -1.03 0.00 0.00 54.13 52.30 2wvl s LEU 112 Cb 0.06 -0.18 0.05 0.00 0.03 0.00 0.00 46.19 46.15 2wvl s LEU 112 CO 0.05 -0.35 0.49 -0.51 0.23 0.00 0.00 176.35 176.26 2wvl s ILE 113 N -2.86 0.01 0.07 -0.59 2.07 -0.42 -1.18 121.20 118.29 2wvl s ILE 113 Ca 0.07 -0.07 -0.08 0.00 -1.41 0.00 0.00 60.65 59.16 2wvl s ILE 113 Cb 0.00 -0.71 -0.01 0.00 0.13 0.00 0.00 42.46 41.87 2wvl s ILE 113 CO -0.02 -0.04 0.15 0.72 -1.91 0.00 0.00 174.94 173.84 2wvl s PHE 114 N -0.11 0.18 -0.14 3.50 -0.12 -0.90 -4.44 117.98 115.94 2wvl s PHE 114 Ca -0.03 -0.57 -0.06 0.00 -0.05 0.00 0.00 56.93 56.22 2wvl s PHE 114 Cb -0.03 -0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.22 2wvl s PHE 114 CO 0.02 -0.48 0.05 -1.58 -0.05 0.00 0.00 175.22 173.18 2wvl s HIS 115 N -3.46 3.27 0.54 3.49 5.65 -1.26 -0.65 115.29 122.88 2wvl s HIS 115 Ca 0.02 0.16 0.24 0.00 0.25 0.00 0.00 55.06 55.73 2wvl s HIS 115 Cb 0.03 -1.97 1.44 0.00 -1.18 0.00 0.00 32.58 30.90 2wvl s HIS 115 CO -0.09 0.33 2.07 0.37 -0.65 0.00 0.00 174.74 176.77 2wvl h GLN 116 N 5.98 0.00 -0.71 2.88 4.15 -0.24 -0.44 115.11 126.73 2wvl h GLN 116 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 2wvl h GLN 116 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.88 2wvl h GLN 116 CO 0.64 0.00 0.00 1.63 -1.93 0.00 0.00 178.83 179.17 2wvl n LYS 117 N -4.26 2.98 -1.71 1.69 4.76 -1.26 -4.13 118.16 116.23 2wvl n LYS 117 Ca 0.04 -2.72 -0.42 0.00 -2.87 0.00 0.00 58.31 52.34 2wvl n LYS 117 Cb 0.37 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 31.89 2wvl n LYS 117 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wvl s ASP 118 N -0.98 6.36 0.38 4.39 -1.08 -0.18 -4.83 116.67 120.72 2wvl s ASP 118 Ca 0.49 2.52 0.05 0.00 -0.52 0.00 0.00 52.55 55.10 2wvl s ASP 118 Cb 0.27 -2.53 0.76 0.00 -1.46 0.00 0.00 42.92 39.97 2wvl s ASP 118 CO 0.31 -1.15 2.02 1.55 0.52 0.00 0.00 175.17 178.42 2wvl h PRO 119 N 11.00 0.68 -0.76 4.34 0.13 -1.92 -2.99 132.00 142.49 2wvl h PRO 119 Ca -0.47 -0.04 0.07 0.00 -0.87 0.00 0.00 66.00 64.69 2wvl h PRO 119 Cb 1.23 -0.15 -0.05 0.00 0.13 0.00 0.00 31.00 32.16 2wvl h PRO 119 CO 0.95 0.45 0.50 0.00 -0.23 0.00 0.00 178.00 179.66 2wvl h ALA 120 N 1.66 1.71 -0.11 -0.56 0.00 -1.97 -1.76 119.26 118.23 2wvl h ALA 120 Ca 0.22 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2wvl h ALA 120 Cb 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2wvl h ALA 120 CO -0.05 0.16 -0.31 -0.07 0.00 0.00 0.00 179.25 178.98 2wvl h LEU 121 N 0.77 0.46 -0.90 0.00 3.38 -1.91 -2.20 115.31 114.91 2wvl h LEU 121 Ca 0.33 -0.60 0.13 0.00 0.09 0.00 0.00 57.88 57.83 2wvl h LEU 121 Cb 0.31 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.84 2wvl h LEU 121 CO -0.12 0.98 0.51 0.00 0.09 0.00 0.00 178.44 179.91 2wvl h ALA 122 N 0.49 1.35 -0.43 1.53 0.00 -1.44 0.33 119.26 121.10 2wvl h ALA 122 Ca -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2wvl h ALA 122 Cb 0.93 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2wvl h ALA 122 CO 0.07 0.04 0.20 0.93 0.00 0.00 0.00 179.25 180.49 2wvl h GLU 123 N 0.78 0.62 0.05 0.00 4.39 -1.33 -1.89 114.58 117.20 2wvl h GLU 123 Ca 0.47 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 2wvl h GLU 123 Cb 0.56 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2wvl h GLU 123 CO -0.31 0.55 -0.02 0.00 -1.16 0.00 0.00 179.01 178.06 2wvl h ALA 124 N 1.04 -0.06 -0.70 3.43 0.00 -0.41 -1.04 119.26 121.51 2wvl h ALA 124 Ca 0.15 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2wvl h ALA 124 Cb 0.14 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2wvl h ALA 124 CO -0.02 -0.52 0.39 -0.07 0.00 0.00 0.00 179.25 179.04 2wvl h LEU 125 N -0.10 0.58 -1.03 0.00 3.38 -0.42 0.12 115.31 117.85 2wvl h LEU 125 Ca -0.01 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2wvl h LEU 125 Cb 0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2wvl h LEU 125 CO 0.01 0.36 0.21 -0.09 0.09 0.00 0.00 178.44 179.03 2wvl h ARG 126 N 0.71 0.91 -0.51 1.13 2.43 -0.88 -1.38 114.38 116.80 2wvl h ARG 126 Ca 0.32 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.28 2wvl h ARG 126 Cb 0.22 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2wvl h ARG 126 CO -0.20 0.77 0.10 0.00 -1.51 0.00 0.00 179.97 179.14 2wvl h ALA 127 N 1.34 0.67 0.00 2.80 0.00 -0.39 -3.02 119.26 120.67 2wvl h ALA 127 Ca 0.20 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2wvl h ALA 127 Cb 0.22 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2wvl h ALA 127 CO -0.01 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.03 2wvl n GLY 128 N -0.57 -0.55 1.19 0.00 0.00 0.36 -4.79 105.19 100.82 2wvl n GLY 128 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wvl n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvl n GLY 129 N -0.98 0.96 2.27 -0.02 0.00 -1.08 -1.23 105.19 105.12 2wvl n GLY 129 Ca 0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 2wvl n GLY 129 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wvl n TYR 130 N -2.54 -0.54 0.44 1.61 4.19 -0.62 -4.84 117.16 114.87 2wvl n TYR 130 Ca 0.00 -3.44 0.13 0.00 3.31 0.00 0.00 57.90 57.91 2wvl n TYR 130 Cb 0.32 -0.10 0.45 0.00 0.49 0.00 0.00 39.34 40.50 2wvl n TYR 130 CO 0.00 0.00 0.00 -1.00 0.91 0.00 0.00 176.86 176.77 2wvl h PRO 131 N 3.53 0.00 -1.05 2.98 0.13 -1.84 -3.39 132.00 132.35 2wvl h PRO 131 Ca 0.05 0.00 0.32 0.00 -0.87 0.00 0.00 66.00 65.51 2wvl h PRO 131 Cb 0.94 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.94 2wvl h PRO 131 CO 0.44 0.00 0.62 0.45 -0.23 0.00 0.00 178.00 179.29 2wvl h HIS 132 N 0.00 0.85 -0.39 1.56 3.86 -1.93 -0.15 115.15 118.95 2wvl h HIS 132 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2wvl h HIS 132 Cb 0.60 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.84 2wvl h HIS 132 CO 0.00 -0.13 0.00 -0.35 0.86 0.00 0.00 177.93 178.31 2wvl n PRO 133 N -4.93 2.18 -3.25 2.45 -0.05 -1.26 -4.87 135.00 125.26 2wvl n PRO 133 Ca 0.31 -1.52 -0.38 0.00 -0.05 0.00 0.00 63.50 61.86 2wvl n PRO 133 Cb 1.01 -1.44 -0.06 0.00 -0.05 0.00 0.00 33.50 32.97 2wvl n PRO 133 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 2wvl s ILE 134 N -1.56 5.03 0.00 0.52 1.01 -0.07 -1.48 121.20 124.65 2wvl s ILE 134 Ca 0.28 1.13 0.00 0.00 0.00 0.00 0.00 60.65 62.06 2wvl s ILE 134 Cb 0.16 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.75 2wvl s ILE 134 CO 0.17 0.39 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2wvl n GLY 135 N 2.72 -0.15 0.07 6.18 0.00 0.63 -4.81 105.19 109.83 2wvl n GLY 135 Ca -0.07 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.03 2wvl n GLY 135 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wvl h GLU 136 N 0.00 0.09 0.00 1.61 5.08 -1.99 -2.87 114.58 116.50 2wvl h GLU 136 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2wvl h GLU 136 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2wvl h GLU 136 CO 0.00 0.36 0.30 0.38 -1.00 0.00 0.00 179.01 179.06 2wvl h ASP 137 N -0.20 0.00 0.00 1.42 2.03 -2.01 -3.43 116.42 114.22 2wvl h ASP 137 Ca 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 2wvl h ASP 137 Cb 0.33 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.83 2wvl h ASP 137 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 2wvl n GLY 138 N -1.27 0.69 3.72 7.15 0.00 -1.08 -5.08 105.19 109.32 2wvl n GLY 138 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2wvl n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wvl s LEU 139 N 0.00 3.50 0.26 0.99 1.43 -1.26 -4.81 118.68 118.79 2wvl s LEU 139 Ca 0.00 -0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 52.42 2wvl s LEU 139 Cb 0.00 -2.08 -0.11 0.00 0.03 0.00 0.00 46.19 44.03 2wvl s LEU 139 CO 0.00 0.03 1.57 -0.69 0.23 0.00 0.00 176.35 177.49 2wvl s VAL 140 N -1.99 2.26 0.53 -1.59 1.01 -1.26 -0.27 120.40 119.10 2wvl s VAL 140 Ca 0.30 0.21 -0.21 0.00 0.00 0.00 0.00 61.98 62.29 2wvl s VAL 140 Cb -0.08 -3.14 -0.07 0.00 0.00 0.00 0.00 36.38 33.09 2wvl s VAL 140 CO 0.21 0.03 0.98 0.54 0.00 0.00 0.00 175.10 176.86 2wvl n ARG 141 N 2.61 1.09 -1.37 2.72 1.74 -0.55 -4.67 116.66 118.23 2wvl n ARG 141 Ca 0.09 0.41 -0.30 0.00 -0.77 0.00 0.00 57.85 57.28 2wvl n ARG 141 Cb 0.38 -2.13 0.12 0.00 -1.02 0.00 0.00 32.46 29.81 2wvl n ARG 141 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2wvl s SER 142 N -1.04 3.93 0.00 0.55 0.01 -1.26 -4.78 113.70 111.11 2wvl s SER 142 Ca 0.71 1.38 0.00 0.00 1.31 0.00 0.00 55.95 59.35 2wvl s SER 142 Cb -0.46 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2wvl s SER 142 CO 0.51 -2.34 0.00 0.61 0.41 0.00 0.00 173.24 172.44 2wvl n GLY 143 N -1.61 3.64 0.34 3.44 0.00 -1.26 -4.86 105.19 104.89 2wvl n GLY 143 Ca 0.07 -1.56 -0.05 0.00 0.00 0.00 0.00 46.02 44.49 2wvl n GLY 143 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2wvl h LYS 144 N 0.00 1.20 -0.31 1.61 3.64 -1.91 -3.02 116.57 117.78 2wvl h LYS 144 Ca 0.00 -0.16 0.06 0.00 -1.27 0.00 0.00 60.65 59.27 2wvl h LYS 144 Cb 0.00 -0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 31.55 2wvl h LYS 144 CO 0.00 0.91 -0.03 0.00 -2.27 0.00 0.00 179.45 178.06 2wvl h ALA 145 N 1.23 0.26 -0.89 5.00 0.00 -1.88 -0.29 119.26 122.68 2wvl h ALA 145 Ca 0.29 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.37 2wvl h ALA 145 Cb 0.09 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2wvl h ALA 145 CO -0.04 -0.43 0.55 0.93 0.00 0.00 0.00 179.25 180.27 2wvl h GLU 146 N 0.06 0.96 -0.26 0.00 3.07 -1.85 0.50 114.58 117.07 2wvl h GLU 146 Ca 0.15 -0.06 0.02 0.00 -0.50 0.00 0.00 59.36 58.97 2wvl h GLU 146 Cb 0.21 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 2wvl h GLU 146 CO -0.28 0.64 0.12 0.78 -1.40 0.00 0.00 179.01 178.87 2wvl h GLY 147 N 0.99 0.34 1.01 -3.84 0.00 -1.03 -2.67 103.07 97.87 2wvl h GLY 147 Ca 0.40 -0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.65 2wvl h GLY 147 CO -0.19 0.07 0.38 -0.33 0.00 0.00 0.00 176.54 176.47 2wvl h MET 148 N 0.26 0.76 -0.27 4.80 2.86 -0.03 -0.45 114.93 122.86 2wvl h MET 148 Ca 0.11 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.76 2wvl h MET 148 Cb 0.04 -0.17 -0.08 0.00 0.06 0.00 0.00 31.60 31.45 2wvl h MET 148 CO -0.08 0.50 -0.37 0.82 1.06 0.00 0.00 176.91 178.85 2wvl h ILE 149 N 0.78 0.20 -0.76 -1.22 2.04 -0.74 0.28 117.51 118.09 2wvl h ILE 149 Ca 0.21 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.17 2wvl h ILE 149 Cb -0.09 0.20 -0.08 0.00 -0.74 0.00 0.00 36.82 36.11 2wvl h ILE 149 CO -0.05 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 178.42 2wvl h LEU 150 N -0.36 0.51 -1.10 1.44 3.38 -1.14 -1.70 115.31 116.35 2wvl h LEU 150 Ca 0.12 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 2wvl h LEU 150 Cb 0.57 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2wvl h LEU 150 CO -0.47 0.28 0.07 0.00 0.09 0.00 0.00 178.44 178.42 2wvl h ALA 151 N 1.46 1.27 -0.76 1.53 0.00 0.73 -1.45 119.26 122.03 2wvl h ALA 151 Ca 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2wvl h ALA 151 Cb 0.41 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2wvl h ALA 151 CO -0.28 0.50 0.44 -0.07 0.00 0.00 0.00 179.25 179.84 2wvl h LEU 152 N 0.68 0.94 -0.49 0.00 3.38 0.31 0.31 115.31 120.44 2wvl h LEU 152 Ca 0.15 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.08 2wvl h LEU 152 Cb 0.31 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2wvl h LEU 152 CO 0.00 0.74 0.25 0.58 0.09 0.00 0.00 178.44 180.11 2wvl h VAL 153 N 1.05 0.96 -0.10 1.22 2.07 -0.58 0.12 116.25 121.00 2wvl h VAL 153 Ca 0.27 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.59 2wvl h VAL 153 Cb -0.00 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2wvl h VAL 153 CO -0.05 0.09 -0.10 -0.26 0.02 0.00 0.00 177.57 177.27 2wvl h PHE 154 N 0.49 0.15 0.50 1.57 0.04 -0.76 -1.86 116.94 117.07 2wvl h PHE 154 Ca 0.22 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.95 2wvl h PHE 154 Cb 0.12 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.23 2wvl h PHE 154 CO -0.10 0.26 -0.24 0.00 -0.60 0.00 0.00 178.31 177.63 2wvl h ALA 155 N 1.75 -0.67 -0.89 2.45 0.00 0.64 -1.37 119.26 121.19 2wvl h ALA 155 Ca 0.03 -0.19 0.24 0.00 0.00 0.00 0.00 54.91 54.99 2wvl h ALA 155 Cb 0.28 0.26 -0.14 0.00 0.00 0.00 0.00 17.79 18.19 2wvl h ALA 155 CO 0.02 -0.69 0.28 0.00 0.00 0.00 0.00 179.25 178.85 2wvl h ALA 156 N -0.82 1.34 -0.19 0.00 0.00 -0.69 -1.81 119.26 117.09 2wvl h ALA 156 Ca -0.07 0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2wvl h ALA 156 Cb 0.59 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2wvl h ALA 156 CO 0.11 -0.46 -0.43 -0.07 0.00 0.00 0.00 179.25 178.40 2wvl h LEU 157 N 0.24 0.48 -0.03 0.00 3.38 -1.04 -2.43 115.31 115.90 2wvl h LEU 157 Ca 0.56 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2wvl h LEU 157 Cb 1.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2wvl h LEU 157 CO -0.64 0.85 -0.05 -1.54 0.09 0.00 0.00 178.44 177.15 2wvl n SER 158 N -4.01 0.10 -1.12 -0.43 3.41 -0.54 -4.90 113.62 106.13 2wvl n SER 158 Ca -0.02 0.05 -0.11 0.00 -0.26 0.00 0.00 58.87 58.53 2wvl n SER 158 Cb 0.52 -0.30 -0.02 0.00 -0.26 0.00 0.00 64.21 64.14 2wvl n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvl n GLY 159 N 1.39 0.50 3.85 5.00 0.00 -0.92 -5.02 105.19 110.00 2wvl n GLY 159 Ca 0.11 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 2wvl n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvl s ARG 160 N -3.87 3.89 -0.00 1.61 1.81 -1.23 -5.01 118.95 116.15 2wvl s ARG 160 Ca 0.00 0.82 0.19 0.00 -1.72 0.00 0.00 55.73 55.02 2wvl s ARG 160 Cb 0.00 -2.20 -0.20 0.00 -0.45 0.00 0.00 34.95 32.10 2wvl s ARG 160 CO 0.00 -0.22 0.59 -2.13 -0.68 0.00 0.00 175.30 172.86 2wvl n ARG 161 N -1.55 0.64 -4.07 3.54 0.63 0.54 -4.71 116.66 111.69 2wvl n ARG 161 Ca 0.05 0.05 -0.17 0.00 -0.92 0.00 0.00 57.85 56.87 2wvl n ARG 161 Cb 0.54 -1.67 -0.15 0.00 0.45 0.00 0.00 32.46 31.63 2wvl n ARG 161 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2wvl s TYR 162 N -3.04 0.43 -0.13 -0.14 2.02 -0.84 -0.36 117.35 115.28 2wvl s TYR 162 Ca -0.06 -0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.59 2wvl s TYR 162 Cb 0.10 -0.37 0.01 0.00 -0.40 0.00 0.00 41.96 41.30 2wvl s TYR 162 CO 0.84 -0.07 -0.18 0.08 -1.57 0.00 0.00 175.55 174.65 2wvl s VAL 163 N 0.39 1.78 0.10 0.71 1.01 -0.44 0.35 120.40 124.29 2wvl s VAL 163 Ca -0.04 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.23 2wvl s VAL 163 Cb -0.07 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2wvl s VAL 163 CO -0.01 0.50 -0.21 -0.83 0.00 0.00 0.00 175.10 174.55 2wvl s GLY 164 N 1.04 1.61 0.03 4.51 0.00 0.18 -1.07 107.32 113.61 2wvl s GLY 164 Ca -0.04 -1.35 0.03 0.00 0.00 0.00 0.00 44.72 43.36 2wvl s GLY 164 CO -0.04 -1.31 -0.01 -1.36 0.00 0.00 0.00 173.10 170.38 2wvl s PHE 165 N -1.05 3.02 -0.09 1.90 0.08 0.22 0.09 117.98 122.14 2wvl s PHE 165 Ca 0.16 0.03 -0.04 0.00 0.12 0.00 0.00 56.93 57.20 2wvl s PHE 165 Cb -0.10 -1.62 0.05 0.00 -0.57 0.00 0.00 43.02 40.77 2wvl s PHE 165 CO 0.07 0.45 0.18 0.42 -0.10 0.00 0.00 175.22 176.25 2wvl s ILE 166 N -1.14 -0.28 0.46 0.64 -1.09 -0.69 -3.90 121.20 115.19 2wvl s ILE 166 Ca 0.21 0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 58.74 2wvl s ILE 166 Cb -0.11 -0.32 -0.08 0.00 -1.58 0.00 0.00 42.46 40.37 2wvl s ILE 166 CO 0.12 0.14 1.14 -1.81 -1.23 0.00 0.00 174.94 173.31 2wvl s ASP 167 N 2.28 6.24 0.00 3.58 -0.00 -1.26 -4.06 116.67 123.44 2wvl s ASP 167 Ca 0.02 2.25 0.28 0.00 -0.00 0.00 0.00 52.55 55.10 2wvl s ASP 167 Cb -0.12 -2.60 1.05 0.00 -0.00 0.00 0.00 42.92 41.25 2wvl s ASP 167 CO -0.06 -0.87 1.74 0.00 -0.00 0.00 0.00 175.17 175.98 2wvl n ALA 168 N -0.48 2.60 0.78 5.23 0.00 -1.25 -4.17 120.51 123.21 2wvl n ALA 168 Ca 0.07 -0.44 -0.02 0.00 0.00 0.00 0.00 53.44 53.05 2wvl n ALA 168 Cb 0.49 -1.17 0.02 0.00 0.00 0.00 0.00 19.45 18.79 2wvl n ALA 168 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2wvl n ASP 169 N 0.12 2.99 -4.42 0.00 5.75 -1.26 -4.52 116.55 115.22 2wvl n ASP 169 Ca 0.19 -2.16 -0.40 0.00 -0.01 0.00 0.00 54.79 52.41 2wvl n ASP 169 Cb 0.35 -0.53 -0.11 0.00 -1.03 0.00 0.00 41.12 39.80 2wvl n ASP 169 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2wvl s ASN 170 N 0.72 5.73 0.17 -1.12 3.84 -1.26 -2.97 114.94 120.04 2wvl s ASN 170 Ca 0.06 -0.77 0.25 0.00 0.21 0.00 0.00 52.86 52.60 2wvl s ASN 170 Cb 0.05 -2.04 0.91 0.00 -0.55 0.00 0.00 41.25 39.63 2wvl s ASN 170 CO 0.01 -0.31 1.76 -1.22 -2.79 0.00 0.00 177.10 174.55 2wvl n TYR 171 N 5.01 0.64 -3.91 0.43 4.01 -1.22 -4.61 117.16 117.52 2wvl n TYR 171 Ca -0.12 0.21 -0.30 0.00 -0.16 0.00 0.00 57.90 57.52 2wvl n TYR 171 Cb 0.47 -0.84 -0.15 0.00 -0.31 0.00 0.00 39.34 38.51 2wvl n TYR 171 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2wvl s PHE 172 N -3.13 2.71 0.35 -0.72 0.08 -1.26 -4.98 117.98 111.03 2wvl s PHE 172 Ca 0.09 -2.24 0.09 0.00 0.12 0.00 0.00 56.93 54.99 2wvl s PHE 172 Cb 0.12 -2.14 0.81 0.00 -0.57 0.00 0.00 43.02 41.24 2wvl s PHE 172 CO 0.50 -0.88 1.85 -1.35 -0.10 0.00 0.00 175.22 175.24 2wvl h PRO 173 N 7.86 0.68 -0.63 0.24 0.11 -1.82 -0.70 132.00 137.76 2wvl h PRO 173 Ca -0.11 -0.04 0.13 0.00 0.11 0.00 0.00 66.00 66.08 2wvl h PRO 173 Cb 1.03 -0.15 -0.10 0.00 0.11 0.00 0.00 31.00 31.89 2wvl h PRO 173 CO 0.47 0.45 0.08 0.78 -0.21 0.00 0.00 178.00 179.58 2wvl h GLY 174 N 0.71 0.76 0.77 -0.55 0.00 -1.92 0.12 103.07 102.95 2wvl h GLY 174 Ca 0.47 0.02 0.03 0.00 0.00 0.00 0.00 47.33 47.85 2wvl h GLY 174 CO -0.23 -0.17 0.15 0.00 0.00 0.00 0.00 176.54 176.29 2wvl h ALA 175 N 1.53 0.41 -0.38 3.60 0.00 -1.53 -2.09 119.26 120.81 2wvl h ALA 175 Ca 0.33 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.33 2wvl h ALA 175 Cb 0.53 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2wvl h ALA 175 CO -0.47 -0.24 0.05 0.28 0.00 0.00 0.00 179.25 178.87 2wvl h VAL 176 N 0.31 0.77 -0.13 0.00 2.07 -0.47 -0.51 116.25 118.29 2wvl h VAL 176 Ca 0.15 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.65 2wvl h VAL 176 Cb 0.09 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2wvl h VAL 176 CO -0.13 0.03 -0.12 -0.25 0.02 0.00 0.00 177.57 177.12 2wvl h TRP 177 N 0.17 -0.31 -0.27 1.57 7.01 -0.60 -1.66 115.95 121.86 2wvl h TRP 177 Ca 0.18 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.27 2wvl h TRP 177 Cb 0.23 0.16 -0.07 0.00 -2.10 0.00 0.00 29.16 27.38 2wvl h TRP 177 CO -0.22 -0.19 -0.21 1.49 -2.79 0.00 0.00 178.44 176.53 2wvl h GLU 178 N -0.15 -0.18 -0.70 2.65 4.81 -0.70 0.15 114.58 120.46 2wvl h GLU 178 Ca 0.09 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.48 2wvl h GLU 178 Cb 0.28 0.04 -0.13 0.00 0.63 0.00 0.00 28.75 29.57 2wvl h GLU 178 CO -0.22 -0.12 -0.08 1.88 -0.73 0.00 0.00 179.01 179.74 2wvl h TYR 179 N -0.19 -0.20 -0.17 0.92 0.05 -0.63 0.09 116.97 116.84 2wvl h TYR 179 Ca 0.15 0.06 -0.21 0.00 0.05 0.00 0.00 58.73 58.78 2wvl h TYR 179 Cb 0.42 0.20 0.01 0.00 1.01 0.00 0.00 36.73 38.36 2wvl h TYR 179 CO -0.38 -0.26 -0.71 0.28 -1.05 0.00 0.00 178.16 176.04 2wvl h VAL 180 N 0.05 1.29 -0.36 -2.88 2.07 -0.55 -0.85 116.25 115.03 2wvl h VAL 180 Ca 0.36 -1.94 0.04 0.00 0.82 0.00 0.00 66.70 65.97 2wvl h VAL 180 Cb 0.59 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 2wvl h VAL 180 CO -0.66 0.61 0.25 0.03 0.02 0.00 0.00 177.57 177.82 2wvl h ARG 181 N 0.52 0.34 -0.45 1.57 2.47 -0.66 -2.44 114.38 115.73 2wvl h ARG 181 Ca -0.03 -0.02 -0.14 0.00 -1.26 0.00 0.00 59.98 58.53 2wvl h ARG 181 Cb 1.33 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 29.56 2wvl h ARG 181 CO 0.15 0.22 -0.27 0.00 0.56 0.00 0.00 179.97 180.63 2wvl h ALA 182 N 1.79 0.64 -0.58 0.04 0.00 -0.42 0.20 119.26 120.93 2wvl h ALA 182 Ca 0.15 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.66 2wvl h ALA 182 Cb 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2wvl h ALA 182 CO -0.03 0.67 0.38 1.88 0.00 0.00 0.00 179.25 182.14 2wvl h TYR 183 N 0.82 0.71 -0.30 0.00 0.05 -0.79 0.14 116.97 117.61 2wvl h TYR 183 Ca 0.09 0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.79 2wvl h TYR 183 Cb 0.86 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.35 2wvl h TYR 183 CO 0.06 0.44 -0.20 0.00 -1.05 0.00 0.00 178.16 177.41 2wvl h ALA 184 N 1.22 0.42 -0.45 3.88 0.00 -1.19 -2.10 119.26 121.05 2wvl h ALA 184 Ca 0.22 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.85 2wvl h ALA 184 Cb -0.07 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.53 2wvl h ALA 184 CO -0.06 0.36 -0.33 0.00 0.00 0.00 0.00 179.25 179.23 2wvl h ALA 185 N 0.73 -0.15 -0.28 0.00 0.00 -0.26 0.12 119.26 119.41 2wvl h ALA 185 Ca 0.06 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.12 2wvl h ALA 185 Cb 0.74 0.73 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 2wvl h ALA 185 CO 0.05 -0.72 -0.32 0.78 0.00 0.00 0.00 179.25 179.05 2wvl h GLY 186 N -0.23 -1.46 1.54 0.00 0.00 -0.45 -2.14 103.07 100.33 2wvl h GLY 186 Ca 0.19 0.80 0.06 0.00 0.00 0.00 0.00 47.33 48.38 2wvl h GLY 186 CO -0.57 -0.40 0.17 0.74 0.00 0.00 0.00 176.54 176.48 2wvl h PHE 187 N -0.19 0.00 -0.30 5.60 0.04 -0.65 -0.13 116.94 121.31 2wvl h PHE 187 Ca 0.05 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.68 2wvl h PHE 187 Cb 0.32 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 2wvl h PHE 187 CO -0.72 0.00 -0.39 -0.07 -0.60 0.00 0.00 178.31 176.52 2wvl h LEU 188 N 0.00 0.75 -0.21 1.54 3.38 -0.41 -3.11 115.31 117.25 2wvl h LEU 188 Ca 0.11 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2wvl h LEU 188 Cb 0.44 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2wvl h LEU 188 CO -0.00 1.06 0.00 0.24 0.09 0.00 0.00 178.44 179.82 2wvl h MET 189 N 0.58 0.00 -6.98 1.13 2.86 -0.40 -3.45 114.93 108.67 2wvl h MET 189 Ca 0.05 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.16 2wvl h MET 189 Cb 0.93 0.00 0.09 0.00 0.06 0.00 0.00 31.60 32.68 2wvl h MET 189 CO 0.08 0.00 0.60 0.00 1.06 0.00 0.00 176.91 178.65 2wvl s ALA 190 N -3.26 3.13 -0.31 6.32 0.00 -0.78 -4.90 121.76 121.95 2wvl s ALA 190 Ca 0.06 1.21 0.08 0.00 0.00 0.00 0.00 51.96 53.32 2wvl s ALA 190 Cb 0.06 -3.49 0.50 0.00 0.00 0.00 0.00 23.12 20.19 2wvl s ALA 190 CO 0.64 -0.92 1.46 1.63 0.00 0.00 0.00 175.76 178.58 2wvl n LYS 191 N -0.20 2.05 -3.84 0.00 5.02 -1.26 -4.99 118.16 114.93 2wvl n LYS 191 Ca 0.06 -3.32 -0.12 0.00 -2.02 0.00 0.00 58.31 52.91 2wvl n LYS 191 Cb 0.44 -1.88 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 2wvl n LYS 191 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2wvl s THR 192 N -3.49 0.06 0.45 -0.18 -1.32 -1.26 -5.02 115.64 104.88 2wvl s THR 192 Ca 0.46 -0.51 0.18 0.00 -1.21 0.00 0.00 61.69 60.61 2wvl s THR 192 Cb 0.41 -0.44 0.37 0.00 -1.51 0.00 0.00 72.50 71.33 2wvl s THR 192 CO -0.00 -0.28 1.93 -0.65 -2.21 0.00 0.00 174.62 173.41 2wvl h PRO 193 N 4.52 0.32 -3.79 7.08 0.11 -1.90 -3.39 132.00 134.95 2wvl h PRO 193 Ca -0.29 -0.02 -0.78 0.00 0.11 0.00 0.00 66.00 65.02 2wvl h PRO 193 Cb 1.19 -0.07 -0.27 0.00 0.11 0.00 0.00 31.00 31.96 2wvl h PRO 193 CO 0.40 0.21 0.07 -0.06 -0.21 0.00 0.00 178.00 178.41 2wvl s PHE 194 N -5.32 3.76 0.13 0.65 0.08 -1.26 -4.74 117.98 111.28 2wvl s PHE 194 Ca -0.07 -2.11 0.07 0.00 0.12 0.00 0.00 56.93 54.93 2wvl s PHE 194 Cb 0.21 -3.75 -0.04 0.00 -0.57 0.00 0.00 43.02 38.87 2wvl s PHE 194 CO 0.76 -0.97 -0.16 0.00 -0.10 0.00 0.00 175.22 174.75 2wvl s ALA 195 N 0.04 1.68 -0.04 5.36 0.00 -1.26 -1.86 121.76 125.67 2wvl s ALA 195 Ca 0.19 -1.33 -0.02 0.00 0.00 0.00 0.00 51.96 50.80 2wvl s ALA 195 Cb -0.11 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.90 2wvl s ALA 195 CO -0.08 0.18 0.09 1.41 0.00 0.00 0.00 175.76 177.36 2wvl s MET 196 N -2.55 0.06 -0.11 0.00 1.75 -0.06 -2.30 119.30 116.09 2wvl s MET 196 Ca 0.10 0.24 0.03 0.00 -1.25 0.00 0.00 55.69 54.81 2wvl s MET 196 Cb -0.06 -0.13 -0.00 0.00 2.84 0.00 0.00 34.83 37.48 2wvl s MET 196 CO 0.04 -0.12 -0.22 0.08 -0.65 0.00 0.00 175.02 174.16 2wvl s VAL 197 N 0.80 2.25 -0.11 10.11 1.01 -0.69 0.05 120.40 133.82 2wvl s VAL 197 Ca -0.06 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 60.97 2wvl s VAL 197 Cb -0.09 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.44 2wvl s VAL 197 CO -0.03 0.55 -0.11 -0.13 0.00 0.00 0.00 175.10 175.38 2wvl s ARG 198 N 0.37 1.85 0.18 2.72 0.52 0.76 -0.88 118.95 124.47 2wvl s ARG 198 Ca -0.17 -0.40 -0.23 0.00 -0.52 0.00 0.00 55.73 54.41 2wvl s ARG 198 Cb -0.17 -1.73 -0.08 0.00 0.52 0.00 0.00 34.95 33.49 2wvl s ARG 198 CO 0.08 -0.18 0.74 0.42 0.02 0.00 0.00 175.30 176.38 2wvl s ILE 199 N 1.36 4.47 0.11 1.52 -1.09 -1.02 -0.68 121.20 125.87 2wvl s ILE 199 Ca -0.00 1.51 -0.01 0.00 -2.23 0.00 0.00 60.65 59.92 2wvl s ILE 199 Cb -0.14 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 2wvl s ILE 199 CO -0.06 0.41 0.02 -1.48 -1.23 0.00 0.00 174.94 172.61 2wvl s LEU 200 N -1.44 2.03 0.22 2.97 2.34 -0.93 -4.76 118.68 119.11 2wvl s LEU 200 Ca 0.38 -1.14 0.11 0.00 0.06 0.00 0.00 54.13 53.54 2wvl s LEU 200 Cb -0.20 0.23 -0.05 0.00 -0.56 0.00 0.00 46.19 45.61 2wvl s LEU 200 CO 0.24 -0.67 -0.20 0.86 -1.06 0.00 0.00 176.35 175.52 2wvl s TRP 201 N -3.97 2.36 -0.42 3.48 -0.00 -1.26 -1.62 118.94 117.50 2wvl s TRP 201 Ca 0.19 -0.33 0.04 0.00 -0.00 0.00 0.00 56.10 56.00 2wvl s TRP 201 Cb 0.07 -1.12 0.11 0.00 -0.00 0.00 0.00 33.47 32.54 2wvl s TRP 201 CO -0.02 0.58 0.15 1.03 -0.00 0.00 0.00 176.95 178.69 2wvl s ARG 202 N -3.00 1.67 0.00 5.86 3.00 -1.26 -5.05 118.95 120.16 2wvl s ARG 202 Ca 0.25 -2.19 0.00 0.00 0.00 0.00 0.00 55.73 53.78 2wvl s ARG 202 Cb -0.07 -3.19 0.00 0.00 0.00 0.00 0.00 34.95 31.69 2wvl s ARG 202 CO 0.13 -1.03 0.00 0.41 0.00 0.00 0.00 175.30 174.81 2wvl n GLY 212 N 3.73 0.00 2.35 -3.53 0.00 -1.26 -5.21 105.19 101.28 2wvl n GLY 212 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 2wvl n GLY 212 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wvl n VAL 213 N 0.00 1.71 -0.02 1.61 0.24 -1.26 -4.50 118.33 116.11 2wvl n VAL 213 Ca 0.00 -0.91 -0.02 0.00 -2.04 0.00 0.00 64.34 61.37 2wvl n VAL 213 Cb 0.00 -1.84 -0.01 0.00 -1.47 0.00 0.00 33.84 30.52 2wvl n VAL 213 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 2wvl n VAL 214 N 3.15 0.46 1.33 3.34 3.14 -1.26 -4.52 118.33 123.99 2wvl n VAL 214 Ca 0.27 0.40 0.06 0.00 -2.96 0.00 0.00 64.34 62.11 2wvl n VAL 214 Cb 0.38 -1.78 0.35 0.00 -1.06 0.00 0.00 33.84 31.72 2wvl n VAL 214 CO 0.00 0.00 0.00 2.22 -6.46 0.00 0.00 176.83 172.59 2wvl n PHE 215 N -3.05 0.00 -0.05 1.45 -0.00 -1.26 -2.54 117.46 112.00 2wvl n PHE 215 Ca -0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.35 2wvl n PHE 215 Cb 0.11 0.00 0.10 0.00 -0.00 0.00 0.00 39.48 39.70 2wvl n PHE 215 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2wvl h ARG 216 N 0.00 0.69 0.48 3.97 2.47 -1.91 -2.41 114.38 117.67 2wvl h ARG 216 Ca 0.00 -0.30 -0.02 0.00 -1.26 0.00 0.00 59.98 58.40 2wvl h ARG 216 Cb 0.00 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 2wvl h ARG 216 CO 0.00 0.89 -0.23 0.00 0.56 0.00 0.00 179.97 181.19 2wvl h ARG 217 N 0.59 -0.62 -0.08 0.04 2.47 -1.77 -2.83 114.38 112.18 2wvl h ARG 217 Ca 0.07 0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 2wvl h ARG 217 Cb 0.78 0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.24 2wvl h ARG 217 CO 0.06 -0.35 0.01 -0.92 0.56 0.00 0.00 179.97 179.33 2wvl h TYR 218 N -0.78 0.11 0.00 3.04 3.20 -1.74 -3.19 116.97 117.60 2wvl h TYR 218 Ca -0.07 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.80 2wvl h TYR 218 Cb 0.56 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.79 2wvl h TYR 218 CO -0.01 0.11 0.00 0.41 -1.64 0.00 0.00 178.16 177.03 2wvl n GLY 219 N -1.39 -1.96 0.44 1.82 0.00 -0.91 -2.83 105.19 100.35 2wvl n GLY 219 Ca -0.02 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.24 2wvl n GLY 219 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2wvl h ARG 220 N 0.00 0.00 0.18 1.61 0.11 -1.55 0.40 114.38 115.13 2wvl h ARG 220 Ca 0.00 0.00 -0.30 0.00 0.10 0.00 0.00 59.98 59.78 2wvl h ARG 220 Cb 0.00 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.10 2wvl h ARG 220 CO 0.00 0.00 -1.36 -0.39 0.10 0.00 0.00 179.97 178.32 2wvl h VAL 221 N 0.00 1.39 0.02 0.08 -1.51 -1.61 -2.40 116.25 112.21 2wvl h VAL 221 Ca 0.30 -2.90 -0.26 0.00 -1.23 0.00 0.00 66.70 62.61 2wvl h VAL 221 Cb 1.67 2.98 0.02 0.00 -2.13 0.00 0.00 31.29 33.83 2wvl h VAL 221 CO -0.00 0.86 -1.04 0.77 -1.23 0.00 0.00 177.57 176.92 2wvl h SER 222 N 0.11 0.76 -0.10 4.19 4.64 -0.79 0.31 113.55 122.67 2wvl h SER 222 Ca -0.19 -0.63 0.03 0.00 -0.47 0.00 0.00 61.79 60.53 2wvl h SER 222 Cb 2.06 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 63.92 2wvl h SER 222 CO 0.23 1.43 0.07 -0.33 -0.87 0.00 0.00 176.83 177.37 2wvl h GLU 223 N 0.31 0.00 -0.01 4.77 5.08 -1.47 0.71 114.58 123.97 2wvl h GLU 223 Ca -0.12 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 2wvl h GLU 223 Cb 1.70 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.95 2wvl h GLU 223 CO 0.20 0.00 -0.48 -0.09 -1.00 0.00 0.00 179.01 177.63 2wvl h ARG 224 N 0.00 0.34 -0.18 2.33 9.65 -0.94 -1.00 114.38 124.58 2wvl h ARG 224 Ca 0.05 -0.36 0.03 0.00 -1.10 0.00 0.00 59.98 58.60 2wvl h ARG 224 Cb 0.19 0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.84 2wvl h ARG 224 CO -0.00 1.04 0.00 -0.91 2.80 0.00 0.00 179.97 182.90 2wvl h ASN 225 N -0.21 -0.06 -0.10 -3.80 2.35 0.29 -0.27 115.58 113.78 2wvl h ASN 225 Ca -0.06 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2wvl h ASN 225 Cb 1.20 0.07 -0.05 0.00 0.05 0.00 0.00 38.32 39.59 2wvl h ASN 225 CO 0.10 -0.01 -0.23 0.78 -1.65 0.00 0.00 177.43 176.42 2wvl h ASN 226 N 0.06 -0.72 -0.97 5.81 2.35 0.32 -2.64 115.58 119.79 2wvl h ASN 226 Ca 0.08 0.11 0.15 0.00 -0.55 0.00 0.00 56.30 56.09 2wvl h ASN 226 Cb 0.10 0.31 -0.09 0.00 0.05 0.00 0.00 38.32 38.69 2wvl h ASN 226 CO -0.14 -0.29 0.59 -0.09 -1.65 0.00 0.00 177.43 175.85 2wvl h ARG 227 N -0.32 0.82 -0.30 0.81 2.43 -0.83 -0.13 114.38 116.87 2wvl h ARG 227 Ca 0.09 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2wvl h ARG 227 Cb 0.45 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 2wvl h ARG 227 CO -0.28 0.54 0.12 0.00 -1.51 0.00 0.00 179.97 178.84 2wvl h ALA 228 N 1.58 0.35 -0.58 2.80 0.00 -0.73 -0.16 119.26 122.52 2wvl h ALA 228 Ca 0.52 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.39 2wvl h ALA 228 Cb 0.66 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2wvl h ALA 228 CO -0.32 -0.28 0.11 -0.07 0.00 0.00 0.00 179.25 178.69 2wvl h LEU 229 N 0.26 0.86 -1.00 0.00 4.07 -0.73 -0.36 115.31 118.41 2wvl h LEU 229 Ca 0.13 -0.17 -0.09 0.00 0.08 0.00 0.00 57.88 57.83 2wvl h LEU 229 Cb 0.08 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 2wvl h LEU 229 CO -0.12 0.85 -0.19 0.78 -1.08 0.00 0.00 178.44 178.68 2wvl h ASN 230 N 0.87 0.50 -0.03 -0.43 -0.26 -0.94 -1.35 115.58 113.94 2wvl h ASN 230 Ca 0.18 -0.15 -0.12 0.00 -0.56 0.00 0.00 56.30 55.65 2wvl h ASN 230 Cb 0.35 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.47 2wvl h ASN 230 CO 0.00 0.70 -0.37 1.56 -1.06 0.00 0.00 177.43 178.26 2wvl h GLN 231 N 0.45 0.53 -0.07 0.81 4.20 -0.27 0.03 115.11 120.79 2wvl h GLN 231 Ca 0.08 -0.26 0.02 0.00 0.06 0.00 0.00 58.65 58.55 2wvl h GLN 231 Cb 0.59 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 2wvl h GLN 231 CO 0.04 0.83 -0.06 1.25 -0.67 0.00 0.00 178.83 180.21 2wvl h LEU 232 N 0.45 -0.20 0.87 1.46 5.85 -0.40 -1.49 115.31 121.85 2wvl h LEU 232 Ca 0.04 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 2wvl h LEU 232 Cb 0.86 0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.99 2wvl h LEU 232 CO 0.07 -0.09 -0.42 0.40 -0.34 0.00 0.00 178.44 178.07 2wvl h ILE 233 N -0.08 0.11 -0.95 4.05 2.04 -0.80 -3.11 117.51 118.78 2wvl h ILE 233 Ca 0.05 -0.06 0.18 0.00 1.00 0.00 0.00 64.86 66.04 2wvl h ILE 233 Cb 0.15 0.12 -0.10 0.00 -0.74 0.00 0.00 36.82 36.25 2wvl h ILE 233 CO -0.12 0.00 0.53 1.23 0.00 0.00 0.00 178.15 179.80 2wvl h GLY 234 N -1.21 1.64 1.14 5.37 0.00 -0.91 0.17 103.07 109.27 2wvl h GLY 234 Ca -0.12 -0.31 0.06 0.00 0.00 0.00 0.00 47.33 46.96 2wvl h GLY 234 CO 0.20 -0.08 0.37 -1.33 0.00 0.00 0.00 176.54 175.70 2wvl h GLY 235 N 0.68 0.00 0.00 4.60 0.00 -1.19 0.66 103.07 107.82 2wvl h GLY 235 Ca 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.84 2wvl h GLY 235 CO -0.39 0.00 -1.08 -0.62 0.00 0.00 0.00 176.54 174.45 2wvl n VAL 236 N -3.31 1.50 -0.14 4.60 0.31 0.50 -4.56 118.33 117.23 2wvl n VAL 236 Ca 0.02 0.11 0.10 0.00 -0.01 0.00 0.00 64.34 64.56 2wvl n VAL 236 Cb 0.48 -2.32 0.44 0.00 -0.91 0.00 0.00 33.84 31.53 2wvl n VAL 236 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2wvl h SER 237 N -1.00 0.50 0.00 4.52 4.64 -1.19 -3.46 113.55 117.56 2wvl h SER 237 Ca -0.05 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2wvl h SER 237 Cb 1.02 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2wvl h SER 237 CO -0.03 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 2wvl n GLY 238 N -1.48 0.55 2.80 -0.77 0.00 0.21 -5.07 105.19 101.42 2wvl n GLY 238 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2wvl n GLY 238 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvl s PHE 239 N -2.26 0.02 0.43 1.61 0.08 -1.24 -5.02 117.98 111.59 2wvl s PHE 239 Ca 0.00 0.12 -0.26 0.00 0.12 0.00 0.00 56.93 56.91 2wvl s PHE 239 Cb 0.00 -0.19 -0.08 0.00 -0.57 0.00 0.00 43.02 42.18 2wvl s PHE 239 CO 0.00 -0.08 1.37 -1.83 -0.10 0.00 0.00 175.22 174.59 2wvl s GLU 240 N 0.87 3.82 0.13 0.44 1.03 -1.26 -4.39 118.70 119.33 2wvl s GLU 240 Ca -0.07 2.30 0.07 0.00 0.03 0.00 0.00 54.97 57.30 2wvl s GLU 240 Cb -0.10 -2.71 -0.04 0.00 -0.80 0.00 0.00 34.13 30.48 2wvl s GLU 240 CO -0.03 -0.67 -0.16 -0.08 -1.33 0.00 0.00 175.26 173.00 2wvl s THR 241 N -1.23 1.52 -1.39 1.83 -1.32 -1.26 -5.00 115.64 108.78 2wvl s THR 241 Ca 0.59 -1.72 0.13 0.00 -1.21 0.00 0.00 61.69 59.48 2wvl s THR 241 Cb -0.41 -1.60 0.24 0.00 -1.51 0.00 0.00 72.50 69.22 2wvl s THR 241 CO 0.53 -0.32 1.11 -0.90 -2.21 0.00 0.00 174.62 172.84 2wvl n ASP 242 N 0.60 2.61 0.05 8.08 5.75 -1.26 -4.81 116.55 127.57 2wvl n ASP 242 Ca -0.16 -1.78 -0.11 0.00 -0.01 0.00 0.00 54.79 52.73 2wvl n ASP 242 Cb 0.56 -0.14 -0.00 0.00 -1.03 0.00 0.00 41.12 40.51 2wvl n ASP 242 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 2wvl h VAL 243 N 2.53 1.38 -3.01 2.12 3.04 -1.97 -3.42 116.25 116.92 2wvl h VAL 243 Ca 0.00 -2.20 -0.57 0.00 -1.01 0.00 0.00 66.70 62.91 2wvl h VAL 243 Cb 0.67 2.18 -0.05 0.00 -2.01 0.00 0.00 31.29 32.08 2wvl h VAL 243 CO 0.00 0.66 0.88 -0.69 -1.01 0.00 0.00 177.57 177.41 2wvl s VAL 244 N -3.54 4.40 0.00 1.51 1.01 -1.26 -4.67 120.40 117.85 2wvl s VAL 244 Ca -0.06 1.68 0.00 0.00 0.00 0.00 0.00 61.98 63.60 2wvl s VAL 244 Cb 0.10 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2wvl s VAL 244 CO 0.85 -0.20 0.75 0.29 0.00 0.00 0.00 175.10 176.79 2wvl n LYS 245 N 6.61 1.40 -2.78 2.72 4.76 -1.26 -4.75 118.16 124.85 2wvl n LYS 245 Ca 0.13 -1.03 -0.14 0.00 -2.87 0.00 0.00 58.31 54.40 2wvl n LYS 245 Cb 0.45 -0.91 0.01 0.00 -1.84 0.00 0.00 35.03 32.74 2wvl n LYS 245 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2wvl n THR 246 N -0.28 0.98 -0.21 -0.18 -2.24 -1.26 -4.85 114.28 106.24 2wvl n THR 246 Ca 0.00 -3.80 -0.06 0.00 -2.27 0.00 0.00 64.05 57.93 2wvl n THR 246 Cb 0.21 0.09 0.04 0.00 -2.10 0.00 0.00 70.33 68.58 2wvl n THR 246 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wvl h ALA 247 N 2.95 0.77 -3.17 6.98 0.00 -1.90 -3.38 119.26 121.50 2wvl h ALA 247 Ca 0.01 -0.04 -0.66 0.00 0.00 0.00 0.00 54.91 54.22 2wvl h ALA 247 Cb 1.06 -0.23 -0.14 0.00 0.00 0.00 0.00 17.79 18.48 2wvl h ALA 247 CO 0.56 0.19 -0.59 -0.80 0.00 0.00 0.00 179.25 178.61 2wvl s ASN 248 N -5.73 5.51 -0.48 0.00 0.01 -1.26 -1.86 114.94 111.14 2wvl s ASN 248 Ca -0.13 0.19 0.05 0.00 -0.71 0.00 0.00 52.86 52.26 2wvl s ASN 248 Cb 0.13 -1.69 0.23 0.00 0.41 0.00 0.00 41.25 40.33 2wvl s ASN 248 CO 0.76 0.34 0.90 0.00 -1.51 0.00 0.00 177.10 177.58 2wvl n ALA 249 N 2.42 -1.78 0.04 0.60 0.00 -1.26 -4.96 120.51 115.56 2wvl n ALA 249 Ca -0.18 -1.18 -0.14 0.00 0.00 0.00 0.00 53.44 51.93 2wvl n ALA 249 Cb 0.54 -1.60 -0.08 0.00 0.00 0.00 0.00 19.45 18.31 2wvl n ALA 249 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wvl h GLY 250 N 4.11 -0.88 -7.25 0.00 0.00 -1.96 -3.24 103.07 93.86 2wvl h GLY 250 Ca -0.11 0.57 -0.53 0.00 0.00 0.00 0.00 47.33 47.25 2wvl h GLY 250 CO 0.21 -0.24 1.24 -0.54 0.00 0.00 0.00 176.54 177.22 2wvl s GLU 251 N -5.84 3.24 0.24 4.80 8.01 -1.26 -4.71 118.70 123.18 2wvl s GLU 251 Ca -0.16 -0.56 0.01 0.00 0.01 0.00 0.00 54.97 54.27 2wvl s GLU 251 Cb 0.08 -4.83 -0.05 0.00 -4.31 0.00 0.00 34.13 25.03 2wvl s GLU 251 CO 0.63 -2.37 0.12 -3.38 0.01 0.00 0.00 175.26 170.26 2wvl s HIS 252 N 6.22 1.42 0.15 1.61 -3.43 -1.22 -2.44 115.29 117.59 2wvl s HIS 252 Ca 0.47 -1.28 -0.00 0.00 -0.80 0.00 0.00 55.06 53.45 2wvl s HIS 252 Cb -0.05 -0.78 -0.04 0.00 -1.43 0.00 0.00 32.58 30.28 2wvl s HIS 252 CO 0.03 -0.47 0.05 0.00 -2.00 0.00 0.00 174.74 172.34 2wvl s ALA 253 N -3.87 1.06 -0.25 -1.38 0.00 -0.05 -0.61 121.76 116.65 2wvl s ALA 253 Ca 0.38 -1.54 -0.25 0.00 0.00 0.00 0.00 51.96 50.55 2wvl s ALA 253 Cb 0.07 0.81 0.07 0.00 0.00 0.00 0.00 23.12 24.07 2wvl s ALA 253 CO 0.14 -0.44 0.70 0.00 0.00 0.00 0.00 175.76 176.16 2wvl s MET 254 N -4.02 0.84 0.53 0.00 0.23 -0.24 -1.70 119.30 114.95 2wvl s MET 254 Ca 0.26 0.94 -0.20 0.00 -1.03 0.00 0.00 55.69 55.66 2wvl s MET 254 Cb 0.07 0.41 -0.09 0.00 -1.53 0.00 0.00 34.83 33.69 2wvl s MET 254 CO 0.04 -0.11 0.68 -1.13 -2.03 0.00 0.00 175.02 172.46 2wvl n SER 255 N 2.59 -0.35 0.03 -1.18 3.41 -0.97 -1.33 113.62 115.82 2wvl n SER 255 Ca -0.14 0.82 -0.20 0.00 -0.26 0.00 0.00 58.87 59.09 2wvl n SER 255 Cb 0.55 -1.23 -0.10 0.00 -0.26 0.00 0.00 64.21 63.17 2wvl n SER 255 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2wvl h LEU 256 N 0.58 0.89 -0.99 1.04 5.85 -1.03 -2.62 115.31 119.03 2wvl h LEU 256 Ca -0.45 -0.72 0.33 0.00 0.84 0.00 0.00 57.88 57.88 2wvl h LEU 256 Cb 1.38 -0.27 -0.16 0.00 0.37 0.00 0.00 40.66 41.99 2wvl h LEU 256 CO 0.50 1.49 0.52 1.23 -0.34 0.00 0.00 178.44 181.84 2wvl h GLY 257 N 0.38 2.02 0.50 3.75 0.00 -1.89 -1.76 103.07 106.08 2wvl h GLY 257 Ca -0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2wvl h GLY 257 CO 0.19 -0.55 -0.22 -2.00 0.00 0.00 0.00 176.54 173.96 2wvl h LEU 258 N 0.24 -0.53 -0.96 3.11 5.85 -1.78 -3.22 115.31 118.02 2wvl h LEU 258 Ca 0.74 -0.01 0.30 0.00 0.84 0.00 0.00 57.88 59.75 2wvl h LEU 258 Cb 1.72 0.14 -0.16 0.00 0.37 0.00 0.00 40.66 42.74 2wvl h LEU 258 CO -0.65 -0.11 0.40 0.00 -0.34 0.00 0.00 178.44 177.74 2wvl h ALA 259 N -1.07 1.69 0.00 1.25 0.00 -1.11 0.26 119.26 120.27 2wvl h ALA 259 Ca -0.06 0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2wvl h ALA 259 Cb 0.52 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2wvl h ALA 259 CO 0.11 -0.60 -0.17 -0.07 0.00 0.00 0.00 179.25 178.52 2wvl h LEU 260 N 0.20 0.00 -0.01 0.00 3.38 -1.50 -2.60 115.31 114.78 2wvl h LEU 260 Ca 0.68 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.65 2wvl h LEU 260 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 2wvl h LEU 260 CO -0.68 0.17 0.00 0.54 0.09 0.00 0.00 178.44 178.56 2wvl n ARG 261 N -3.24 0.04 -3.71 1.13 1.74 0.91 -0.79 116.66 112.73 2wvl n ARG 261 Ca 0.01 0.06 -0.37 0.00 -0.77 0.00 0.00 57.85 56.78 2wvl n ARG 261 Cb 0.47 -1.55 -0.12 0.00 -1.02 0.00 0.00 32.46 30.24 2wvl n ARG 261 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2wvl s LEU 262 N -3.23 3.59 0.24 0.55 2.96 -0.98 -4.75 118.68 117.06 2wvl s LEU 262 Ca 0.13 -0.15 -0.30 0.00 -0.22 0.00 0.00 54.13 53.58 2wvl s LEU 262 Cb 0.17 -1.97 -0.10 0.00 0.50 0.00 0.00 46.19 44.79 2wvl s LEU 262 CO 0.51 -0.04 1.38 -2.16 -1.32 0.00 0.00 176.35 174.73 2wvl s PRO 263 N 1.64 4.32 -0.12 0.98 0.04 -1.26 -4.37 135.00 136.23 2wvl s PRO 263 Ca 0.06 2.21 -0.02 0.00 0.04 0.00 0.00 61.00 63.29 2wvl s PRO 263 Cb -0.15 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.23 2wvl s PRO 263 CO 0.05 -0.33 -0.05 -0.51 0.04 0.00 0.00 177.00 176.20 2wvl s LEU 264 N -0.44 3.19 0.69 -3.56 1.43 -0.71 -4.78 118.68 114.49 2wvl s LEU 264 Ca 0.57 -0.09 -0.08 0.00 -1.03 0.00 0.00 54.13 53.50 2wvl s LEU 264 Cb -0.40 -1.74 0.04 0.00 0.03 0.00 0.00 46.19 44.12 2wvl s LEU 264 CO 0.43 0.25 1.03 0.00 0.23 0.00 0.00 176.35 178.28 2wvl s ALA 265 N -0.13 3.06 -0.16 4.21 0.00 -1.26 0.44 121.76 127.91 2wvl s ALA 265 Ca 0.02 -0.67 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 2wvl s ALA 265 Cb -0.13 -2.76 -0.07 0.00 0.00 0.00 0.00 23.12 20.16 2wvl s ALA 265 CO 0.03 -1.17 -0.13 0.45 0.00 0.00 0.00 175.76 174.93 2wvl n SER 266 N -2.90 1.84 0.00 0.00 2.88 -0.97 -4.38 113.62 110.08 2wvl n SER 266 Ca 0.07 0.56 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 2wvl n SER 266 Cb 0.59 -0.87 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 2wvl n SER 266 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wvl n GLY 267 N 1.55 0.81 0.96 0.46 0.00 -1.26 -4.34 105.19 103.37 2wvl n GLY 267 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 2wvl n GLY 267 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wvl n TYR 268 N 0.00 0.42 1.18 1.61 4.01 -1.26 -3.80 117.16 119.32 2wvl n TYR 268 Ca 0.00 -0.42 0.12 0.00 -0.16 0.00 0.00 57.90 57.45 2wvl n TYR 268 Cb 0.00 -0.27 0.28 0.00 -0.31 0.00 0.00 39.34 39.05 2wvl n TYR 268 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wvl n ALA 269 N 0.17 3.23 0.25 -0.72 0.00 -1.26 -4.51 120.51 117.66 2wvl n ALA 269 Ca 0.07 -0.45 -0.15 0.00 0.00 0.00 0.00 53.44 52.91 2wvl n ALA 269 Cb 0.55 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 18.86 2wvl n ALA 269 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvl h VAL 270 N 1.37 0.49 0.54 0.00 2.07 -1.76 -0.61 116.25 118.35 2wvl h VAL 270 Ca 0.00 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 2wvl h VAL 270 Cb 0.56 0.64 0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2wvl h VAL 270 CO 0.00 0.05 -0.26 -0.33 0.02 0.00 0.00 177.57 177.05 2wvl h GLU 271 N -0.84 -0.70 -0.53 1.57 3.07 -1.82 -2.60 114.58 112.73 2wvl h GLU 271 Ca -0.06 0.05 0.08 0.00 -0.50 0.00 0.00 59.36 58.92 2wvl h GLU 271 Cb 0.57 0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.57 2wvl h GLU 271 CO 0.10 -0.41 0.18 -1.35 -1.40 0.00 0.00 179.01 176.13 2wvl h PRO 272 N -0.88 0.34 0.00 2.33 0.11 -1.40 -1.67 132.00 130.82 2wvl h PRO 272 Ca -0.07 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 2wvl h PRO 272 Cb 0.62 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 2wvl h PRO 272 CO 0.12 0.22 -0.07 0.37 -0.21 0.00 0.00 178.00 178.43 2wvl h GLN 273 N 0.35 0.00 -0.43 1.05 5.75 -1.07 -1.71 115.11 119.05 2wvl h GLN 273 Ca 0.26 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.78 2wvl h GLN 273 Cb 0.30 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 2wvl h GLN 273 CO -0.28 0.07 0.26 0.93 -2.65 0.00 0.00 178.83 177.16 2wvl h GLU 274 N 0.00 0.50 -0.42 1.69 5.08 -0.89 0.58 114.58 121.11 2wvl h GLU 274 Ca -0.00 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2wvl h GLU 274 Cb 0.15 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2wvl h GLU 274 CO 0.01 0.33 0.03 -0.07 -1.00 0.00 0.00 179.01 178.32 2wvl h LEU 275 N 0.52 0.70 -0.66 1.33 3.38 -1.36 -2.21 115.31 117.01 2wvl h LEU 275 Ca 0.17 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2wvl h LEU 275 Cb 0.01 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2wvl h LEU 275 CO -0.08 0.81 0.31 0.58 0.09 0.00 0.00 178.44 180.16 2wvl h VAL 276 N 0.57 1.22 -0.24 1.22 2.07 -1.02 -1.90 116.25 118.18 2wvl h VAL 276 Ca 0.12 -0.64 -0.13 0.00 0.82 0.00 0.00 66.70 66.88 2wvl h VAL 276 Cb 0.43 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2wvl h VAL 276 CO 0.01 0.26 -0.39 0.28 0.02 0.00 0.00 177.57 177.75 2wvl h SER 277 N 0.91 0.58 0.25 0.57 0.02 -0.82 -0.13 113.55 114.94 2wvl h SER 277 Ca 0.23 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2wvl h SER 277 Cb 0.12 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 2wvl h SER 277 CO -0.03 0.91 -0.44 -0.07 -1.14 0.00 0.00 176.83 176.07 2wvl h LEU 278 N 0.46 -1.26 -0.94 5.07 3.38 -1.17 0.11 115.31 120.96 2wvl h LEU 278 Ca 0.04 0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.24 2wvl h LEU 278 Cb 0.89 0.45 -0.08 0.00 0.09 0.00 0.00 40.66 42.01 2wvl h LEU 278 CO 0.08 -0.54 0.57 -0.07 0.09 0.00 0.00 178.44 178.57 2wvl h LEU 279 N -0.76 0.84 -0.25 1.67 3.38 -1.11 0.30 115.31 119.38 2wvl h LEU 279 Ca -0.01 0.04 -0.19 0.00 0.09 0.00 0.00 57.88 57.82 2wvl h LEU 279 Cb 0.73 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2wvl h LEU 279 CO -0.18 0.47 -0.59 -0.33 0.09 0.00 0.00 178.44 177.91 2wvl h GLU 280 N 0.94 0.83 0.14 1.13 5.08 -0.75 -1.22 114.58 120.74 2wvl h GLU 280 Ca 0.45 -0.57 -0.30 0.00 -1.00 0.00 0.00 59.36 57.95 2wvl h GLU 280 Cb 0.40 0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.76 2wvl h GLU 280 CO -0.25 1.19 -1.27 -0.07 -1.00 0.00 0.00 179.01 177.61 2wvl h LEU 281 N 0.60 0.75 -2.77 1.33 3.38 -0.52 -3.38 115.31 114.69 2wvl h LEU 281 Ca -0.00 -0.73 -0.00 0.00 0.09 0.00 0.00 57.88 57.24 2wvl h LEU 281 Cb 1.20 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 2wvl h LEU 281 CO 0.13 1.55 -0.12 -1.22 0.09 0.00 0.00 178.44 178.86 2wvl n TYR 282 N -3.72 0.00 1.48 1.13 4.01 0.07 -4.60 117.16 115.53 2wvl n TYR 282 Ca -0.13 -0.78 0.14 0.00 -0.16 0.00 0.00 57.90 56.98 2wvl n TYR 282 Cb 1.01 -0.13 0.51 0.00 -0.31 0.00 0.00 39.34 40.42 2wvl n TYR 282 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvl n GLY 283 N -1.10 -0.01 2.03 2.72 0.00 -0.46 -1.17 105.19 107.20 2wvl n GLY 283 Ca 0.12 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2wvl n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvl n GLY 284 N 1.18 1.40 0.10 -0.02 0.00 -1.26 -2.25 105.19 104.34 2wvl n GLY 284 Ca 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 2wvl n GLY 284 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wvl h VAL 285 N 0.00 0.33 -3.89 1.61 2.07 -1.88 -3.47 116.25 111.02 2wvl h VAL 285 Ca 0.00 -1.12 -0.50 0.00 0.82 0.00 0.00 66.70 65.90 2wvl h VAL 285 Cb 0.00 0.61 0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2wvl h VAL 285 CO 0.00 0.10 0.23 -0.36 0.02 0.00 0.00 177.57 177.57 2wvl s PHE 286 N -2.16 3.57 -0.09 1.57 0.08 -1.26 -4.99 117.98 114.70 2wvl s PHE 286 Ca -0.05 1.04 -0.35 0.00 0.12 0.00 0.00 56.93 57.69 2wvl s PHE 286 Cb -0.00 -2.49 -0.13 0.00 -0.57 0.00 0.00 43.02 39.83 2wvl s PHE 286 CO 0.19 -0.40 1.82 -0.35 -0.10 0.00 0.00 175.22 176.37 2wvl n PRO 287 N -2.26 1.99 -3.47 0.24 -0.04 -1.26 -4.93 135.00 125.28 2wvl n PRO 287 Ca 0.03 0.73 -0.43 0.00 -0.04 0.00 0.00 63.50 63.79 2wvl n PRO 287 Cb 0.55 -2.54 -0.09 0.00 -0.04 0.00 0.00 33.50 31.37 2wvl n PRO 287 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2wvl s LEU 288 N 3.59 5.21 -0.37 1.53 2.96 -1.26 -5.04 118.68 125.30 2wvl s LEU 288 Ca 0.92 -1.08 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2wvl s LEU 288 Cb -0.76 -2.14 0.10 0.00 0.50 0.00 0.00 46.19 43.90 2wvl s LEU 288 CO 0.52 -0.51 0.12 -1.83 -1.32 0.00 0.00 176.35 173.33 2wvl s GLU 289 N 1.63 1.82 -0.40 1.98 1.03 -1.26 -4.94 118.70 118.56 2wvl s GLU 289 Ca 0.04 -1.79 0.07 0.00 0.03 0.00 0.00 54.97 53.32 2wvl s GLU 289 Cb -0.21 -3.38 0.18 0.00 -0.80 0.00 0.00 34.13 29.92 2wvl s GLU 289 CO 0.08 -0.97 0.65 0.34 -1.33 0.00 0.00 175.26 174.03 2wvl s ASP 290 N 1.38 -1.49 0.46 0.83 3.68 -1.26 -5.04 116.67 115.23 2wvl s ASP 290 Ca 0.08 -0.73 0.37 0.00 2.13 0.00 0.00 52.55 54.41 2wvl s ASP 290 Cb -0.21 1.90 1.51 0.00 -1.45 0.00 0.00 42.92 44.67 2wvl s ASP 290 CO -0.06 -0.17 1.48 -0.62 0.13 0.00 0.00 175.17 175.94 2wvl n GLU 291 N 4.41 -0.02 -0.01 4.34 1.02 -1.26 -0.66 120.64 128.46 2wvl n GLU 291 Ca 0.11 1.13 -0.17 0.00 -0.02 0.00 0.00 57.16 58.20 2wvl n GLU 291 Cb 0.57 -2.36 -0.14 0.00 -0.02 0.00 0.00 31.44 29.50 2wvl n GLU 291 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2wvl h GLU 292 N 0.00 0.14 -0.40 3.49 4.39 -1.98 -3.01 114.58 117.21 2wvl h GLU 292 Ca 0.86 -0.25 -0.14 0.00 0.34 0.00 0.00 59.36 60.18 2wvl h GLU 292 Cb 3.04 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 31.77 2wvl h GLU 292 CO -0.28 1.12 -0.29 0.28 -1.16 0.00 0.00 179.01 178.68 2wvl h VAL 293 N -0.69 1.27 -0.75 3.13 2.07 -1.26 0.11 116.25 120.14 2wvl h VAL 293 Ca -0.09 -1.45 0.12 0.00 0.82 0.00 0.00 66.70 66.11 2wvl h VAL 293 Cb 1.33 1.28 -0.09 0.00 -1.52 0.00 0.00 31.29 32.29 2wvl h VAL 293 CO 0.06 0.48 0.34 0.25 0.02 0.00 0.00 177.57 178.73 2wvl h LEU 294 N 0.73 0.39 0.00 2.57 6.46 -1.12 0.69 115.31 125.04 2wvl h LEU 294 Ca 0.08 0.09 -0.17 0.00 -0.12 0.00 0.00 57.88 57.76 2wvl h LEU 294 Cb 0.85 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.78 2wvl h LEU 294 CO 0.07 0.19 -1.12 -0.61 -0.62 0.00 0.00 178.44 176.35 2wvl h GLN 295 N 0.53 0.00 0.00 1.25 5.75 -1.36 -3.39 115.11 117.90 2wvl h GLN 295 Ca 0.40 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.66 2wvl h GLN 295 Cb 0.53 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.04 2wvl h GLN 295 CO -0.34 0.47 -1.99 0.72 -2.65 0.00 0.00 178.83 175.03 2wvl n HIS 296 N -3.07 0.00 -0.81 3.99 8.25 0.37 -5.09 115.22 118.86 2wvl n HIS 296 Ca -0.06 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.51 2wvl n HIS 296 Cb 0.85 -0.69 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 2wvl n HIS 296 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wvl n GLY 297 N 2.00 -1.65 3.16 -1.41 0.00 0.24 -4.78 105.19 102.76 2wvl n GLY 297 Ca -0.22 -1.32 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 2wvl n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wvl s VAL 298 N -1.73 1.87 -0.18 1.61 1.01 -0.77 -4.24 120.40 117.96 2wvl s VAL 298 Ca 0.00 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.02 2wvl s VAL 298 Cb 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2wvl s VAL 298 CO 0.00 0.52 0.06 -1.61 0.00 0.00 0.00 175.10 174.06 2wvl s GLU 299 N 0.59 3.97 -0.14 2.72 2.02 -0.78 0.89 118.70 127.96 2wvl s GLU 299 Ca -0.14 -0.35 -0.00 0.00 0.02 0.00 0.00 54.97 54.50 2wvl s GLU 299 Cb -0.17 -3.20 -0.01 0.00 0.10 0.00 0.00 34.13 30.85 2wvl s GLU 299 CO 0.04 0.27 -0.13 0.42 0.02 0.00 0.00 175.26 175.88 2wvl s ILE 300 N 0.37 2.95 0.12 -1.63 1.01 -0.01 -0.88 121.20 123.12 2wvl s ILE 300 Ca 0.03 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 60.05 2wvl s ILE 300 Cb -0.12 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2wvl s ILE 300 CO 0.00 0.51 0.01 -0.36 0.00 0.00 0.00 174.94 175.11 2wvl s PHE 301 N 0.58 2.96 -0.17 3.97 0.08 0.11 -0.36 117.98 125.16 2wvl s PHE 301 Ca -0.08 -0.06 -0.01 0.00 0.12 0.00 0.00 56.93 56.89 2wvl s PHE 301 Cb -0.16 -1.48 0.05 0.00 -0.57 0.00 0.00 43.02 40.86 2wvl s PHE 301 CO 0.03 0.49 -0.01 -0.65 -0.10 0.00 0.00 175.22 174.99 2wvl s GLN 302 N -2.59 0.99 -0.22 0.44 -0.21 -1.26 -0.17 119.66 116.64 2wvl s GLN 302 Ca 0.27 -0.40 -0.02 0.00 0.02 0.00 0.00 55.36 55.22 2wvl s GLN 302 Cb -0.11 -1.91 0.00 0.00 1.00 0.00 0.00 33.01 32.00 2wvl s GLN 302 CO 0.19 -0.50 -0.08 0.42 -2.12 0.00 0.00 175.29 173.19 2wvl s ILE 303 N 1.77 2.98 -0.11 1.08 1.01 0.14 -0.92 121.20 127.14 2wvl s ILE 303 Ca 0.00 -0.70 -0.26 0.00 0.00 0.00 0.00 60.65 59.69 2wvl s ILE 303 Cb -0.16 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 2wvl s ILE 303 CO -0.07 0.41 0.87 -0.70 0.00 0.00 0.00 174.94 175.44 2wvl s GLU 304 N 1.41 4.39 0.19 2.79 2.12 -0.15 -2.18 118.70 127.27 2wvl s GLU 304 Ca 0.05 1.13 -0.06 0.00 0.36 0.00 0.00 54.97 56.44 2wvl s GLU 304 Cb -0.14 -3.53 -0.06 0.00 0.26 0.00 0.00 34.13 30.66 2wvl s GLU 304 CO -0.06 -0.21 0.45 -0.08 -0.54 0.00 0.00 175.26 174.82 2wvl s THR 305 N 1.71 5.08 0.15 -1.70 -1.32 -0.64 -2.92 115.64 115.99 2wvl s THR 305 Ca 0.42 0.16 0.01 0.00 -1.21 0.00 0.00 61.69 61.06 2wvl s THR 305 Cb -0.18 -3.64 -0.16 0.00 -1.51 0.00 0.00 72.50 67.01 2wvl s THR 305 CO 0.17 -0.04 1.35 0.03 -2.21 0.00 0.00 174.62 173.92 2wvl h ARG 306 N 2.58 0.25 -6.06 7.08 2.47 -1.91 -3.44 114.38 115.35 2wvl h ARG 306 Ca -0.46 -0.28 -0.56 0.00 -1.26 0.00 0.00 59.98 57.42 2wvl h ARG 306 Cb 1.17 0.08 -0.05 0.00 -1.65 0.00 0.00 29.97 29.52 2wvl h ARG 306 CO 0.71 1.00 0.14 -0.80 0.56 0.00 0.00 179.97 181.58 2wvl s ASN 307 N -6.97 7.02 0.54 7.04 0.01 -1.26 -5.04 114.94 116.28 2wvl s ASN 307 Ca -0.04 1.23 -0.21 0.00 -0.71 0.00 0.00 52.86 53.13 2wvl s ASN 307 Cb 0.10 -2.43 -0.05 0.00 0.41 0.00 0.00 41.25 39.27 2wvl s ASN 307 CO 0.84 -0.16 1.26 -2.65 -1.51 0.00 0.00 177.10 174.88 2wvl n PRO 308 N 3.94 1.51 -2.33 -0.60 -0.02 -1.26 -4.93 135.00 131.31 2wvl n PRO 308 Ca 0.00 0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 61.66 2wvl n PRO 308 Cb 0.51 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 2wvl n PRO 308 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2wvl s HIS 309 N -1.32 2.10 -0.49 6.00 3.76 -1.26 -4.96 115.29 119.12 2wvl s HIS 309 Ca 0.72 0.10 0.02 0.00 -0.15 0.00 0.00 55.06 55.74 2wvl s HIS 309 Cb -0.43 -4.40 0.13 0.00 1.11 0.00 0.00 32.58 28.98 2wvl s HIS 309 CO 0.49 -2.04 0.24 -1.17 -0.85 0.00 0.00 174.74 171.41 2wvl s LEU 310 N 7.19 4.69 0.00 0.89 2.96 -1.26 -5.08 118.68 128.07 2wvl s LEU 310 Ca 0.52 -2.69 0.04 0.00 -0.22 0.00 0.00 54.13 51.78 2wvl s LEU 310 Cb -0.07 -1.70 0.04 0.00 0.50 0.00 0.00 46.19 44.96 2wvl s LEU 310 CO 0.08 -0.32 0.32 1.41 -1.32 0.00 0.00 176.35 176.52 2wvl n HIS 311 N 3.59 -2.42 0.13 5.38 8.25 -1.26 -3.40 115.22 125.50 2wvl n HIS 311 Ca 0.05 -0.95 -0.02 0.00 -0.26 0.00 0.00 57.72 56.54 2wvl n HIS 311 Cb 0.36 -0.23 0.14 0.00 1.12 0.00 0.00 29.99 31.38 2wvl n HIS 311 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2wvl n GLU 312 N -1.47 2.28 -4.38 -0.41 2.13 -1.16 -4.96 120.64 112.67 2wvl n GLU 312 Ca 0.06 -1.33 -0.27 0.00 0.66 0.00 0.00 57.16 56.28 2wvl n GLU 312 Cb 0.27 -1.72 -0.13 0.00 0.27 0.00 0.00 31.44 30.13 2wvl n GLU 312 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2wvl s ASN 313 N -0.21 2.94 -0.45 4.31 4.22 -1.26 -5.04 114.94 119.45 2wvl s ASN 313 Ca 0.24 -0.71 0.04 0.00 -2.14 0.00 0.00 52.86 50.30 2wvl s ASN 313 Cb 0.19 -0.19 0.27 0.00 1.28 0.00 0.00 41.25 42.80 2wvl s ASN 313 CO 0.06 0.13 1.02 0.29 -2.04 0.00 0.00 177.10 176.57 2wvl n LYS 314 N 1.06 0.68 -4.18 3.55 5.02 -1.26 -5.16 118.16 117.87 2wvl n LYS 314 Ca -0.19 -1.53 -0.16 0.00 -2.02 0.00 0.00 58.31 54.41 2wvl n LYS 314 Cb 0.53 -1.09 -0.13 0.00 -0.02 0.00 0.00 35.03 34.32 2wvl n LYS 314 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2wvl s GLY 315 N -1.28 0.53 -0.00 0.72 0.00 -1.26 -5.09 107.32 100.94 2wvl s GLY 315 Ca 0.28 -0.65 0.07 0.00 0.00 0.00 0.00 44.72 44.43 2wvl s GLY 315 CO -0.18 -0.65 0.28 2.09 0.00 0.00 0.00 173.10 174.64 2wvl n ASP 316 N 1.98 1.00 -0.21 1.64 5.68 -1.26 -4.57 116.55 120.81 2wvl n ASP 316 Ca -0.19 -0.52 -0.08 0.00 -0.50 0.00 0.00 54.79 53.50 2wvl n ASP 316 Cb 0.56 1.08 0.03 0.00 -1.14 0.00 0.00 41.12 41.64 2wvl n ASP 316 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2wvl h GLU 317 N 0.00 0.93 -0.67 0.11 4.81 -2.03 -3.05 114.58 114.69 2wvl h GLU 317 Ca 0.00 -0.20 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 2wvl h GLU 317 Cb 0.21 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2wvl h GLU 317 CO 0.00 0.83 0.24 0.45 -0.73 0.00 0.00 179.01 179.81 2wvl h HIS 318 N 0.85 1.02 -0.26 0.92 -0.00 -2.00 -3.27 115.15 112.41 2wvl h HIS 318 Ca 0.19 -0.08 0.04 0.00 -0.00 0.00 0.00 60.37 60.53 2wvl h HIS 318 Cb 0.29 -0.31 -0.04 0.00 -0.00 0.00 0.00 27.41 27.35 2wvl h HIS 318 CO 0.02 0.79 0.03 0.82 -0.00 0.00 0.00 177.93 179.60 2wvl h ILE 319 N 0.98 0.85 -0.34 2.45 2.04 -1.77 0.35 117.51 122.06 2wvl h ILE 319 Ca 0.22 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 66.10 2wvl h ILE 319 Cb 0.22 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 2wvl h ILE 319 CO -0.02 0.02 0.00 -0.09 0.00 0.00 0.00 178.15 178.07 2wvl h ARG 320 N 0.12 0.10 -0.70 2.37 2.43 -1.67 -2.30 114.38 114.73 2wvl h ARG 320 Ca 0.12 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2wvl h ARG 320 Cb 0.14 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 2wvl h ARG 320 CO -0.18 0.06 0.45 -0.44 -1.51 0.00 0.00 179.97 178.35 2wvl h ASP 321 N 0.10 0.75 -0.81 -3.80 3.45 -1.15 -0.49 116.42 114.48 2wvl h ASP 321 Ca 0.17 -0.01 0.11 0.00 0.43 0.00 0.00 57.03 57.73 2wvl h ASP 321 Cb 0.23 -0.17 -0.08 0.00 -0.56 0.00 0.00 39.33 38.75 2wvl h ASP 321 CO -0.28 0.53 0.44 -0.03 -1.57 0.00 0.00 179.24 178.33 2wvl h MET 322 N 0.89 0.68 0.30 3.56 4.05 0.04 0.22 114.93 124.67 2wvl h MET 322 Ca 0.27 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 2wvl h MET 322 Cb -0.03 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 30.62 2wvl h MET 322 CO -0.09 0.45 -0.14 1.25 0.23 0.00 0.00 176.91 178.61 2wvl h LEU 323 N 0.70 -0.34 -0.45 3.39 5.85 -0.67 -2.53 115.31 121.26 2wvl h LEU 323 Ca 0.41 -0.18 0.09 0.00 0.84 0.00 0.00 57.88 59.04 2wvl h LEU 323 Cb 0.44 0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.47 2wvl h LEU 323 CO -0.28 0.02 -0.20 0.25 -0.34 0.00 0.00 178.44 177.88 2wvl h LEU 324 N -0.73 -0.70 -0.36 2.25 6.46 -0.92 -0.44 115.31 120.86 2wvl h LEU 324 Ca -0.04 0.17 0.05 0.00 -0.12 0.00 0.00 57.88 57.94 2wvl h LEU 324 Cb 0.49 0.39 -0.08 0.00 -0.73 0.00 0.00 40.66 40.73 2wvl h LEU 324 CO 0.07 -0.23 -0.51 0.00 -0.62 0.00 0.00 178.44 177.14 2wvl h ALA 325 N 1.20 -0.69 -0.23 1.25 0.00 -0.56 -1.15 119.26 119.08 2wvl h ALA 325 Ca 0.21 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2wvl h ALA 325 Cb 0.44 1.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 2wvl h ALA 325 CO -0.52 -1.00 -0.19 0.00 0.00 0.00 0.00 179.25 177.54 2wvl h LEU 327 N 0.23 0.00 -0.11 0.00 4.07 -1.02 -2.29 115.31 116.19 2wvl h LEU 327 Ca 0.04 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.82 2wvl h LEU 327 Cb 0.72 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.47 2wvl h LEU 327 CO 0.05 0.06 -0.65 0.00 -1.08 0.00 0.00 178.44 176.82 2wvl h ALA 328 N 1.94 0.23 -0.12 1.53 0.00 -0.42 -1.66 119.26 120.77 2wvl h ALA 328 Ca -0.00 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2wvl h ALA 328 Cb 0.19 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2wvl h ALA 328 CO 0.01 0.52 0.05 1.79 0.00 0.00 0.00 179.25 181.62 2wvl h THR 329 N 0.29 1.05 0.01 0.00 1.35 -0.96 0.99 112.91 115.64 2wvl h THR 329 Ca -0.05 -0.14 -0.04 0.00 -0.55 0.00 0.00 66.41 65.63 2wvl h THR 329 Cb 1.29 0.91 -0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2wvl h THR 329 CO 0.13 0.05 -0.22 0.58 -0.25 0.00 0.00 175.52 175.82 2wvl h VAL 330 N 0.16 1.66 -0.76 6.82 2.07 -1.52 -2.66 116.25 122.02 2wvl h VAL 330 Ca 0.04 -2.34 0.17 0.00 0.82 0.00 0.00 66.70 65.39 2wvl h VAL 330 Cb 0.03 3.23 -0.12 0.00 -1.52 0.00 0.00 31.29 32.91 2wvl h VAL 330 CO -0.01 0.58 0.19 0.22 0.02 0.00 0.00 177.57 178.57 2wvl h TYR 331 N -0.96 0.29 -0.05 1.57 3.20 -0.62 0.57 116.97 120.98 2wvl h TYR 331 Ca -0.06 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2wvl h TYR 331 Cb 1.08 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2wvl h TYR 331 CO 0.25 -0.10 0.00 0.72 -1.64 0.00 0.00 178.16 177.39 2wvl n HIS 332 N -5.17 0.05 -1.76 -3.82 8.25 0.28 -4.84 115.22 108.21 2wvl n HIS 332 Ca 0.15 -0.02 -0.38 0.00 -0.26 0.00 0.00 57.72 57.21 2wvl n HIS 332 Cb 0.49 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.65 2wvl n HIS 332 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2wvl s SER 333 N -1.89 5.23 0.00 0.41 0.15 0.19 -4.87 113.70 112.92 2wvl s SER 333 Ca 0.37 2.80 0.20 0.00 0.70 0.00 0.00 55.95 60.02 2wvl s SER 333 Cb 0.20 -2.64 0.94 0.00 -1.71 0.00 0.00 66.02 62.81 2wvl s SER 333 CO 0.32 -1.60 1.61 0.29 1.20 0.00 0.00 173.24 175.07 2wvl n LYS 334 N -1.03 0.19 -0.00 5.44 5.02 -1.26 -2.86 118.16 123.65 2wvl n LYS 334 Ca 0.10 0.12 0.10 0.00 -2.02 0.00 0.00 58.31 56.62 2wvl n LYS 334 Cb 0.45 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.83 2wvl n LYS 334 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2wvl n LEU 335 N -1.36 0.78 -4.76 -0.35 4.77 -1.26 -4.97 117.00 109.85 2wvl n LEU 335 Ca 0.08 -0.40 -0.41 0.00 -0.03 0.00 0.00 56.01 55.24 2wvl n LEU 335 Cb 0.18 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 2wvl n LEU 335 CO 0.16 0.19 1.13 0.00 -1.33 0.00 0.00 177.39 177.55 2wvl n ALA 336 N -1.64 2.27 -2.71 -1.18 0.00 -1.13 -4.76 120.51 111.36 2wvl n ALA 336 Ca 0.02 0.35 -0.21 0.00 0.00 0.00 0.00 53.44 53.61 2wvl n ALA 336 Cb 0.37 -2.41 -0.01 0.00 0.00 0.00 0.00 19.45 17.40 2wvl n ALA 336 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wvl s THR 337 N -0.83 4.75 0.21 0.00 -4.23 -1.26 -4.91 115.64 109.36 2wvl s THR 337 Ca 0.56 -0.87 -0.09 0.00 -1.18 0.00 0.00 61.69 60.12 2wvl s THR 337 Cb -0.49 -3.68 0.15 0.00 1.34 0.00 0.00 72.50 69.81 2wvl s THR 337 CO 0.60 -0.31 1.76 -0.33 -0.54 0.00 0.00 174.62 175.80 2wvl h GLU 338 N 0.95 0.47 -0.37 3.99 4.39 -1.99 0.23 114.58 122.24 2wvl h GLU 338 Ca -0.49 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.24 2wvl h GLU 338 Cb 1.24 -0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.70 2wvl h GLU 338 CO 0.58 0.31 -0.49 0.93 -1.16 0.00 0.00 179.01 179.19 2wvl h GLU 339 N 0.48 -0.37 -0.44 2.33 3.07 -1.99 0.15 114.58 117.82 2wvl h GLU 339 Ca 0.32 0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.25 2wvl h GLU 339 Cb 0.36 0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 2wvl h GLU 339 CO -0.28 -0.25 0.17 0.28 -1.40 0.00 0.00 179.01 177.53 2wvl h VAL 340 N -0.38 0.88 0.06 3.13 2.07 -1.68 -1.63 116.25 118.69 2wvl h VAL 340 Ca 0.10 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.53 2wvl h VAL 340 Cb 0.60 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2wvl h VAL 340 CO -0.57 0.06 -0.19 0.03 0.02 0.00 0.00 177.57 176.93 2wvl h ARG 341 N 0.34 -0.33 -0.77 1.57 3.08 -0.02 -2.99 114.38 115.28 2wvl h ARG 341 Ca 0.20 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 2wvl h ARG 341 Cb 0.18 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 2wvl h ARG 341 CO -0.20 -0.22 0.43 1.96 -1.07 0.00 0.00 179.97 180.88 2wvl h GLN 342 N -0.34 1.07 -0.38 0.04 1.08 -0.41 -2.29 115.11 113.87 2wvl h GLN 342 Ca 0.04 -0.12 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2wvl h GLN 342 Cb 0.38 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 2wvl h GLN 342 CO -0.14 0.78 0.23 1.03 -0.95 0.00 0.00 178.83 179.79 2wvl h SER 343 N 1.06 0.44 0.30 1.46 0.87 -1.24 -1.81 113.55 114.63 2wvl h SER 343 Ca 0.27 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 2wvl h SER 343 Cb 0.02 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 2wvl h SER 343 CO -0.04 0.34 -0.14 0.58 -0.53 0.00 0.00 176.83 177.03 2wvl h VAL 344 N 0.52 0.00 -0.81 2.23 2.07 -1.28 -3.10 116.25 115.87 2wvl h VAL 344 Ca 0.14 -0.20 0.30 0.00 0.82 0.00 0.00 66.70 67.75 2wvl h VAL 344 Cb -0.03 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.64 2wvl h VAL 344 CO -0.03 0.00 0.50 -0.11 0.02 0.00 0.00 177.57 177.95 2wvl n LEU 345 N -3.63 0.16 0.01 2.57 -0.00 -0.93 -1.30 117.00 113.88 2wvl n LEU 345 Ca -0.05 0.95 -0.12 0.00 -0.00 0.00 0.00 56.01 56.79 2wvl n LEU 345 Cb 0.16 -0.47 -0.09 0.00 -0.00 0.00 0.00 43.42 43.01 2wvl n LEU 345 CO 0.12 -1.05 0.48 -0.33 -0.00 0.00 0.00 177.39 176.61 2wvl h GLU 346 N 0.00 -0.09 -0.51 1.96 5.08 -1.28 -1.64 114.58 118.10 2wvl h GLU 346 Ca 0.56 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.93 2wvl h GLU 346 Cb 1.71 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.96 2wvl h GLU 346 CO -0.36 0.46 0.30 0.93 -1.00 0.00 0.00 179.01 179.33 2wvl h GLU 347 N -0.75 0.69 0.04 2.33 4.39 -1.23 0.45 114.58 120.50 2wvl h GLU 347 Ca -0.01 -0.06 -0.23 0.00 0.34 0.00 0.00 59.36 59.40 2wvl h GLU 347 Cb 0.59 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2wvl h GLU 347 CO 0.02 0.49 -1.02 1.25 -1.16 0.00 0.00 179.01 178.59 2wvl h LEU 348 N 0.70 0.36 -0.01 1.33 7.12 -1.20 -1.05 115.31 122.57 2wvl h LEU 348 Ca 0.18 -0.33 -0.06 0.00 0.13 0.00 0.00 57.88 57.80 2wvl h LEU 348 Cb -0.01 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 40.01 2wvl h LEU 348 CO -0.03 1.17 -0.25 1.56 -0.13 0.00 0.00 178.44 180.76 2wvl h GLN 349 N 0.12 0.18 -0.95 1.25 4.20 -1.11 -2.92 115.11 115.88 2wvl h GLN 349 Ca -0.08 -0.19 0.28 0.00 0.06 0.00 0.00 58.65 58.73 2wvl h GLN 349 Cb 1.69 0.05 -0.15 0.00 0.30 0.00 0.00 27.48 29.37 2wvl h GLN 349 CO 0.16 0.91 0.41 0.00 -0.67 0.00 0.00 178.83 179.64 2wvl h ALA 350 N 0.28 1.65 -1.31 3.87 0.00 0.06 -3.25 119.26 120.56 2wvl h ALA 350 Ca -0.03 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2wvl h ALA 350 Cb 0.99 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2wvl h ALA 350 CO 0.05 -0.53 0.00 0.00 0.00 0.00 0.00 179.25 178.77 2wvl n ALA 351 N -2.49 0.00 -3.16 0.00 0.00 -0.41 -5.00 120.51 109.44 2wvl n ALA 351 Ca 0.27 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.71 2wvl n ALA 351 Cb 0.85 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.29 2wvl n ALA 351 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wvl s GLY 352 N -1.69 -1.04 0.00 0.00 0.00 -1.11 -5.10 107.32 98.38 2wvl s GLY 352 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 44.72 46.29 2wvl s GLY 352 CO 0.00 3.42 0.00 0.00 0.00 0.00 0.00 173.10 176.52 2wvl n ALA 353 N 5.42 0.00 -1.49 3.20 0.00 -1.22 -4.80 120.51 121.62 2wvl n ALA 353 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 53.44 52.89 2wvl n ALA 353 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 2wvl n ALA 353 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wvl n LEU 354 N 0.00 -0.02 0.00 0.00 4.77 -1.26 -4.51 117.00 115.98 2wvl n LEU 354 Ca 0.00 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 2wvl n LEU 354 Cb 0.00 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2wvl n LEU 354 CO 0.00 -2.01 0.46 0.00 -1.33 0.00 0.00 177.39 174.51 2wvl n ALA 355 N 1.28 -0.17 -1.00 -1.18 0.00 -1.26 -4.13 120.51 114.05 2wvl n ALA 355 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2wvl n ALA 355 Cb 0.13 0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2wvl n ALA 355 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wvl n PRO 356 N -2.32 0.00 -1.05 0.00 -0.02 -1.26 -4.46 135.00 125.89 2wvl n PRO 356 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.35 2wvl n PRO 356 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.43 2wvl n PRO 356 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvl n GLY 357 N 1.03 -0.02 3.19 -1.23 0.00 -1.26 -4.85 105.19 102.05 2wvl n GLY 357 Ca 0.00 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2wvl n GLY 357 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvl s GLU 358 N 5.85 2.66 -0.46 1.61 2.56 -1.26 -4.82 118.70 124.84 2wvl s GLU 358 Ca 0.35 -1.10 0.05 0.00 0.00 0.00 0.00 54.97 54.27 2wvl s GLU 358 Cb 0.02 -3.07 0.18 0.00 2.00 0.00 0.00 34.13 33.26 2wvl s GLU 358 CO 0.12 -0.49 0.53 -1.21 -0.56 0.00 0.00 175.26 173.64 2wvl s GLU 359 N 1.29 0.98 0.27 4.30 0.41 -1.26 -5.10 118.70 119.59 2wvl s GLU 359 Ca -0.02 -1.59 -0.27 0.00 -0.41 0.00 0.00 54.97 52.68 2wvl s GLU 359 Cb -0.18 -0.75 -0.16 0.00 -1.78 0.00 0.00 34.13 31.26 2wvl s GLU 359 CO -0.03 -1.36 0.58 -0.35 -0.49 0.00 0.00 175.26 173.62 2wvl n PRO 360 N 2.92 0.36 -1.65 0.39 -0.04 -1.26 -4.71 135.00 131.01 2wvl n PRO 360 Ca 0.24 0.13 -0.54 0.00 -0.04 0.00 0.00 63.50 63.29 2wvl n PRO 360 Cb 0.52 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.67 2wvl n PRO 360 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2wvl n PRO 361 N 0.93 1.28 -1.72 0.54 -0.04 -1.26 -4.86 135.00 129.87 2wvl n PRO 361 Ca 0.15 0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 63.65 2wvl n PRO 361 Cb 0.30 -2.15 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 2wvl n PRO 361 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2wvl s PRO 362 N 1.99 4.15 0.94 0.54 0.04 -1.26 -4.85 135.00 136.54 2wvl s PRO 362 Ca 0.90 2.55 -0.12 0.00 0.04 0.00 0.00 61.00 64.38 2wvl s PRO 362 Cb -0.97 -4.07 0.15 0.00 0.04 0.00 0.00 34.50 29.65 2wvl s PRO 362 CO 0.54 -0.93 1.10 -1.25 0.04 0.00 0.00 177.00 176.51 2wvl s PRO 363 N 4.20 0.91 -0.15 0.56 0.04 -1.26 -4.97 135.00 134.33 2wvl s PRO 363 Ca 0.85 0.56 -0.08 0.00 0.04 0.00 0.00 61.00 62.38 2wvl s PRO 363 Cb -0.42 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 2wvl s PRO 363 CO 0.39 -2.41 0.14 0.14 0.04 0.00 0.00 177.00 175.30 2wvl s VAL 364 N -3.03 5.46 -0.06 -0.36 -7.23 -1.26 -5.03 120.40 108.89 2wvl s VAL 364 Ca 0.64 0.20 0.03 0.00 -1.81 0.00 0.00 61.98 61.04 2wvl s VAL 364 Cb -0.17 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.35 2wvl s VAL 364 CO 0.56 0.55 -0.16 -0.76 -0.31 0.00 0.00 175.10 174.98 2wvl s LEU 365 N -0.48 1.84 0.17 1.32 1.02 -1.26 -2.29 118.68 119.00 2wvl s LEU 365 Ca 0.12 -0.36 -0.25 0.00 0.02 0.00 0.00 54.13 53.66 2wvl s LEU 365 Cb -0.12 -0.98 -0.08 0.00 0.02 0.00 0.00 46.19 45.03 2wvl s LEU 365 CO 0.02 0.11 0.78 -0.31 0.02 0.00 0.00 176.35 176.97 2wvl s TYR 366 N 0.32 3.89 0.83 0.29 2.02 0.17 -4.90 117.35 119.97 2wvl s TYR 366 Ca -0.10 1.63 -0.11 0.00 -0.37 0.00 0.00 57.07 58.12 2wvl s TYR 366 Cb -0.14 -2.77 0.09 0.00 -0.40 0.00 0.00 41.96 38.74 2wvl s TYR 366 CO 0.04 0.50 1.09 -1.25 -1.57 0.00 0.00 175.55 174.36 2wvl s PRO 367 N -1.21 1.84 0.36 -1.71 0.04 -1.26 -1.74 135.00 131.32 2wvl s PRO 367 Ca 0.36 0.84 -0.25 0.00 0.04 0.00 0.00 61.00 61.99 2wvl s PRO 367 Cb -0.23 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.31 2wvl s PRO 367 CO 0.26 -1.84 0.85 -2.30 0.04 0.00 0.00 177.00 174.01 2wvl n PRO 368 N -3.61 1.04 0.28 0.56 -0.02 -1.26 -4.64 135.00 127.35 2wvl n PRO 368 Ca 0.07 0.37 0.15 0.00 -2.02 0.00 0.00 63.50 62.07 2wvl n PRO 368 Cb 0.55 -1.75 0.79 0.00 -0.02 0.00 0.00 33.50 33.07 2wvl n PRO 368 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2wvl h LEU 369 N 1.47 0.00 -0.85 2.45 3.38 -1.71 -2.61 115.31 117.44 2wvl h LEU 369 Ca -0.40 0.00 0.21 0.00 0.09 0.00 0.00 57.88 57.78 2wvl h LEU 369 Cb 1.36 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.96 2wvl h LEU 369 CO 0.57 0.09 0.03 0.77 0.09 0.00 0.00 178.44 179.98 2wvl h SER 370 N 0.00 -0.37 0.00 -0.43 4.64 -1.30 -1.46 113.55 114.63 2wvl h SER 370 Ca -0.00 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2wvl h SER 370 Cb 0.30 0.39 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2wvl h SER 370 CO 0.01 -0.23 0.00 -1.54 -0.87 0.00 0.00 176.83 174.20 2wvl n SER 371 N -5.38 0.03 -4.09 4.97 3.41 -0.98 -4.68 113.62 106.89 2wvl n SER 371 Ca 0.17 -0.10 -0.21 0.00 -0.26 0.00 0.00 58.87 58.47 2wvl n SER 371 Cb 0.58 -0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.38 2wvl n SER 371 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2wvl s LEU 372 N 0.00 2.05 -0.43 1.04 0.20 -0.55 -4.74 118.68 116.26 2wvl s LEU 372 Ca 0.00 -0.27 -0.20 0.00 0.69 0.00 0.00 54.13 54.35 2wvl s LEU 372 Cb 0.00 -0.62 0.02 0.00 -0.43 0.00 0.00 46.19 45.16 2wvl s LEU 372 CO 0.00 0.12 0.63 -0.62 -0.29 0.00 0.00 176.35 176.19 2wvl s ASP 373 N -0.46 6.32 0.23 3.68 -1.08 -0.36 -4.93 116.67 120.06 2wvl s ASP 373 Ca 0.04 -0.31 0.01 0.00 -0.52 0.00 0.00 52.55 51.77 2wvl s ASP 373 Cb -0.05 -2.31 0.24 0.00 -1.46 0.00 0.00 42.92 39.34 2wvl s ASP 373 CO -0.00 -0.74 1.58 -0.07 0.52 0.00 0.00 175.17 176.46 2wvl h LEU 374 N 9.62 0.46 -0.73 -1.34 4.07 -1.95 -3.03 115.31 122.41 2wvl h LEU 374 Ca -0.26 -0.23 -0.13 0.00 0.08 0.00 0.00 57.88 57.35 2wvl h LEU 374 Cb 1.10 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 2wvl h LEU 374 CO 0.88 0.87 -0.42 -0.61 -1.08 0.00 0.00 178.44 178.09 2wvl h GLN 375 N 0.34 0.47 -0.02 1.13 -0.00 -1.98 0.50 115.11 115.55 2wvl h GLN 375 Ca 0.02 -0.24 0.03 0.00 -0.00 0.00 0.00 58.65 58.46 2wvl h GLN 375 Cb 0.98 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 28.41 2wvl h GLN 375 CO 0.09 0.81 -0.31 0.00 0.00 0.00 0.00 178.83 179.41 2wvl h ALA 376 N 1.16 -0.44 -0.60 3.38 0.00 -1.91 0.96 119.26 121.81 2wvl h ALA 376 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2wvl h ALA 376 Cb 0.90 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 2wvl h ALA 376 CO 0.08 -0.82 0.05 -0.39 0.00 0.00 0.00 179.25 178.17 2wvl h VAL 377 N -0.45 1.26 -0.98 0.00 -1.51 -1.39 -1.37 116.25 111.80 2wvl h VAL 377 Ca 0.07 -1.05 0.02 0.00 -1.23 0.00 0.00 66.70 64.51 2wvl h VAL 377 Cb 0.55 0.74 -0.05 0.00 -2.13 0.00 0.00 31.29 30.39 2wvl h VAL 377 CO -0.27 0.38 0.65 -0.09 -1.23 0.00 0.00 177.57 177.01 2wvl h ARG 378 N 0.93 1.27 -0.39 5.19 2.43 -0.66 0.17 114.38 123.32 2wvl h ARG 378 Ca 0.18 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2wvl h ARG 378 Cb 0.46 -0.29 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 2wvl h ARG 378 CO 0.02 0.84 0.24 0.87 -1.51 0.00 0.00 179.97 180.43 2wvl h LYS 379 N 1.31 0.47 0.00 0.20 1.57 -0.52 -3.12 116.57 116.48 2wvl h LYS 379 Ca 0.37 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 59.06 2wvl h LYS 379 Cb -0.11 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 2wvl h LYS 379 CO -0.09 0.31 -0.27 0.00 -0.57 0.00 0.00 179.45 178.83 2wvl h ALA 380 N 1.16 1.04 -0.68 3.86 0.00 -0.15 -2.89 119.26 121.61 2wvl h ALA 380 Ca 0.15 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2wvl h ALA 380 Cb -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2wvl h ALA 380 CO -0.06 0.34 0.00 1.28 0.00 0.00 0.00 179.25 180.81 2wvl n LEU 381 N -3.47 4.71 0.20 0.00 4.77 0.50 -4.71 117.00 119.00 2wvl n LEU 381 Ca -0.00 -2.37 -0.15 0.00 -0.03 0.00 0.00 56.01 53.46 2wvl n LEU 381 Cb 0.44 -0.58 -0.08 0.00 -2.33 0.00 0.00 43.42 40.88 2wvl n LEU 381 CO 0.34 0.85 0.72 -0.09 -1.33 0.00 0.00 177.39 177.88 2wvl h ARG 382 N 4.21 -0.45 0.00 3.23 2.43 -1.45 -0.43 114.38 121.92 2wvl h ARG 382 Ca 0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2wvl h ARG 382 Cb 1.40 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.05 2wvl h ARG 382 CO 0.20 -0.26 0.00 0.41 -1.51 0.00 0.00 179.97 178.81 2wvl n GLY 383 N -1.13 -0.38 0.00 2.80 0.00 -1.26 -3.77 105.19 101.44 2wvl n GLY 383 Ca -0.10 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 45.85 2wvl n GLY 383 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wvl n HIS 384 N -1.00 0.00 -0.31 1.61 8.25 -0.22 -4.67 115.22 118.89 2wvl n HIS 384 Ca 0.09 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.74 2wvl n HIS 384 Cb 0.04 -0.03 0.46 0.00 1.12 0.00 0.00 29.99 31.58 2wvl n HIS 384 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 2wvl h PHE 385 N 0.00 0.75 -0.90 4.41 0.04 -1.52 -1.64 116.94 118.07 2wvl h PHE 385 Ca 0.00 0.02 0.11 0.00 2.80 0.00 0.00 57.97 60.90 2wvl h PHE 385 Cb 0.08 -0.22 -0.13 0.00 2.20 0.00 0.00 35.95 37.88 2wvl h PHE 385 CO 0.00 0.12 -0.49 0.77 -0.60 0.00 0.00 178.31 178.11 2wvl h SER 386 N 0.50 -1.79 1.21 2.17 0.02 -1.86 -1.40 113.55 112.39 2wvl h SER 386 Ca 0.57 0.31 -0.05 0.00 -0.84 0.00 0.00 61.79 61.77 2wvl h SER 386 Cb 1.27 0.84 -0.01 0.00 0.14 0.00 0.00 62.40 64.64 2wvl h SER 386 CO -0.30 -0.28 -0.24 0.08 -1.14 0.00 0.00 176.83 174.95 2wvl h ARG 387 N -0.06 0.00 -0.01 3.45 0.11 -1.63 -3.15 114.38 113.08 2wvl h ARG 387 Ca 0.22 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.22 2wvl h ARG 387 Cb 0.51 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.60 2wvl h ARG 387 CO -0.90 0.24 -0.32 0.74 0.10 0.00 0.00 179.97 179.83 2wvl h PHE 388 N 0.00 0.35 -3.10 4.08 0.04 -1.45 -3.45 116.94 113.41 2wvl h PHE 388 Ca -0.00 -0.18 -0.54 0.00 2.80 0.00 0.00 57.97 60.04 2wvl h PHE 388 Cb 0.91 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.01 2wvl h PHE 388 CO 0.00 0.97 0.67 0.50 -0.60 0.00 0.00 178.31 179.85 2wvl s ARG 389 N -3.24 4.37 -0.87 1.51 3.52 -0.56 -1.30 118.95 122.37 2wvl s ARG 389 Ca -0.15 1.75 -0.25 0.00 -0.13 0.00 0.00 55.73 56.95 2wvl s ARG 389 Cb 0.02 -3.48 0.04 0.00 -1.56 0.00 0.00 34.95 29.96 2wvl s ARG 389 CO 0.76 -0.40 1.36 0.08 -0.81 0.00 0.00 175.30 176.30 2wvl s VAL 390 N 1.83 3.81 -2.00 7.11 1.01 -1.08 -4.87 120.40 126.20 2wvl s VAL 390 Ca 0.58 -0.12 0.25 0.00 0.00 0.00 0.00 61.98 62.69 2wvl s VAL 390 Cb -0.27 -4.97 0.71 0.00 0.00 0.00 0.00 36.38 31.85 2wvl s VAL 390 CO 0.25 -1.88 1.85 -0.81 0.00 0.00 0.00 175.10 174.51