#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ca4 s ASP 2 N 0.00 7.53 0.09 0.00 -0.00 -1.26 -5.02 116.67 118.00 2ca4 s ASP 2 Ca 0.00 1.96 0.03 0.00 -0.00 0.00 0.00 52.55 54.54 2ca4 s ASP 2 Cb 0.00 -2.61 -0.04 0.00 -0.00 0.00 0.00 42.92 40.28 2ca4 s ASP 2 CO 0.00 0.03 -0.09 0.42 -0.00 0.00 0.00 175.17 175.53 2ca4 s THR 3 N -0.79 0.79 0.39 -1.27 -4.23 -1.26 -1.47 115.64 107.80 2ca4 s THR 3 Ca 0.44 -1.62 0.07 0.00 -1.18 0.00 0.00 61.69 59.40 2ca4 s THR 3 Cb -0.26 -1.31 -0.08 0.00 1.34 0.00 0.00 72.50 72.19 2ca4 s THR 3 CO 0.33 -0.62 -0.01 0.68 -0.54 0.00 0.00 174.62 174.46 2ca4 s VAL 4 N -2.60 1.98 -0.13 2.29 -7.23 0.13 -4.84 120.40 110.00 2ca4 s VAL 4 Ca 0.04 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2ca4 s VAL 4 Cb -0.02 -2.91 0.02 0.00 0.56 0.00 0.00 36.38 34.03 2ca4 s VAL 4 CO -0.01 -0.04 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.73 2ca4 s THR 5 N -2.74 1.37 0.49 5.32 2.01 -1.26 -0.71 115.64 120.12 2ca4 s THR 5 Ca 0.35 -0.50 -0.20 0.00 0.31 0.00 0.00 61.69 61.64 2ca4 s THR 5 Cb 0.08 -1.31 -0.09 0.00 0.01 0.00 0.00 72.50 71.20 2ca4 s THR 5 CO 0.17 0.42 1.01 -0.76 -0.69 0.00 0.00 174.62 174.78 2ca4 s LEU 6 N 1.55 3.81 -1.34 4.42 1.43 0.19 -4.92 118.68 123.82 2ca4 s LEU 6 Ca 0.05 1.82 -0.08 0.00 -1.03 0.00 0.00 54.13 54.89 2ca4 s LEU 6 Cb -0.13 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.52 2ca4 s LEU 6 CO -0.10 -0.69 2.82 -0.81 0.23 0.00 0.00 176.35 177.80 2ca4 n PRO 7 N -1.05 3.81 -4.07 1.29 -0.04 -1.26 -4.38 135.00 129.30 2ca4 n PRO 7 Ca 0.08 -2.52 -0.10 0.00 -0.04 0.00 0.00 63.50 60.92 2ca4 n PRO 7 Cb 0.53 -2.65 -0.07 0.00 -0.04 0.00 0.00 33.50 31.27 2ca4 n PRO 7 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2ca4 s PHE 8 N 0.80 0.63 0.38 0.54 -0.12 -1.26 -4.99 117.98 113.96 2ca4 s PHE 8 Ca 0.64 -0.95 -0.27 0.00 -0.05 0.00 0.00 56.93 56.30 2ca4 s PHE 8 Cb 0.20 -0.06 -0.10 0.00 -0.63 0.00 0.00 43.02 42.44 2ca4 s PHE 8 CO -0.07 -0.88 1.40 0.00 -0.05 0.00 0.00 175.22 175.61 2ca4 s ALA 9 N -4.04 3.44 -1.23 1.99 0.00 -1.26 -2.77 121.76 117.89 2ca4 s ALA 9 Ca 0.28 1.41 -0.04 0.00 0.00 0.00 0.00 51.96 53.61 2ca4 s ALA 9 Cb 0.02 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.58 2ca4 s ALA 9 CO 0.10 -0.93 0.79 -1.71 0.00 0.00 0.00 175.76 174.01 2ca4 n ASN 10 N 0.37 -2.75 -1.10 0.00 5.15 -1.26 -4.93 115.26 110.74 2ca4 n ASN 10 Ca 0.02 -0.81 0.12 0.00 -0.60 0.00 0.00 54.58 53.31 2ca4 n ASN 10 Cb 0.41 -4.27 0.20 0.00 -0.53 0.00 0.00 39.78 35.59 2ca4 n ASN 10 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ca4 n GLY 11 N -1.48 1.53 3.74 8.20 0.00 -1.11 -4.96 105.19 111.11 2ca4 n GLY 11 Ca -0.23 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 2ca4 n GLY 11 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ca4 s GLU 12 N -1.61 4.37 0.01 1.61 2.12 -1.26 0.55 118.70 124.49 2ca4 s GLU 12 Ca 0.37 2.09 -0.06 0.00 0.36 0.00 0.00 54.97 57.73 2ca4 s GLU 12 Cb 0.22 -3.19 -0.00 0.00 0.26 0.00 0.00 34.13 31.42 2ca4 s GLU 12 CO 0.31 -0.29 0.11 1.03 -0.54 0.00 0.00 175.26 175.88 2ca4 s ARG 13 N -0.04 0.47 0.44 4.30 1.81 0.12 -4.93 118.95 121.12 2ca4 s ARG 13 Ca 0.58 -0.47 -0.22 0.00 -1.72 0.00 0.00 55.73 53.90 2ca4 s ARG 13 Cb -0.37 0.19 -0.09 0.00 -0.45 0.00 0.00 34.95 34.23 2ca4 s ARG 13 CO 0.38 -0.11 1.02 -1.25 -0.68 0.00 0.00 175.30 174.67 2ca4 s PRO 14 N -1.53 4.02 -0.19 3.54 0.04 -1.26 -0.70 135.00 138.91 2ca4 s PRO 14 Ca -0.14 1.37 -0.20 0.00 0.04 0.00 0.00 61.00 62.08 2ca4 s PRO 14 Cb -0.07 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 2ca4 s PRO 14 CO 0.01 -0.25 0.57 -0.51 0.04 0.00 0.00 177.00 176.86 2ca4 s LEU 15 N -3.11 4.16 0.04 -3.56 1.43 -0.54 -0.91 118.68 116.18 2ca4 s LEU 15 Ca 0.63 0.77 0.07 0.00 -1.03 0.00 0.00 54.13 54.56 2ca4 s LEU 15 Cb -0.17 -2.80 -0.02 0.00 0.03 0.00 0.00 46.19 43.23 2ca4 s LEU 15 CO 0.21 -0.21 -0.20 0.68 0.23 0.00 0.00 176.35 177.07 2ca4 s VAL 16 N 1.69 1.57 -0.21 -1.59 -7.23 0.29 -4.68 120.40 110.25 2ca4 s VAL 16 Ca 0.27 -1.14 -0.03 0.00 -1.81 0.00 0.00 61.98 59.27 2ca4 s VAL 16 Cb -0.16 -1.37 -0.00 0.00 0.56 0.00 0.00 36.38 35.42 2ca4 s VAL 16 CO 0.10 0.18 -0.08 -0.32 -0.31 0.00 0.00 175.10 174.68 2ca4 s MET 17 N -1.13 3.29 0.10 4.82 1.75 -1.26 -0.91 119.30 125.96 2ca4 s MET 17 Ca 0.06 -0.67 0.05 0.00 -1.25 0.00 0.00 55.69 53.88 2ca4 s MET 17 Cb -0.09 -2.89 -0.04 0.00 2.84 0.00 0.00 34.83 34.65 2ca4 s MET 17 CO 0.02 -0.18 0.03 0.71 -0.65 0.00 0.00 175.02 174.94 2ca4 s TYR 18 N 1.38 3.03 0.24 4.11 2.02 -1.26 -5.04 117.35 121.82 2ca4 s TYR 18 Ca 0.05 -0.02 -0.31 0.00 -0.37 0.00 0.00 57.07 56.42 2ca4 s TYR 18 Cb -0.14 -1.54 -0.13 0.00 -0.40 0.00 0.00 41.96 39.75 2ca4 s TYR 18 CO -0.05 0.50 1.43 -2.30 -1.57 0.00 0.00 175.55 173.55 2ca4 n PRO 19 N 0.39 2.07 -0.80 -1.71 -0.02 -1.26 -0.77 135.00 132.91 2ca4 n PRO 19 Ca -0.10 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2ca4 n PRO 19 Cb 0.52 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2ca4 n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ca4 n GLY 20 N 2.25 0.75 3.54 -1.23 0.00 -1.26 -4.97 105.19 104.27 2ca4 n GLY 20 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2ca4 n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ca4 s LYS 21 N -0.30 2.19 1.11 1.61 -0.14 0.05 -4.33 119.74 119.93 2ca4 s LYS 21 Ca 0.00 -0.95 -0.16 0.00 -1.36 0.00 0.00 55.97 53.50 2ca4 s LYS 21 Cb 0.00 -2.30 0.24 0.00 -1.68 0.00 0.00 37.83 34.09 2ca4 s LYS 21 CO 0.00 0.54 1.11 -0.98 -0.76 0.00 0.00 175.35 175.26 2ca4 s ARG 22 N -1.75 -0.51 0.29 1.68 1.70 -0.27 -4.33 118.95 115.76 2ca4 s ARG 22 Ca 0.18 0.17 -0.30 0.00 -0.47 0.00 0.00 55.73 55.31 2ca4 s ARG 22 Cb -0.11 -1.66 -0.11 0.00 -0.57 0.00 0.00 34.95 32.51 2ca4 s ARG 22 CO 0.09 -3.28 1.50 -2.14 -1.08 0.00 0.00 175.30 170.38 2ca4 s PRO 23 N -5.22 4.20 0.31 3.89 0.02 -1.26 -4.51 135.00 132.42 2ca4 s PRO 23 Ca 0.69 2.43 0.03 0.00 0.02 0.00 0.00 61.00 64.17 2ca4 s PRO 23 Cb -0.14 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 2ca4 s PRO 23 CO 0.57 -0.50 0.09 -0.51 -0.33 0.00 0.00 177.00 176.31 2ca4 s LEU 24 N -0.72 1.91 -0.39 -5.54 1.43 -0.09 -4.86 118.68 110.42 2ca4 s LEU 24 Ca 0.59 -1.42 -0.29 0.00 -1.03 0.00 0.00 54.13 51.99 2ca4 s LEU 24 Cb -0.45 -0.15 0.02 0.00 0.03 0.00 0.00 46.19 45.64 2ca4 s LEU 24 CO 0.48 -0.71 1.08 -0.63 0.23 0.00 0.00 176.35 176.80 2ca4 s ILE 25 N -3.49 4.40 -0.32 -0.59 1.01 -0.69 -0.54 121.20 120.98 2ca4 s ILE 25 Ca 0.36 1.47 -0.28 0.00 0.00 0.00 0.00 60.65 62.20 2ca4 s ILE 25 Cb 0.08 -4.48 0.01 0.00 0.01 0.00 0.00 42.46 38.08 2ca4 s ILE 25 CO 0.15 -0.69 1.01 -0.83 0.00 0.00 0.00 174.94 174.58 2ca4 s GLY 26 N 1.99 1.58 -0.16 6.18 0.00 -0.09 -1.09 107.32 115.73 2ca4 s GLY 26 Ca 0.45 -0.15 -0.14 0.00 0.00 0.00 0.00 44.72 44.88 2ca4 s GLY 26 CO 0.22 2.15 0.03 -2.00 0.00 0.00 0.00 173.10 173.51 2ca4 h LEU 27 N 9.97 0.00 -8.05 0.66 5.85 -0.93 -3.38 115.31 119.42 2ca4 h LEU 27 Ca -0.21 -0.24 -0.22 0.00 0.84 0.00 0.00 57.88 58.05 2ca4 h LEU 27 Cb 1.07 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.88 2ca4 h LEU 27 CO 1.00 1.02 -0.72 0.42 -0.34 0.00 0.00 178.44 179.82 2ca4 s THR 28 N -2.22 0.30 -0.11 1.05 -4.23 -1.10 -4.98 115.64 104.35 2ca4 s THR 28 Ca -0.19 -0.96 0.12 0.00 -1.18 0.00 0.00 61.69 59.49 2ca4 s THR 28 Cb 0.03 -0.41 -0.24 0.00 1.34 0.00 0.00 72.50 73.23 2ca4 s THR 28 CO 0.36 -0.43 0.42 0.00 -0.54 0.00 0.00 174.62 174.43 2ca4 n ALA 29 N 1.59 1.45 -3.55 3.99 0.00 -1.26 -0.52 120.51 122.20 2ca4 n ALA 29 Ca -0.23 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 51.98 2ca4 n ALA 29 Cb 0.55 -0.60 -0.15 0.00 0.00 0.00 0.00 19.45 19.24 2ca4 n ALA 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2ca4 s ARG 30 N -2.56 0.23 0.81 0.00 3.52 -1.26 -2.88 118.95 116.80 2ca4 s ARG 30 Ca -0.09 -0.56 -0.11 0.00 -0.13 0.00 0.00 55.73 54.84 2ca4 s ARG 30 Cb 0.07 -1.23 0.08 0.00 -1.56 0.00 0.00 34.95 32.31 2ca4 s ARG 30 CO 0.81 -1.01 1.09 -1.25 -0.81 0.00 0.00 175.30 174.13 2ca4 s PRO 31 N 2.07 2.00 0.19 5.12 0.04 -1.26 -4.79 135.00 138.36 2ca4 s PRO 31 Ca 0.09 1.04 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 2ca4 s PRO 31 Cb -0.16 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.41 2ca4 s PRO 31 CO -0.36 -1.79 1.36 -2.14 0.04 0.00 0.00 177.00 174.12 2ca4 s PRO 32 N -4.93 4.34 -0.05 0.56 0.02 -1.14 -4.63 135.00 129.17 2ca4 s PRO 32 Ca 0.62 2.13 -0.02 0.00 0.02 0.00 0.00 61.00 63.74 2ca4 s PRO 32 Cb -0.17 -3.18 0.04 0.00 0.02 0.00 0.00 34.50 31.20 2ca4 s PRO 32 CO 0.56 -0.34 0.09 -0.65 -0.33 0.00 0.00 177.00 176.34 2ca4 s GLN 33 N 0.11 -0.03 -0.04 5.54 -0.21 0.33 -4.11 119.66 121.24 2ca4 s GLN 33 Ca 0.59 0.43 0.03 0.00 0.02 0.00 0.00 55.36 56.43 2ca4 s GLN 33 Cb -0.38 -0.40 0.01 0.00 1.00 0.00 0.00 33.01 33.23 2ca4 s GLN 33 CO 0.37 -0.31 -0.12 -0.51 -2.12 0.00 0.00 175.29 172.61 2ca4 s LEU 34 N 2.11 1.74 0.07 2.90 1.43 -0.14 -0.23 118.68 126.56 2ca4 s LEU 34 Ca 0.03 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2ca4 s LEU 34 Cb -0.12 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 2ca4 s LEU 34 CO -0.04 0.07 0.01 -0.70 0.23 0.00 0.00 176.35 175.92 2ca4 s GLU 35 N 0.35 2.64 -0.04 1.70 2.12 -0.25 -0.69 118.70 124.53 2ca4 s GLU 35 Ca -0.07 -0.77 -0.25 0.00 0.36 0.00 0.00 54.97 54.23 2ca4 s GLU 35 Cb -0.12 -2.59 -0.04 0.00 0.26 0.00 0.00 34.13 31.64 2ca4 s GLU 35 CO 0.02 0.56 0.77 0.99 -0.54 0.00 0.00 175.26 177.06 2ca4 s THR 36 N -1.28 4.97 0.31 -1.70 2.01 -0.77 -1.71 115.64 117.47 2ca4 s THR 36 Ca 0.25 1.61 -0.30 0.00 0.31 0.00 0.00 61.69 63.57 2ca4 s THR 36 Cb -0.12 -4.12 -0.11 0.00 0.01 0.00 0.00 72.50 68.16 2ca4 s THR 36 CO 0.17 0.24 1.58 -2.65 -0.69 0.00 0.00 174.62 173.28 2ca4 n PRO 37 N 3.69 2.71 -0.24 4.92 -0.02 -1.26 -4.19 135.00 140.62 2ca4 n PRO 37 Ca 0.00 0.96 0.22 0.00 -2.02 0.00 0.00 63.50 62.66 2ca4 n PRO 37 Cb 0.51 -2.74 0.56 0.00 -0.02 0.00 0.00 33.50 31.81 2ca4 n PRO 37 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2ca4 h PHE 38 N 4.51 0.43 -0.13 6.00 3.57 -1.96 -1.42 116.94 127.93 2ca4 h PHE 38 Ca -0.48 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.08 2ca4 h PHE 38 Cb 1.23 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 2ca4 h PHE 38 CO 0.57 0.10 0.15 0.66 -2.23 0.00 0.00 178.31 177.56 2ca4 h SER 39 N 0.31 0.00 -0.00 0.41 4.64 -1.93 -1.90 113.55 115.08 2ca4 h SER 39 Ca 0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.78 2ca4 h SER 39 Cb 1.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 2ca4 h SER 39 CO -0.15 0.00 -0.03 0.58 -0.87 0.00 0.00 176.83 176.36 2ca4 h VAL 40 N 0.00 1.08 0.00 0.95 2.07 -1.62 -2.51 116.25 116.22 2ca4 h VAL 40 Ca 0.06 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2ca4 h VAL 40 Cb 0.36 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2ca4 h VAL 40 CO -0.00 0.10 0.00 0.49 0.02 0.00 0.00 177.57 178.18 2ca4 n PHE 41 N -4.43 0.85 1.55 1.57 3.72 -0.71 -1.70 117.46 118.31 2ca4 n PHE 41 Ca -0.02 0.29 0.14 0.00 -0.05 0.00 0.00 57.45 57.81 2ca4 n PHE 41 Cb 0.16 -0.97 0.60 0.00 -0.94 0.00 0.00 39.48 38.33 2ca4 n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2ca4 n ASP 42 N -2.23 0.98 0.16 4.37 2.03 -0.94 -4.21 116.55 116.70 2ca4 n ASP 42 Ca 0.04 -1.17 0.12 0.00 0.52 0.00 0.00 54.79 54.30 2ca4 n ASP 42 Cb 0.33 0.01 0.15 0.00 -0.72 0.00 0.00 41.12 40.89 2ca4 n ASP 42 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2ca4 h GLU 43 N 1.46 0.00 0.00 -0.67 5.08 -1.41 -3.49 114.58 115.55 2ca4 h GLU 43 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ca4 h GLU 43 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2ca4 h GLU 43 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 2ca4 n GLY 44 N 1.17 -0.04 0.08 -3.84 0.00 -1.26 -5.04 105.19 96.26 2ca4 n GLY 44 Ca 0.03 -1.23 -0.11 0.00 0.00 0.00 0.00 46.02 44.71 2ca4 n GLY 44 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ca4 h LEU 45 N 0.00 0.16 -9.12 0.99 3.38 -1.95 -3.44 115.31 105.34 2ca4 h LEU 45 Ca 0.00 -0.19 -0.61 0.00 0.09 0.00 0.00 57.88 57.17 2ca4 h LEU 45 Cb 0.00 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 40.56 2ca4 h LEU 45 CO 0.00 1.15 -0.46 -0.63 0.09 0.00 0.00 178.44 178.59 2ca4 s ILE 46 N -2.68 5.34 -0.07 1.22 -1.09 -1.26 -4.72 121.20 117.94 2ca4 s ILE 46 Ca -0.02 0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 58.37 2ca4 s ILE 46 Cb 0.09 -3.53 -0.03 0.00 -1.58 0.00 0.00 42.46 37.40 2ca4 s ILE 46 CO 0.84 0.34 1.29 -0.89 -1.23 0.00 0.00 174.94 175.29 2ca4 s THR 47 N 1.00 4.10 0.51 2.92 2.01 0.94 -4.99 115.64 122.13 2ca4 s THR 47 Ca 0.09 1.41 -0.23 0.00 0.31 0.00 0.00 61.69 63.28 2ca4 s THR 47 Cb -0.13 -3.91 -0.06 0.00 0.01 0.00 0.00 72.50 68.41 2ca4 s THR 47 CO 0.04 -0.04 1.33 -2.84 -0.69 0.00 0.00 174.62 172.42 2ca4 s PRO 48 N 2.67 3.39 0.36 4.92 0.02 -1.26 -4.76 135.00 140.35 2ca4 s PRO 48 Ca 0.58 2.17 0.12 0.00 0.02 0.00 0.00 61.00 63.89 2ca4 s PRO 48 Cb -0.26 -2.38 0.90 0.00 0.02 0.00 0.00 34.50 32.78 2ca4 s PRO 48 CO 0.22 -0.97 1.83 -0.91 -0.33 0.00 0.00 177.00 176.84 2ca4 h ASN 49 N 1.78 0.60 0.92 2.53 4.21 -1.94 0.21 115.58 123.89 2ca4 h ASN 49 Ca -0.50 0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.07 2ca4 h ASN 49 Cb 1.28 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 38.43 2ca4 h ASN 49 CO 0.59 0.24 0.00 -0.90 -1.29 0.00 0.00 177.43 176.07 2ca4 n ASP 50 N -4.61 0.00 -0.00 5.81 5.68 -1.26 -2.92 116.55 119.25 2ca4 n ASP 50 Ca 0.20 0.42 0.07 0.00 -0.50 0.00 0.00 54.79 54.98 2ca4 n ASP 50 Cb 0.61 -0.47 -0.08 0.00 -1.14 0.00 0.00 41.12 40.04 2ca4 n ASP 50 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ca4 n ALA 51 N -1.47 3.85 -1.84 2.12 0.00 -0.03 -1.11 120.51 122.04 2ca4 n ALA 51 Ca 0.08 -0.40 -0.41 0.00 0.00 0.00 0.00 53.44 52.70 2ca4 n ALA 51 Cb 0.32 -0.52 -0.02 0.00 0.00 0.00 0.00 19.45 19.23 2ca4 n ALA 51 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2ca4 s PHE 52 N -2.35 3.04 0.69 0.00 5.36 -0.65 -4.59 117.98 119.46 2ca4 s PHE 52 Ca 0.05 1.23 -0.13 0.00 -0.96 0.00 0.00 56.93 57.13 2ca4 s PHE 52 Cb 0.11 -3.74 0.01 0.00 -0.34 0.00 0.00 43.02 39.06 2ca4 s PHE 52 CO 0.59 -2.23 1.08 -0.59 -1.46 0.00 0.00 175.22 172.61 2ca4 s PHE 53 N -0.57 2.80 -0.08 10.12 -0.12 -1.26 -4.95 117.98 123.92 2ca4 s PHE 53 Ca 0.54 1.51 0.01 0.00 -0.05 0.00 0.00 56.93 58.94 2ca4 s PHE 53 Cb -0.41 -3.03 0.02 0.00 -0.63 0.00 0.00 43.02 38.97 2ca4 s PHE 53 CO 0.48 -1.49 -0.10 0.08 -0.05 0.00 0.00 175.22 174.14 2ca4 s VAL 54 N -2.69 1.08 -0.02 -2.49 1.01 0.13 -4.91 120.40 112.51 2ca4 s VAL 54 Ca 0.62 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.23 2ca4 s VAL 54 Cb -0.17 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2ca4 s VAL 54 CO 0.48 0.36 -0.08 -0.13 0.00 0.00 0.00 175.10 175.73 2ca4 s ARG 55 N 1.08 0.80 -0.03 2.72 1.81 -1.26 -0.97 118.95 123.10 2ca4 s ARG 55 Ca -0.07 -0.26 -0.06 0.00 -1.72 0.00 0.00 55.73 53.62 2ca4 s ARG 55 Cb -0.14 -0.77 0.01 0.00 -0.45 0.00 0.00 34.95 33.60 2ca4 s ARG 55 CO -0.01 0.11 0.13 0.71 -0.68 0.00 0.00 175.30 175.56 2ca4 s TYR 56 N 0.13 -0.05 -0.03 -0.53 2.02 -1.26 -5.05 117.35 112.58 2ca4 s TYR 56 Ca -0.02 0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.81 2ca4 s TYR 56 Cb -0.07 -0.00 -0.26 0.00 -0.40 0.00 0.00 41.96 41.23 2ca4 s TYR 56 CO 0.00 -0.17 0.72 0.00 -1.57 0.00 0.00 175.55 174.53 2ca4 h ALA 57 N 5.16 0.44 -4.00 3.71 0.00 -1.97 -3.46 119.26 119.14 2ca4 h ALA 57 Ca -0.28 -1.26 -0.53 0.00 0.00 0.00 0.00 54.91 52.85 2ca4 h ALA 57 Cb 1.20 0.41 -0.26 0.00 0.00 0.00 0.00 17.79 19.13 2ca4 h ALA 57 CO 0.41 1.30 -0.82 -0.51 0.00 0.00 0.00 179.25 179.63 2ca4 s LEU 58 N -6.75 2.14 0.47 0.00 1.43 -1.26 -4.90 118.68 109.81 2ca4 s LEU 58 Ca -0.10 -0.46 0.25 0.00 -1.03 0.00 0.00 54.13 52.79 2ca4 s LEU 58 Cb 0.07 -0.83 1.09 0.00 0.03 0.00 0.00 46.19 46.55 2ca4 s LEU 58 CO 0.83 0.13 1.90 0.00 0.23 0.00 0.00 176.35 179.43 2ca4 h ALA 59 N 5.04 1.09 0.00 4.21 0.00 -1.87 -3.35 119.26 124.38 2ca4 h ALA 59 Ca -0.40 -0.18 -0.34 0.00 0.00 0.00 0.00 54.91 53.99 2ca4 h ALA 59 Cb 1.17 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ca4 h ALA 59 CO 0.45 0.25 1.84 0.41 0.00 0.00 0.00 179.25 182.20 2ca4 n GLY 60 N -0.11 3.05 3.79 0.00 0.00 -0.79 -4.74 105.19 106.39 2ca4 n GLY 60 Ca -0.01 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 2ca4 n GLY 60 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ca4 s ILE 61 N 2.54 3.74 0.35 -0.61 -4.36 -1.26 -1.28 121.20 120.32 2ca4 s ILE 61 Ca 0.47 1.15 -0.28 0.00 -0.26 0.00 0.00 60.65 61.73 2ca4 s ILE 61 Cb 0.16 -3.50 -0.10 0.00 1.25 0.00 0.00 42.46 40.27 2ca4 s ILE 61 CO -0.03 -0.17 1.29 -2.16 0.24 0.00 0.00 174.94 174.12 2ca4 s PRO 62 N -3.02 4.25 0.00 0.37 0.04 -1.26 -4.93 135.00 130.45 2ca4 s PRO 62 Ca 0.65 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.85 2ca4 s PRO 62 Cb -0.18 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2ca4 s PRO 62 CO 0.22 -0.25 0.48 1.28 0.04 0.00 0.00 177.00 178.77 2ca4 n LEU 63 N 0.60 0.95 -3.67 -3.56 4.77 -1.26 -4.98 117.00 109.85 2ca4 n LEU 63 Ca 0.01 -0.95 -0.13 0.00 -0.03 0.00 0.00 56.01 54.90 2ca4 n LEU 63 Cb 0.43 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 2ca4 n LEU 63 CO 0.58 0.24 -0.13 -0.70 -1.33 0.00 0.00 177.39 176.04 2ca4 s GLU 64 N -0.02 0.16 -0.03 3.23 2.12 -1.26 -5.15 118.70 117.74 2ca4 s GLU 64 Ca 0.00 0.74 0.01 0.00 0.36 0.00 0.00 54.97 56.08 2ca4 s GLU 64 Cb 0.00 -0.04 0.01 0.00 0.26 0.00 0.00 34.13 34.37 2ca4 s GLU 64 CO 0.00 -0.27 -0.04 0.42 -0.54 0.00 0.00 175.26 174.83 2ca4 s ILE 65 N 2.32 0.43 -0.49 -3.70 1.01 -1.26 -5.10 121.20 114.41 2ca4 s ILE 65 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 60.65 60.37 2ca4 s ILE 65 Cb -0.12 -0.43 0.09 0.00 0.01 0.00 0.00 42.46 42.01 2ca4 s ILE 65 CO -0.09 0.17 0.43 -0.62 0.00 0.00 0.00 174.94 174.83 2ca4 s ASP 66 N 0.52 6.15 0.65 3.58 2.15 -1.26 -4.95 116.67 123.51 2ca4 s ASP 66 Ca -0.06 -1.48 0.43 0.00 0.43 0.00 0.00 52.55 51.87 2ca4 s ASP 66 Cb -0.10 -2.19 2.32 0.00 -0.30 0.00 0.00 42.92 42.66 2ca4 s ASP 66 CO -0.00 -0.71 2.31 1.55 -0.17 0.00 0.00 175.17 178.14 2ca4 h PRO 67 N 8.79 0.00 0.16 4.34 0.13 -1.99 -1.51 132.00 141.92 2ca4 h PRO 67 Ca -0.29 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.54 2ca4 h PRO 67 Cb 1.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.25 2ca4 h PRO 67 CO 0.93 0.00 -1.37 -0.44 -0.23 0.00 0.00 178.00 176.88 2ca4 h ASP 68 N 0.00 0.52 1.83 1.44 3.32 -2.05 -3.30 116.42 118.19 2ca4 h ASP 68 Ca 0.00 -0.59 -0.01 0.00 0.02 0.00 0.00 57.03 56.45 2ca4 h ASP 68 Cb 0.06 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 2ca4 h ASP 68 CO 0.00 1.47 -0.17 0.00 -1.72 0.00 0.00 179.24 178.82 2ca4 h ALA 69 N 0.45 0.91 -2.51 3.45 0.00 -1.73 -3.47 119.26 116.36 2ca4 h ALA 69 Ca -0.19 -0.03 -0.56 0.00 0.00 0.00 0.00 54.91 54.13 2ca4 h ALA 69 Cb 2.03 -0.00 0.08 0.00 0.00 0.00 0.00 17.79 19.90 2ca4 h ALA 69 CO 0.21 0.04 0.76 0.34 0.00 0.00 0.00 179.25 180.61 2ca4 n PHE 70 N -3.05 2.47 -4.29 0.00 7.35 -0.79 -5.01 117.46 114.13 2ca4 n PHE 70 Ca 0.03 0.32 -0.19 0.00 -0.76 0.00 0.00 57.45 56.85 2ca4 n PHE 70 Cb 0.55 -2.54 -0.15 0.00 0.35 0.00 0.00 39.48 37.69 2ca4 n PHE 70 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2ca4 s ARG 71 N -0.17 0.78 -0.29 -4.13 1.81 -1.26 -4.22 118.95 111.47 2ca4 s ARG 71 Ca 0.68 -0.24 -0.17 0.00 -1.72 0.00 0.00 55.73 54.28 2ca4 s ARG 71 Cb -0.59 -0.75 -0.02 0.00 -0.45 0.00 0.00 34.95 33.14 2ca4 s ARG 71 CO 0.46 0.09 0.49 -1.17 -0.68 0.00 0.00 175.30 174.50 2ca4 s LEU 72 N 0.20 4.12 -0.10 2.53 2.96 0.77 -4.75 118.68 124.42 2ca4 s LEU 72 Ca -0.03 0.34 -0.17 0.00 -0.22 0.00 0.00 54.13 54.05 2ca4 s LEU 72 Cb -0.07 -2.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.97 2ca4 s LEU 72 CO 0.00 -0.32 0.45 -1.61 -1.32 0.00 0.00 176.35 173.55 2ca4 s GLU 73 N 2.30 4.27 -0.20 1.98 0.41 0.41 -1.01 118.70 126.87 2ca4 s GLU 73 Ca 0.19 0.43 -0.01 0.00 -0.41 0.00 0.00 54.97 55.17 2ca4 s GLU 73 Cb -0.16 -3.40 0.01 0.00 -1.78 0.00 0.00 34.13 28.81 2ca4 s GLU 73 CO 0.10 0.26 -0.14 0.42 -0.49 0.00 0.00 175.26 175.42 2ca4 s ILE 74 N 0.30 2.57 0.21 -1.63 -1.09 -0.19 -0.32 121.20 121.05 2ca4 s ILE 74 Ca 0.25 -0.77 -0.02 0.00 -2.23 0.00 0.00 60.65 57.88 2ca4 s ILE 74 Cb -0.15 -2.13 0.01 0.00 -1.58 0.00 0.00 42.46 38.61 2ca4 s ILE 74 CO 0.10 0.49 0.32 2.29 -1.23 0.00 0.00 174.94 176.92 2ca4 n LYS 75 N 4.69 0.46 0.00 2.79 2.85 0.26 -1.18 118.16 128.03 2ca4 n LYS 75 Ca -0.20 -1.58 0.00 0.00 -1.05 0.00 0.00 58.31 55.49 2ca4 n LYS 75 Cb 0.50 1.59 0.00 0.00 -0.65 0.00 0.00 35.03 36.47 2ca4 n LYS 75 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2ca4 n GLY 76 N -0.33 0.74 2.40 2.58 0.00 -1.26 -0.84 105.19 108.47 2ca4 n GLY 76 Ca -0.01 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 2ca4 n GLY 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ca4 n LYS 77 N 4.77 3.19 -4.26 1.61 4.76 0.14 -4.83 118.16 123.55 2ca4 n LYS 77 Ca 0.00 -1.95 -0.20 0.00 -2.87 0.00 0.00 58.31 53.29 2ca4 n LYS 77 Cb 0.00 -2.68 -0.11 0.00 -1.84 0.00 0.00 35.03 30.40 2ca4 n LYS 77 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2ca4 s VAL 78 N 2.52 1.46 0.11 -0.18 -7.23 -1.26 -1.75 120.40 114.07 2ca4 s VAL 78 Ca 0.61 -1.69 -0.18 0.00 -1.81 0.00 0.00 61.98 58.91 2ca4 s VAL 78 Cb 0.16 -1.55 -0.06 0.00 0.56 0.00 0.00 36.38 35.50 2ca4 s VAL 78 CO -0.05 -0.32 1.62 1.23 -0.31 0.00 0.00 175.10 177.27 2ca4 h GLY 79 N 3.63 0.48 -7.60 2.32 0.00 -0.02 -3.42 103.07 98.46 2ca4 h GLY 79 Ca -0.41 -0.28 -0.60 0.00 0.00 0.00 0.00 47.33 46.03 2ca4 h GLY 79 CO 0.48 0.26 -0.78 -1.59 0.00 0.00 0.00 176.54 174.91 2ca4 s THR 80 N -5.41 1.44 0.37 4.70 2.01 -0.26 -5.05 115.64 113.43 2ca4 s THR 80 Ca -0.13 -1.17 -0.27 0.00 0.31 0.00 0.00 61.69 60.42 2ca4 s THR 80 Cb 0.08 -1.73 -0.12 0.00 0.01 0.00 0.00 72.50 70.74 2ca4 s THR 80 CO 0.73 -0.12 1.27 -2.65 -0.69 0.00 0.00 174.62 173.16 2ca4 n PRO 81 N 4.70 2.02 -4.86 4.92 -0.02 -1.26 -4.55 135.00 135.96 2ca4 n PRO 81 Ca -0.12 0.71 -0.30 0.00 -2.02 0.00 0.00 63.50 61.78 2ca4 n PRO 81 Cb 0.44 -2.32 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 2ca4 n PRO 81 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ca4 s LEU 82 N -1.14 2.17 -0.30 2.45 1.43 -0.32 -4.98 118.68 117.99 2ca4 s LEU 82 Ca 0.57 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 2ca4 s LEU 82 Cb -0.55 -1.25 0.09 0.00 0.03 0.00 0.00 46.19 44.51 2ca4 s LEU 82 CO 0.61 0.24 0.06 -0.55 0.23 0.00 0.00 176.35 176.94 2ca4 s SER 83 N -1.27 4.08 -0.16 2.29 0.15 -1.26 -1.02 113.70 116.51 2ca4 s SER 83 Ca 0.11 -1.63 -0.04 0.00 0.70 0.00 0.00 55.95 55.10 2ca4 s SER 83 Cb -0.10 -1.05 -0.03 0.00 -1.71 0.00 0.00 66.02 63.13 2ca4 s SER 83 CO 0.02 -0.37 -0.03 -0.76 1.20 0.00 0.00 173.24 173.30 2ca4 s LEU 84 N 1.45 3.26 0.75 3.45 1.43 -0.18 -4.91 118.68 123.94 2ca4 s LEU 84 Ca 0.07 -0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 52.92 2ca4 s LEU 84 Cb -0.18 -1.79 0.04 0.00 0.03 0.00 0.00 46.19 44.30 2ca4 s LEU 84 CO -0.18 0.16 1.13 -0.94 0.23 0.00 0.00 176.35 176.75 2ca4 s SER 85 N 0.42 5.00 0.31 2.29 1.04 -1.26 -0.16 113.70 121.33 2ca4 s SER 85 Ca -0.03 1.00 -0.01 0.00 0.48 0.00 0.00 55.95 57.39 2ca4 s SER 85 Cb -0.14 -1.66 0.48 0.00 0.10 0.00 0.00 66.02 64.79 2ca4 s SER 85 CO 0.03 -1.61 1.92 -0.07 0.98 0.00 0.00 173.24 174.49 2ca4 h LEU 86 N -0.85 0.82 -0.57 2.42 3.38 -1.82 -1.35 115.31 117.35 2ca4 h LEU 86 Ca -0.46 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 2ca4 h LEU 86 Cb 1.29 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2ca4 h LEU 86 CO 0.64 0.67 0.14 -0.61 0.09 0.00 0.00 178.44 179.37 2ca4 h GLN 87 N 0.92 0.91 -0.28 1.13 4.15 -1.94 -1.34 115.11 118.67 2ca4 h GLN 87 Ca 0.23 -0.22 0.07 0.00 0.77 0.00 0.00 58.65 59.50 2ca4 h GLN 87 Cb 0.04 -0.12 -0.07 0.00 0.21 0.00 0.00 27.48 27.54 2ca4 h GLN 87 CO -0.04 0.85 -0.20 -0.44 -1.93 0.00 0.00 178.83 177.07 2ca4 h ASP 88 N 0.82 -0.66 -1.00 -0.69 3.32 -1.83 -1.26 116.42 115.12 2ca4 h ASP 88 Ca 0.18 0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.37 2ca4 h ASP 88 Cb 0.35 0.33 -0.05 0.00 0.22 0.00 0.00 39.33 40.18 2ca4 h ASP 88 CO 0.00 -0.24 0.66 -0.07 -1.72 0.00 0.00 179.24 177.87 2ca4 h LEU 89 N -0.18 1.14 -0.12 1.55 3.38 -1.05 0.49 115.31 120.51 2ca4 h LEU 89 Ca 0.15 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 2ca4 h LEU 89 Cb 0.41 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2ca4 h LEU 89 CO -0.39 0.82 -0.34 0.11 0.09 0.00 0.00 178.44 178.73 2ca4 h LYS 90 N 1.34 0.00 0.00 1.13 1.57 -0.97 -3.33 116.57 116.31 2ca4 h LYS 90 Ca 0.37 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.87 2ca4 h LYS 90 Cb -0.14 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.12 2ca4 h LYS 90 CO -0.08 0.34 -2.06 0.09 -0.57 0.00 0.00 179.45 177.17 2ca4 n ASN 91 N -3.21 2.12 -0.16 0.86 3.02 -0.50 -4.65 115.26 112.75 2ca4 n ASN 91 Ca 0.02 -0.07 0.12 0.00 -0.03 0.00 0.00 54.58 54.63 2ca4 n ASN 91 Cb 0.65 0.10 0.25 0.00 -0.61 0.00 0.00 39.78 40.17 2ca4 n ASN 91 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2ca4 n ASP 92 N -2.88 0.93 -4.21 6.41 8.00 0.14 -4.90 116.55 120.03 2ca4 n ASP 92 Ca -0.30 -0.73 -0.18 0.00 0.71 0.00 0.00 54.79 54.29 2ca4 n ASP 92 Cb 0.90 0.29 -0.11 0.00 -0.02 0.00 0.00 41.12 42.18 2ca4 n ASP 92 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ca4 s PHE 93 N -2.73 1.32 0.33 1.24 0.08 -1.25 -5.07 117.98 111.90 2ca4 s PHE 93 Ca 0.17 -0.52 -0.26 0.00 0.12 0.00 0.00 56.93 56.44 2ca4 s PHE 93 Cb 0.18 -0.71 -0.10 0.00 -0.57 0.00 0.00 43.02 41.82 2ca4 s PHE 93 CO 0.62 0.10 0.99 -1.25 -0.10 0.00 0.00 175.22 175.58 2ca4 s PRO 94 N -2.29 4.51 0.31 0.24 0.04 -1.26 -4.83 135.00 131.71 2ca4 s PRO 94 Ca 0.04 1.45 -0.24 0.00 0.04 0.00 0.00 61.00 62.30 2ca4 s PRO 94 Cb -0.07 -2.83 -0.10 0.00 0.04 0.00 0.00 34.50 31.55 2ca4 s PRO 94 CO 0.03 0.19 0.88 0.00 0.04 0.00 0.00 177.00 178.14 2ca4 s ALA 95 N -1.53 3.25 0.31 8.56 0.00 -1.26 -4.49 121.76 126.60 2ca4 s ALA 95 Ca 0.50 0.40 0.08 0.00 0.00 0.00 0.00 51.96 52.95 2ca4 s ALA 95 Cb -0.22 -3.07 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 2ca4 s ALA 95 CO 0.28 0.22 -0.08 -1.54 0.00 0.00 0.00 175.76 174.63 2ca4 s SER 96 N -1.70 3.20 0.06 0.00 1.04 0.81 -4.97 113.70 112.14 2ca4 s SER 96 Ca 0.50 -1.19 0.05 0.00 0.48 0.00 0.00 55.95 55.79 2ca4 s SER 96 Cb -0.17 -0.25 -0.03 0.00 0.10 0.00 0.00 66.02 65.68 2ca4 s SER 96 CO 0.22 -0.27 -0.14 -1.61 0.98 0.00 0.00 173.24 172.42 2ca4 s GLU 97 N -3.67 0.81 -0.13 4.02 2.02 -1.26 -1.69 118.70 118.80 2ca4 s GLU 97 Ca 0.31 -0.90 -0.08 0.00 0.02 0.00 0.00 54.97 54.32 2ca4 s GLU 97 Cb 0.03 -0.80 0.05 0.00 0.10 0.00 0.00 34.13 33.50 2ca4 s GLU 97 CO 0.14 0.18 0.32 0.54 0.02 0.00 0.00 175.26 176.46 2ca4 s VAL 98 N -1.21 -0.03 -0.31 2.63 0.11 -0.42 -4.98 120.40 116.19 2ca4 s VAL 98 Ca -0.02 0.11 -0.23 0.00 -2.93 0.00 0.00 61.98 58.91 2ca4 s VAL 98 Cb -0.10 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.28 2ca4 s VAL 98 CO 0.02 0.04 0.76 -0.69 -3.33 0.00 0.00 175.10 171.90 2ca4 s VAL 99 N 1.17 4.81 -0.05 2.04 1.01 -1.26 -0.34 120.40 127.77 2ca4 s VAL 99 Ca -0.08 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.94 2ca4 s VAL 99 Cb -0.08 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.19 2ca4 s VAL 99 CO -0.09 -0.26 0.13 0.00 0.00 0.00 0.00 175.10 174.88 2ca4 s ALA 100 N 2.91 -0.29 0.16 5.51 0.00 -0.59 -2.92 121.76 126.54 2ca4 s ALA 100 Ca 0.31 0.45 -0.30 0.00 0.00 0.00 0.00 51.96 52.41 2ca4 s ALA 100 Cb -0.14 -0.28 -0.08 0.00 0.00 0.00 0.00 23.12 22.62 2ca4 s ALA 100 CO 0.13 -0.09 1.26 0.08 0.00 0.00 0.00 175.76 177.14 2ca4 s VAL 101 N 0.41 3.51 -0.22 0.00 1.01 -0.42 -2.54 120.40 122.15 2ca4 s VAL 101 Ca -0.03 1.20 -0.05 0.00 0.00 0.00 0.00 61.98 63.10 2ca4 s VAL 101 Cb -0.04 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2ca4 s VAL 101 CO -0.02 0.16 0.01 0.21 0.00 0.00 0.00 175.10 175.46 2ca4 s ASN 102 N 0.49 4.74 -0.03 3.32 2.47 0.87 -4.58 114.94 122.22 2ca4 s ASN 102 Ca 0.57 -0.26 0.01 0.00 0.42 0.00 0.00 52.86 53.59 2ca4 s ASN 102 Cb -0.34 -1.82 0.02 0.00 -1.45 0.00 0.00 41.25 37.66 2ca4 s ASN 102 CO 0.35 0.01 -0.04 -1.58 -3.72 0.00 0.00 177.10 172.12 2ca4 s GLN 103 N 1.32 0.66 0.31 0.43 0.74 -1.26 -0.68 119.66 121.18 2ca4 s GLN 103 Ca 0.04 -0.10 -0.29 0.00 0.05 0.00 0.00 55.36 55.06 2ca4 s GLN 103 Cb -0.15 -0.69 -0.11 0.00 1.10 0.00 0.00 33.01 33.17 2ca4 s GLN 103 CO 0.01 -0.04 1.53 0.00 -0.55 0.00 0.00 175.29 176.23 2ca4 n SER 105 N 1.63 0.01 -1.16 0.00 7.64 -1.26 -1.32 113.62 119.17 2ca4 n SER 105 Ca 0.05 1.34 0.11 0.00 1.01 0.00 0.00 58.87 61.38 2ca4 n SER 105 Cb 0.38 -0.53 0.27 0.00 -1.01 0.00 0.00 64.21 63.32 2ca4 n SER 105 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ca4 n GLY 106 N -1.34 1.84 3.56 0.23 0.00 -1.26 -2.15 105.19 106.06 2ca4 n GLY 106 Ca 0.22 -0.72 -0.53 0.00 0.00 0.00 0.00 46.02 45.00 2ca4 n GLY 106 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ca4 n ASN 107 N 1.41 1.07 -0.10 1.61 5.15 -0.43 -1.09 115.26 122.87 2ca4 n ASN 107 Ca 0.21 1.13 -0.01 0.00 -0.60 0.00 0.00 54.58 55.31 2ca4 n ASN 107 Cb 0.57 -1.12 -0.01 0.00 -0.53 0.00 0.00 39.78 38.69 2ca4 n ASN 107 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2ca4 n SER 108 N 2.15 -3.60 -0.19 1.20 7.64 0.51 -4.50 113.62 116.84 2ca4 n SER 108 Ca 0.18 0.03 0.09 0.00 1.01 0.00 0.00 58.87 60.18 2ca4 n SER 108 Cb 0.18 -1.22 0.39 0.00 -1.01 0.00 0.00 64.21 62.55 2ca4 n SER 108 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2ca4 h ARG 109 N 0.55 0.66 0.00 1.43 2.43 -0.97 -1.44 114.38 117.04 2ca4 h ARG 109 Ca -0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2ca4 h ARG 109 Cb 0.23 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2ca4 h ARG 109 CO 0.04 0.44 0.11 0.78 -1.51 0.00 0.00 179.97 179.83 2ca4 h GLY 110 N 0.68 0.00 1.09 2.80 0.00 -1.21 -2.08 103.07 104.35 2ca4 h GLY 110 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2ca4 h GLY 110 CO -0.12 0.00 -0.63 0.69 0.00 0.00 0.00 176.54 176.48 2ca4 n PHE 111 N -2.96 0.42 -1.83 5.60 3.72 -0.54 -4.82 117.46 117.05 2ca4 n PHE 111 Ca -0.03 0.12 -0.42 0.00 -0.05 0.00 0.00 57.45 57.08 2ca4 n PHE 111 Cb 0.17 -0.56 -0.02 0.00 -0.94 0.00 0.00 39.48 38.13 2ca4 n PHE 111 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2ca4 s VAL 112 N -3.14 2.21 -0.07 -4.37 1.01 -0.78 -5.01 120.40 110.25 2ca4 s VAL 112 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2ca4 s VAL 112 Cb 0.14 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.43 2ca4 s VAL 112 CO 0.72 0.03 -0.04 -0.70 0.00 0.00 0.00 175.10 175.10 2ca4 s GLU 113 N -0.26 1.00 0.60 2.72 2.56 -1.26 -2.84 118.70 121.22 2ca4 s GLU 113 Ca 0.64 -0.10 -0.19 0.00 0.00 0.00 0.00 54.97 55.32 2ca4 s GLU 113 Cb -0.47 -1.11 -0.03 0.00 2.00 0.00 0.00 34.13 34.53 2ca4 s GLU 113 CO 0.45 -0.19 1.30 -1.25 -0.56 0.00 0.00 175.26 175.01 2ca4 s PRO 114 N 1.43 2.84 0.52 4.30 0.04 -1.26 -4.93 135.00 137.93 2ca4 s PRO 114 Ca -0.02 2.07 -0.22 0.00 0.04 0.00 0.00 61.00 62.87 2ca4 s PRO 114 Cb -0.13 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 2ca4 s PRO 114 CO -0.03 -1.38 1.22 0.54 0.04 0.00 0.00 177.00 177.39 2ca4 n ARG 115 N -1.54 1.54 -4.33 4.56 5.12 -1.13 -5.03 116.66 115.84 2ca4 n ARG 115 Ca 0.14 0.56 -0.19 0.00 -1.93 0.00 0.00 57.85 56.43 2ca4 n ARG 115 Cb 0.47 -2.40 -0.10 0.00 -1.16 0.00 0.00 32.46 29.27 2ca4 n ARG 115 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2ca4 s VAL 116 N -1.32 1.70 0.71 1.55 -7.23 -1.26 -5.12 120.40 109.43 2ca4 s VAL 116 Ca 0.70 -2.09 -0.13 0.00 -1.81 0.00 0.00 61.98 58.65 2ca4 s VAL 116 Cb -0.45 -1.94 0.02 0.00 0.56 0.00 0.00 36.38 34.58 2ca4 s VAL 116 CO 0.51 -0.52 1.09 -0.83 -0.31 0.00 0.00 175.10 175.05 2ca4 s GLY 117 N -3.07 1.90 0.00 2.32 0.00 -1.26 -4.93 107.32 102.28 2ca4 s GLY 117 Ca 0.19 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.29 2ca4 s GLY 117 CO 0.06 0.72 0.00 0.61 0.00 0.00 0.00 173.10 174.49 2ca4 n GLY 118 N -0.98 0.69 3.62 0.20 0.00 -1.26 -4.87 105.19 102.58 2ca4 n GLY 118 Ca 0.09 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.56 2ca4 n GLY 118 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ca4 s GLY 119 N 0.00 1.25 -1.16 -0.02 0.00 -1.26 -4.92 107.32 101.21 2ca4 s GLY 119 Ca 0.00 0.07 -0.19 0.00 0.00 0.00 0.00 44.72 44.60 2ca4 s GLY 119 CO 0.00 2.72 1.55 1.20 0.00 0.00 0.00 173.10 178.57 2ca4 s GLN 120 N 4.53 3.85 -0.06 2.90 -1.52 -1.26 -4.60 119.66 123.49 2ca4 s GLN 120 Ca 0.61 -1.80 -0.10 0.00 -1.95 0.00 0.00 55.36 52.12 2ca4 s GLN 120 Cb -0.17 -5.35 -0.05 0.00 -0.22 0.00 0.00 33.01 27.22 2ca4 s GLN 120 CO 0.27 -2.12 0.26 -0.51 -0.25 0.00 0.00 175.29 172.94 2ca4 s LEU 121 N 3.90 4.42 0.00 2.90 1.43 -1.26 -4.73 118.68 125.34 2ca4 s LEU 121 Ca 0.48 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.25 2ca4 s LEU 121 Cb 0.01 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.90 2ca4 s LEU 121 CO -0.00 0.36 0.00 0.00 0.23 0.00 0.00 176.35 176.94 2ca4 n ALA 122 N 1.84 0.00 0.37 4.21 0.00 -1.26 -0.79 120.51 124.88 2ca4 n ALA 122 Ca -0.17 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.34 2ca4 n ALA 122 Cb 0.54 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.21 2ca4 n ALA 122 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ca4 n ASN 123 N 0.00 2.78 -0.76 0.00 3.02 -1.26 -0.36 115.26 118.68 2ca4 n ASN 123 Ca 0.00 -2.08 0.07 0.00 -0.03 0.00 0.00 54.58 52.54 2ca4 n ASN 123 Cb 0.00 -0.36 0.18 0.00 -0.61 0.00 0.00 39.78 38.99 2ca4 n ASN 123 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ca4 n GLY 124 N 1.16 0.93 2.68 7.41 0.00 -1.26 -4.37 105.19 111.74 2ca4 n GLY 124 Ca 0.16 -0.44 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2ca4 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ca4 n ALA 125 N 0.70 6.28 -3.10 4.61 0.00 -1.26 -1.84 120.51 125.89 2ca4 n ALA 125 Ca 0.14 -4.37 -0.12 0.00 0.00 0.00 0.00 53.44 49.08 2ca4 n ALA 125 Cb 0.35 -2.21 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 2ca4 n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ca4 s MET 126 N -3.82 0.98 -0.05 0.00 0.23 -1.26 -1.46 119.30 113.91 2ca4 s MET 126 Ca 0.44 -0.49 -0.30 0.00 -1.03 0.00 0.00 55.69 54.32 2ca4 s MET 126 Cb 0.26 0.44 0.11 0.00 -1.53 0.00 0.00 34.83 34.10 2ca4 s MET 126 CO -0.20 -0.36 0.94 0.20 -2.03 0.00 0.00 175.02 173.57 2ca4 s GLY 127 N -2.32 -0.41 -0.11 3.16 0.00 0.14 -4.70 107.32 103.08 2ca4 s GLY 127 Ca -0.02 1.28 0.02 0.00 0.00 0.00 0.00 44.72 45.99 2ca4 s GLY 127 CO -0.06 0.50 -0.16 0.21 0.00 0.00 0.00 173.10 173.60 2ca4 s ASN 128 N -2.16 2.46 0.04 1.64 2.47 -1.26 -0.09 114.94 118.04 2ca4 s ASN 128 Ca 0.04 -0.43 -0.03 0.00 0.42 0.00 0.00 52.86 52.86 2ca4 s ASN 128 Cb -0.01 -1.10 -0.02 0.00 -1.45 0.00 0.00 41.25 38.66 2ca4 s ASN 128 CO -0.06 0.02 0.03 0.00 -3.72 0.00 0.00 177.10 173.37 2ca4 s ALA 129 N 0.95 0.19 -0.37 1.71 0.00 -1.05 -0.04 121.76 123.15 2ca4 s ALA 129 Ca -0.07 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 50.80 2ca4 s ALA 129 Cb -0.15 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.24 2ca4 s ALA 129 CO -0.01 -0.32 0.95 0.50 0.00 0.00 0.00 175.76 176.88 2ca4 s ARG 130 N -2.98 3.85 -0.13 0.00 3.52 -1.26 -1.54 118.95 120.41 2ca4 s ARG 130 Ca -0.02 0.61 -0.06 0.00 -0.13 0.00 0.00 55.73 56.14 2ca4 s ARG 130 Cb 0.01 -3.80 -0.04 0.00 -1.56 0.00 0.00 34.95 29.56 2ca4 s ARG 130 CO -0.06 -0.97 0.08 -1.58 -0.81 0.00 0.00 175.30 171.95 2ca4 s TRP 131 N 3.54 3.37 -0.02 5.12 0.52 0.53 -0.47 118.94 131.53 2ca4 s TRP 131 Ca 0.39 0.30 0.04 0.00 0.02 0.00 0.00 56.10 56.86 2ca4 s TRP 131 Cb -0.12 -1.93 -0.01 0.00 -1.15 0.00 0.00 33.47 30.26 2ca4 s TRP 131 CO 0.19 0.49 -0.14 0.50 0.02 0.00 0.00 176.95 178.02 2ca4 s ARG 132 N -0.58 1.24 0.00 4.98 3.52 -0.54 -1.31 118.95 126.25 2ca4 s ARG 132 Ca 0.11 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 55.22 2ca4 s ARG 132 Cb -0.12 -1.16 0.00 0.00 -1.56 0.00 0.00 34.95 32.11 2ca4 s ARG 132 CO 0.02 0.26 0.00 0.41 -0.81 0.00 0.00 175.30 175.18 2ca4 n GLY 133 N 2.92 -0.61 3.48 8.12 0.00 -0.68 -1.50 105.19 116.92 2ca4 n GLY 133 Ca -0.16 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 2ca4 n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ca4 s VAL 134 N -3.46 3.94 0.11 1.61 1.01 -0.57 -0.14 120.40 122.91 2ca4 s VAL 134 Ca 0.00 -0.33 -0.33 0.00 0.00 0.00 0.00 61.98 61.32 2ca4 s VAL 134 Cb 0.00 -2.75 -0.12 0.00 0.00 0.00 0.00 36.38 33.50 2ca4 s VAL 134 CO 0.00 0.46 1.73 -2.65 0.00 0.00 0.00 175.10 174.64 2ca4 n PRO 135 N 3.86 2.44 -0.33 2.72 -0.02 -1.26 -0.37 135.00 142.04 2ca4 n PRO 135 Ca -0.17 0.89 0.20 0.00 -2.02 0.00 0.00 63.50 62.39 2ca4 n PRO 135 Cb 0.52 -2.72 0.45 0.00 -0.02 0.00 0.00 33.50 31.73 2ca4 n PRO 135 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2ca4 h LEU 136 N 7.43 0.55 -0.94 2.45 5.85 -1.27 -0.92 115.31 128.45 2ca4 h LEU 136 Ca -0.46 0.09 0.28 0.00 0.84 0.00 0.00 57.88 58.64 2ca4 h LEU 136 Cb 1.24 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 42.11 2ca4 h LEU 136 CO 0.93 0.13 0.24 0.50 -0.34 0.00 0.00 178.44 179.89 2ca4 h LYS 137 N 0.50 0.11 -0.00 1.25 3.64 -1.76 -0.28 116.57 120.03 2ca4 h LYS 137 Ca 0.59 -0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 59.74 2ca4 h LYS 137 Cb 1.31 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2ca4 h LYS 137 CO -0.34 0.07 -0.92 0.00 -2.27 0.00 0.00 179.45 176.00 2ca4 h ALA 138 N 1.89 0.40 -0.27 5.00 0.00 -1.53 -0.99 119.26 123.76 2ca4 h ALA 138 Ca 0.63 -0.71 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2ca4 h ALA 138 Cb 1.37 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 2ca4 h ALA 138 CO -0.76 0.83 -0.23 0.28 0.00 0.00 0.00 179.25 179.38 2ca4 h VAL 139 N 0.21 1.31 -0.36 0.00 2.07 -1.42 -2.63 116.25 115.41 2ca4 h VAL 139 Ca -0.07 -1.38 -0.09 0.00 0.82 0.00 0.00 66.70 65.98 2ca4 h VAL 139 Cb 1.56 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 2ca4 h VAL 139 CO 0.16 0.44 -0.15 -0.07 0.02 0.00 0.00 177.57 177.96 2ca4 h LEU 140 N 0.35 0.65 -0.55 2.57 3.38 -0.99 -1.42 115.31 119.31 2ca4 h LEU 140 Ca 0.05 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2ca4 h LEU 140 Cb 0.78 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2ca4 h LEU 140 CO 0.06 0.82 0.16 -0.08 0.09 0.00 0.00 178.44 179.49 2ca4 h GLU 141 N 0.59 0.86 -0.49 1.13 4.81 -1.21 0.76 114.58 121.04 2ca4 h GLU 141 Ca 0.10 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2ca4 h GLU 141 Cb 0.60 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 2ca4 h GLU 141 CO 0.04 0.80 0.31 -0.22 -0.73 0.00 0.00 179.01 179.20 2ca4 h LYS 142 N 0.77 0.60 -0.49 1.92 1.63 -1.26 -2.54 116.57 117.19 2ca4 h LYS 142 Ca 0.18 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.89 2ca4 h LYS 142 Cb 0.30 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.77 2ca4 h LYS 142 CO -0.00 0.40 0.12 0.00 -3.45 0.00 0.00 179.45 176.51 2ca4 h ALA 143 N 1.20 1.28 -2.39 5.00 0.00 -1.04 -3.45 119.26 119.87 2ca4 h ALA 143 Ca 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ca4 h ALA 143 Cb -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2ca4 h ALA 143 CO -0.06 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.10 2ca4 n GLY 144 N -0.91 -1.31 3.73 0.00 0.00 0.24 -1.11 105.19 105.83 2ca4 n GLY 144 Ca 0.03 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2ca4 n GLY 144 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ca4 s VAL 145 N -0.41 2.36 0.27 1.61 1.01 -1.20 -0.29 120.40 123.73 2ca4 s VAL 145 Ca 0.00 0.27 -0.24 0.00 0.00 0.00 0.00 61.98 62.01 2ca4 s VAL 145 Cb 0.00 -3.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.12 2ca4 s VAL 145 CO 0.00 0.03 0.86 -1.10 0.00 0.00 0.00 175.10 174.89 2ca4 s GLN 146 N 0.58 4.50 0.41 2.72 -0.21 -0.72 -4.90 119.66 122.05 2ca4 s GLN 146 Ca 0.68 1.18 -0.25 0.00 0.02 0.00 0.00 55.36 56.99 2ca4 s GLN 146 Cb -0.46 -2.90 -0.10 0.00 1.00 0.00 0.00 33.01 30.55 2ca4 s GLN 146 CO 0.37 0.36 1.19 0.00 -2.12 0.00 0.00 175.29 175.09 2ca4 n ALA 147 N 0.77 0.94 0.00 6.09 0.00 -1.26 -1.89 120.51 125.17 2ca4 n ALA 147 Ca -0.00 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2ca4 n ALA 147 Cb 0.50 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.74 2ca4 n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ca4 n GLY 148 N 0.92 3.10 3.53 0.00 0.00 -1.26 -5.06 105.19 106.42 2ca4 n GLY 148 Ca 0.07 -0.96 -0.60 0.00 0.00 0.00 0.00 46.02 44.53 2ca4 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ca4 n ALA 149 N 0.00 -3.32 -0.02 4.61 0.00 -0.79 -4.52 120.51 116.47 2ca4 n ALA 149 Ca 0.00 0.59 -0.02 0.00 0.00 0.00 0.00 53.44 54.00 2ca4 n ALA 149 Cb 0.00 -1.79 -0.01 0.00 0.00 0.00 0.00 19.45 17.65 2ca4 n ALA 149 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ca4 n LYS 150 N 1.84 0.08 -4.07 0.00 5.02 0.07 -4.89 118.16 116.21 2ca4 n LYS 150 Ca 0.21 0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.45 2ca4 n LYS 150 Cb 0.06 -1.03 -0.10 0.00 -0.02 0.00 0.00 35.03 33.95 2ca4 n LYS 150 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2ca4 s GLN 151 N -2.06 0.70 -0.12 1.97 -0.21 -1.01 -1.06 119.66 117.87 2ca4 s GLN 151 Ca -0.04 -1.22 0.02 0.00 0.02 0.00 0.00 55.36 54.14 2ca4 s GLN 151 Cb 0.01 0.24 0.01 0.00 1.00 0.00 0.00 33.01 34.27 2ca4 s GLN 151 CO 0.07 -0.16 -0.18 0.08 -2.12 0.00 0.00 175.29 172.98 2ca4 s VAL 152 N -3.93 1.72 0.09 1.09 1.01 0.25 -1.20 120.40 119.42 2ca4 s VAL 152 Ca 0.10 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 2ca4 s VAL 152 Cb 0.07 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 2ca4 s VAL 152 CO -0.08 0.48 0.27 0.42 0.00 0.00 0.00 175.10 176.20 2ca4 s THR 153 N 0.91 5.30 -0.06 3.92 -4.23 0.20 -1.02 115.64 120.67 2ca4 s THR 153 Ca -0.07 -0.19 0.01 0.00 -1.18 0.00 0.00 61.69 60.26 2ca4 s THR 153 Cb -0.15 -3.62 0.02 0.00 1.34 0.00 0.00 72.50 70.09 2ca4 s THR 153 CO -0.02 0.12 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.75 2ca4 s PHE 154 N -1.55 1.13 0.09 3.99 0.08 0.91 -1.65 117.98 120.97 2ca4 s PHE 154 Ca 0.37 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 57.05 2ca4 s PHE 154 Cb -0.13 -0.90 -0.03 0.00 -0.57 0.00 0.00 43.02 41.39 2ca4 s PHE 154 CO 0.26 -0.26 -0.11 0.20 -0.10 0.00 0.00 175.22 175.21 2ca4 s GLY 155 N 0.91 0.82 0.08 4.36 0.00 -0.31 -1.81 107.32 111.38 2ca4 s GLY 155 Ca -0.11 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.52 2ca4 s GLY 155 CO 0.01 -1.16 0.01 0.61 0.00 0.00 0.00 173.10 172.57 2ca4 n GLY 156 N 0.83 4.04 0.21 0.20 0.00 -1.26 -1.60 105.19 107.60 2ca4 n GLY 156 Ca -0.18 -2.14 0.09 0.00 0.00 0.00 0.00 46.02 43.79 2ca4 n GLY 156 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ca4 h LEU 157 N 0.00 0.00-10.31 0.99 3.38 -1.45 -3.45 115.31 104.46 2ca4 h LEU 157 Ca -0.07 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.39 2ca4 h LEU 157 Cb 0.22 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.11 2ca4 h LEU 157 CO 0.11 0.23 0.30 1.51 0.09 0.00 0.00 178.44 180.68 2ca4 s ASP 158 N -6.21 4.22 0.20 -0.43 -4.77 -1.26 -4.67 116.67 103.74 2ca4 s ASP 158 Ca 0.03 1.80 -0.22 0.00 -3.30 0.00 0.00 52.55 50.85 2ca4 s ASP 158 Cb 0.08 -2.47 0.05 0.00 -1.09 0.00 0.00 42.92 39.50 2ca4 s ASP 158 CO 0.66 -2.21 0.62 -0.83 0.70 0.00 0.00 175.17 174.11 2ca4 s GLY 159 N -3.34 -0.42 0.37 2.12 0.00 -0.40 -4.80 107.32 100.84 2ca4 s GLY 159 Ca 0.62 0.19 -0.26 0.00 0.00 0.00 0.00 44.72 45.27 2ca4 s GLY 159 CO 0.56 0.04 1.09 2.56 0.00 0.00 0.00 173.10 177.36 2ca4 s PRO 160 N -3.81 4.26 0.29 2.90 0.04 -1.26 -1.88 135.00 135.54 2ca4 s PRO 160 Ca 0.05 1.66 -0.02 0.00 0.04 0.00 0.00 61.00 62.73 2ca4 s PRO 160 Cb -0.02 -2.74 0.42 0.00 0.04 0.00 0.00 34.50 32.20 2ca4 s PRO 160 CO -0.06 -0.09 1.91 0.28 0.04 0.00 0.00 177.00 179.07 2ca4 h VAL 161 N 2.45 1.22 -3.38 -0.36 2.07 -1.95 -3.40 116.25 112.90 2ca4 h VAL 161 Ca -0.48 -0.55 -0.66 0.00 0.82 0.00 0.00 66.70 65.82 2ca4 h VAL 161 Cb 1.22 0.26 -0.29 0.00 -1.52 0.00 0.00 31.29 30.96 2ca4 h VAL 161 CO 0.63 0.24 -0.74 -0.63 0.02 0.00 0.00 177.57 177.10 2ca4 s ILE 162 N -5.65 3.17 0.55 4.57 1.01 -1.26 -5.02 121.20 118.58 2ca4 s ILE 162 Ca -0.11 -0.62 0.30 0.00 0.00 0.00 0.00 60.65 60.23 2ca4 s ILE 162 Cb 0.17 -2.46 0.45 0.00 0.01 0.00 0.00 42.46 40.63 2ca4 s ILE 162 CO 0.80 0.40 1.89 -0.65 0.00 0.00 0.00 174.94 177.38 2ca4 h PRO 163 N 8.08 0.00 0.00 2.79 0.11 -2.02 -0.63 132.00 140.34 2ca4 h PRO 163 Ca -0.41 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.64 2ca4 h PRO 163 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2ca4 h PRO 163 CO 0.61 0.00 -0.32 0.93 -0.21 0.00 0.00 178.00 179.00 2ca4 h GLU 164 N 0.00 0.00 -6.80 1.05 5.08 -1.95 -3.44 114.58 108.52 2ca4 h GLU 164 Ca 0.35 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 58.19 2ca4 h GLU 164 Cb 1.52 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.84 2ca4 h GLU 164 CO -0.00 0.32 0.75 0.99 -1.00 0.00 0.00 179.01 180.07 2ca4 s THR 165 N -3.92 2.52 0.10 1.13 2.01 -0.24 -4.93 115.64 112.31 2ca4 s THR 165 Ca -0.01 0.46 -0.31 0.00 0.31 0.00 0.00 61.69 62.14 2ca4 s THR 165 Cb 0.13 -3.30 -0.09 0.00 0.01 0.00 0.00 72.50 69.25 2ca4 s THR 165 CO 0.68 0.09 1.65 -2.84 -0.69 0.00 0.00 174.62 173.50 2ca4 s PRO 166 N -0.88 4.20 0.49 4.92 0.02 -1.26 -4.80 135.00 137.68 2ca4 s PRO 166 Ca 0.57 2.37 -0.22 0.00 0.02 0.00 0.00 61.00 63.74 2ca4 s PRO 166 Cb -0.43 -3.46 -0.07 0.00 0.02 0.00 0.00 34.50 30.56 2ca4 s PRO 166 CO 0.48 -0.71 1.17 0.34 -0.33 0.00 0.00 177.00 177.95 2ca4 s ASP 167 N 2.05 5.99 -0.64 2.53 -1.08 -1.26 -4.86 116.67 119.40 2ca4 s ASP 167 Ca 0.73 2.30 -0.27 0.00 -0.52 0.00 0.00 52.55 54.79 2ca4 s ASP 167 Cb -0.42 -2.60 0.01 0.00 -1.46 0.00 0.00 42.92 38.46 2ca4 s ASP 167 CO 0.32 -1.04 1.47 0.12 0.52 0.00 0.00 175.17 176.57 2ca4 s PHE 168 N -1.59 2.13 -0.03 -5.34 5.36 -1.26 -4.85 117.98 112.40 2ca4 s PHE 168 Ca 0.67 0.35 0.01 0.00 -0.96 0.00 0.00 56.93 57.00 2ca4 s PHE 168 Cb -0.28 -4.41 0.02 0.00 -0.34 0.00 0.00 43.02 38.01 2ca4 s PHE 168 CO 0.33 -2.10 -0.04 0.08 -1.46 0.00 0.00 175.22 172.03 2ca4 s VAL 169 N 6.66 0.46 0.31 3.12 1.01 -1.26 -4.32 120.40 126.39 2ca4 s VAL 169 Ca 0.49 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 62.46 2ca4 s VAL 169 Cb -0.10 -0.48 -0.06 0.00 0.00 0.00 0.00 36.38 35.74 2ca4 s VAL 169 CO 0.20 0.19 -0.10 -0.54 0.00 0.00 0.00 175.10 174.85 2ca4 s LYS 170 N 0.69 1.86 0.00 2.72 -0.14 -0.75 -4.46 119.74 119.67 2ca4 s LYS 170 Ca -0.09 -1.80 0.02 0.00 -1.36 0.00 0.00 55.97 52.74 2ca4 s LYS 170 Cb -0.12 -1.81 -0.01 0.00 -1.68 0.00 0.00 37.83 34.21 2ca4 s LYS 170 CO -0.00 0.22 -0.07 0.00 -0.76 0.00 0.00 175.35 174.75 2ca4 s ALA 171 N -2.53 0.54 0.22 5.17 0.00 -1.26 -0.06 121.76 123.84 2ca4 s ALA 171 Ca 0.32 -0.35 0.10 0.00 0.00 0.00 0.00 51.96 52.03 2ca4 s ALA 171 Cb -0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2ca4 s ALA 171 CO 0.17 0.11 -0.12 -0.51 0.00 0.00 0.00 175.76 175.40 2ca4 s LEU 172 N -0.37 2.84 0.54 0.00 1.43 -0.19 -4.97 118.68 117.96 2ca4 s LEU 172 Ca 0.01 -0.75 -0.19 0.00 -1.03 0.00 0.00 54.13 52.16 2ca4 s LEU 172 Cb -0.04 -1.46 -0.06 0.00 0.03 0.00 0.00 46.19 44.67 2ca4 s LEU 172 CO -0.00 0.07 1.12 -0.94 0.23 0.00 0.00 176.35 176.83 2ca4 s SER 173 N -3.15 5.77 0.22 2.29 1.04 -1.26 -0.59 113.70 118.02 2ca4 s SER 173 Ca 0.27 2.14 -0.09 0.00 0.48 0.00 0.00 55.95 58.75 2ca4 s SER 173 Cb -0.07 -2.58 0.25 0.00 0.10 0.00 0.00 66.02 63.72 2ca4 s SER 173 CO 0.15 -1.18 1.82 -0.29 0.98 0.00 0.00 173.24 174.72 2ca4 h ILE 174 N 1.20 1.00 -0.02 -1.02 6.09 -1.39 -0.54 117.51 122.83 2ca4 h ILE 174 Ca -0.50 -0.26 -0.08 0.00 -1.37 0.00 0.00 64.86 62.65 2ca4 h ILE 174 Cb 1.26 0.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.70 2ca4 h ILE 174 CO 0.57 0.14 -0.37 0.44 -3.07 0.00 0.00 178.15 175.86 2ca4 h ASP 175 N 0.77 0.03 0.04 2.19 3.32 -1.93 -1.47 116.42 119.37 2ca4 h ASP 175 Ca 0.31 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 2ca4 h ASP 175 Cb 0.16 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2ca4 h ASP 175 CO -0.17 0.40 -0.02 -0.74 -1.72 0.00 0.00 179.24 177.00 2ca4 h HIS 176 N 0.03 -0.04 -0.24 4.55 2.76 -1.84 -3.12 115.15 117.24 2ca4 h HIS 176 Ca 0.00 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 2ca4 h HIS 176 Cb 0.68 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.64 2ca4 h HIS 176 CO 0.00 0.38 0.17 0.00 -1.30 0.00 0.00 177.93 177.18 2ca4 h ALA 177 N 0.45 2.07 -0.62 5.26 0.00 -0.65 -2.30 119.26 123.47 2ca4 h ALA 177 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ca4 h ALA 177 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2ca4 h ALA 177 CO 0.01 -0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.39 2ca4 n THR 178 N -4.49 2.21 0.76 0.00 -2.24 -0.60 -3.59 114.28 106.34 2ca4 n THR 178 Ca 0.02 -1.27 0.11 0.00 -2.27 0.00 0.00 64.05 60.64 2ca4 n THR 178 Cb 0.23 -0.05 0.47 0.00 -2.10 0.00 0.00 70.33 68.89 2ca4 n THR 178 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ca4 n ASP 179 N 0.94 0.03 0.00 3.42 5.75 -0.87 -4.75 116.55 121.07 2ca4 n ASP 179 Ca 0.27 0.50 0.00 0.00 -0.01 0.00 0.00 54.79 55.55 2ca4 n ASP 179 Cb 1.02 -0.51 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 2ca4 n ASP 179 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ca4 n GLY 180 N 0.80 3.28 0.13 6.12 0.00 -1.26 -4.85 105.19 109.41 2ca4 n GLY 180 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 2ca4 n GLY 180 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ca4 n GLU 181 N -1.85 0.70 -1.67 1.61 1.02 -1.26 -4.79 120.64 114.40 2ca4 n GLU 181 Ca 0.00 0.25 -0.48 0.00 -0.02 0.00 0.00 57.16 56.91 2ca4 n GLU 181 Cb 0.00 -1.64 -0.05 0.00 -0.02 0.00 0.00 31.44 29.74 2ca4 n GLU 181 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2ca4 n VAL 182 N -3.53 0.24 -4.45 2.62 0.31 -1.26 -4.72 118.33 107.54 2ca4 n VAL 182 Ca -0.38 -0.04 -0.22 0.00 -0.01 0.00 0.00 64.34 63.69 2ca4 n VAL 182 Cb 0.99 -1.59 -0.14 0.00 -0.91 0.00 0.00 33.84 32.20 2ca4 n VAL 182 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2ca4 s MET 183 N 2.23 1.09 -0.74 5.55 0.00 -0.59 -0.88 119.30 125.96 2ca4 s MET 183 Ca 0.86 -0.82 -0.18 0.00 0.00 0.00 0.00 55.69 55.55 2ca4 s MET 183 Cb -0.73 -1.14 0.13 0.00 0.00 0.00 0.00 34.83 33.10 2ca4 s MET 183 CO 0.45 0.28 0.87 -0.51 0.00 0.00 0.00 175.02 176.11 2ca4 s LEU 184 N -1.15 5.47 -0.21 4.11 1.43 0.50 -0.90 118.68 127.93 2ca4 s LEU 184 Ca 0.04 -1.82 -0.20 0.00 -1.03 0.00 0.00 54.13 51.12 2ca4 s LEU 184 Cb -0.08 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 2ca4 s LEU 184 CO 0.01 -1.02 0.57 0.00 0.23 0.00 0.00 176.35 176.14 2ca4 s ALA 185 N 2.32 3.55 -1.68 4.21 0.00 0.12 -1.51 121.76 128.77 2ca4 s ALA 185 Ca 0.20 -0.37 0.14 0.00 0.00 0.00 0.00 51.96 51.93 2ca4 s ALA 185 Cb -0.15 -2.90 0.09 0.00 0.00 0.00 0.00 23.12 20.16 2ca4 s ALA 185 CO -0.01 -0.55 0.92 2.48 0.00 0.00 0.00 175.76 178.60 2ca4 n TYR 186 N 5.04 0.00 -4.03 0.00 0.18 -0.56 -1.53 117.16 116.25 2ca4 n TYR 186 Ca -0.03 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.61 2ca4 n TYR 186 Cb 0.50 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.32 2ca4 n TYR 186 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2ca4 s SER 187 N -1.27 0.37 -0.08 9.48 0.15 -0.67 -3.68 113.70 118.01 2ca4 s SER 187 Ca 0.16 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2ca4 s SER 187 Cb 0.12 -0.06 0.02 0.00 -1.71 0.00 0.00 66.02 64.39 2ca4 s SER 187 CO 0.21 0.03 -0.06 -0.32 1.20 0.00 0.00 173.24 174.30 2ca4 s MET 188 N 0.01 1.15 -1.63 5.44 1.75 0.27 -1.47 119.30 124.82 2ca4 s MET 188 Ca 0.00 -0.15 -0.13 0.00 -1.25 0.00 0.00 55.69 54.16 2ca4 s MET 188 Cb -0.02 -1.21 0.11 0.00 2.84 0.00 0.00 34.83 36.55 2ca4 s MET 188 CO -0.00 -0.18 0.63 0.09 -0.65 0.00 0.00 175.02 174.91 2ca4 n ASN 189 N 4.56 -2.19 -0.14 1.11 3.02 0.38 -1.68 115.26 120.32 2ca4 n ASN 189 Ca -0.16 -1.04 -0.02 0.00 -0.03 0.00 0.00 54.58 53.33 2ca4 n ASN 189 Cb 0.51 -2.70 -0.01 0.00 -0.61 0.00 0.00 39.78 36.97 2ca4 n ASN 189 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ca4 n GLY 190 N -1.62 0.48 3.44 7.41 0.00 -1.26 -5.01 105.19 108.64 2ca4 n GLY 190 Ca -0.05 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 2ca4 n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ca4 s ALA 191 N -1.81 2.37 0.71 4.61 0.00 -0.67 -5.13 121.76 121.83 2ca4 s ALA 191 Ca 0.00 -1.98 -0.16 0.00 0.00 0.00 0.00 51.96 49.82 2ca4 s ALA 191 Cb 0.00 0.37 0.02 0.00 0.00 0.00 0.00 23.12 23.51 2ca4 s ALA 191 CO 0.00 -0.17 1.26 -0.51 0.00 0.00 0.00 175.76 176.34 2ca4 s ASP 192 N -3.47 4.24 0.19 0.00 1.01 -1.26 -0.56 116.67 116.82 2ca4 s ASP 192 Ca 0.32 2.52 -0.33 0.00 0.71 0.00 0.00 52.55 55.77 2ca4 s ASP 192 Cb 0.06 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 41.25 2ca4 s ASP 192 CO 0.13 -2.24 1.58 0.18 0.21 0.00 0.00 175.17 175.03 2ca4 n LEU 193 N -2.43 3.36 -4.59 1.23 4.77 -1.24 -4.56 117.00 113.54 2ca4 n LEU 193 Ca 0.15 1.09 -0.39 0.00 -0.03 0.00 0.00 56.01 56.83 2ca4 n LEU 193 Cb 0.49 -1.47 0.03 0.00 -2.33 0.00 0.00 43.42 40.14 2ca4 n LEU 193 CO 0.47 -0.19 0.49 -2.65 -1.33 0.00 0.00 177.39 174.18 2ca4 n PRO 194 N 3.25 1.05 -0.21 3.23 -0.02 -1.26 -4.19 135.00 136.85 2ca4 n PRO 194 Ca 0.15 0.39 -0.08 0.00 -2.02 0.00 0.00 63.50 61.94 2ca4 n PRO 194 Cb 0.31 -2.04 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 2ca4 n PRO 194 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2ca4 h TRP 195 N 0.93 -1.28 0.00 6.00 2.91 -1.93 -1.36 115.95 121.22 2ca4 h TRP 195 Ca -0.46 0.08 0.00 0.00 1.13 0.00 0.00 58.89 59.64 2ca4 h TRP 195 Cb 1.36 0.64 0.00 0.00 -0.51 0.00 0.00 29.16 30.65 2ca4 h TRP 195 CO 0.39 -0.42 0.00 1.28 -1.03 0.00 0.00 178.44 178.66 2ca4 n LEU 196 N -5.41 0.00 -1.56 0.65 4.77 -1.26 -1.16 117.00 113.04 2ca4 n LEU 196 Ca 0.02 0.32 0.08 0.00 -0.03 0.00 0.00 56.01 56.40 2ca4 n LEU 196 Cb 0.35 -0.32 0.36 0.00 -2.33 0.00 0.00 43.42 41.47 2ca4 n LEU 196 CO -0.01 -0.09 0.82 0.59 -1.33 0.00 0.00 177.39 177.37 2ca4 n ASN 197 N -1.32 5.06 0.00 -1.43 4.13 -0.53 -4.74 115.26 116.43 2ca4 n ASN 197 Ca 0.10 -2.86 0.00 0.00 1.68 0.00 0.00 54.58 53.50 2ca4 n ASN 197 Cb 0.19 -0.62 0.00 0.00 -1.54 0.00 0.00 39.78 37.81 2ca4 n ASN 197 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ca4 n GLY 198 N 0.41 1.02 2.16 7.41 0.00 -0.31 -4.77 105.19 111.11 2ca4 n GLY 198 Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 2ca4 n GLY 198 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ca4 n TYR 199 N -1.94 0.35 1.17 1.61 9.36 -1.13 -1.97 117.16 124.61 2ca4 n TYR 199 Ca 0.00 0.65 0.12 0.00 3.32 0.00 0.00 57.90 62.00 2ca4 n TYR 199 Cb 0.00 -1.29 0.23 0.00 -0.63 0.00 0.00 39.34 37.65 2ca4 n TYR 199 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2ca4 n PRO 200 N 0.91 1.52 -3.69 2.98 -0.04 -1.26 -4.50 135.00 130.92 2ca4 n PRO 200 Ca 0.12 -1.12 -0.12 0.00 -0.04 0.00 0.00 63.50 62.35 2ca4 n PRO 200 Cb 0.06 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 31.95 2ca4 n PRO 200 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2ca4 s LEU 201 N -2.25 -0.14 0.04 1.53 2.96 -0.91 -4.49 118.68 115.42 2ca4 s LEU 201 Ca 0.27 1.07 -0.03 0.00 -0.22 0.00 0.00 54.13 55.22 2ca4 s LEU 201 Cb 0.20 1.75 -0.02 0.00 0.50 0.00 0.00 46.19 48.61 2ca4 s LEU 201 CO 0.44 -0.19 0.02 0.00 -1.32 0.00 0.00 176.35 175.30 2ca4 s ARG 202 N 0.74 0.52 0.11 1.98 1.70 -0.58 -1.07 118.95 122.36 2ca4 s ARG 202 Ca -0.04 -0.87 -0.30 0.00 -0.47 0.00 0.00 55.73 54.05 2ca4 s ARG 202 Cb -0.05 0.19 -0.06 0.00 -0.57 0.00 0.00 34.95 34.46 2ca4 s ARG 202 CO -0.05 -0.11 1.06 -1.17 -1.08 0.00 0.00 175.30 173.95 2ca4 s LEU 203 N -2.22 4.45 -0.16 -1.89 2.96 0.20 0.14 118.68 122.17 2ca4 s LEU 203 Ca -0.04 1.94 0.01 0.00 -0.22 0.00 0.00 54.13 55.82 2ca4 s LEU 203 Cb -0.00 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 43.10 2ca4 s LEU 203 CO -0.05 -0.23 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.87 2ca4 s VAL 204 N 0.22 2.33 -0.61 1.68 1.01 -0.08 -3.70 120.40 121.26 2ca4 s VAL 204 Ca 0.51 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2ca4 s VAL 204 Cb -0.27 -1.97 0.16 0.00 0.00 0.00 0.00 36.38 34.30 2ca4 s VAL 204 CO 0.32 0.53 0.40 -0.69 0.00 0.00 0.00 175.10 175.66 2ca4 s VAL 205 N 0.96 2.40 0.22 2.92 1.01 -1.26 -1.54 120.40 125.12 2ca4 s VAL 205 Ca -0.03 -3.73 -0.32 0.00 0.00 0.00 0.00 61.98 57.90 2ca4 s VAL 205 Cb -0.15 -2.61 -0.13 0.00 0.00 0.00 0.00 36.38 33.49 2ca4 s VAL 205 CO -0.04 -0.98 1.50 -2.65 0.00 0.00 0.00 175.10 172.93 2ca4 n PRO 206 N 2.46 2.20 -0.48 2.72 -0.02 -1.26 -1.45 135.00 139.16 2ca4 n PRO 206 Ca 0.17 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2ca4 n PRO 206 Cb 0.36 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 2ca4 n PRO 206 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ca4 n GLY 207 N 2.62 1.63 3.71 -1.23 0.00 -1.26 -4.96 105.19 105.69 2ca4 n GLY 207 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2ca4 n GLY 207 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ca4 s TYR 208 N -3.34 3.09 0.64 1.61 1.51 -0.53 -0.75 117.35 119.58 2ca4 s TYR 208 Ca 0.00 0.06 -0.18 0.00 -1.01 0.00 0.00 57.07 55.94 2ca4 s TYR 208 Cb 0.00 -1.63 -0.02 0.00 -0.11 0.00 0.00 41.96 40.20 2ca4 s TYR 208 CO 0.00 0.49 1.19 0.66 -1.11 0.00 0.00 175.55 176.78 2ca4 n TYR 209 N 0.96 1.59 0.15 2.71 4.01 -0.75 -4.70 117.16 121.13 2ca4 n TYR 209 Ca -0.12 0.42 0.18 0.00 -0.16 0.00 0.00 57.90 58.22 2ca4 n TYR 209 Cb 0.52 -2.23 0.78 0.00 -0.31 0.00 0.00 39.34 38.11 2ca4 n TYR 209 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2ca4 h GLY 210 N 0.51 0.00 0.04 2.72 0.00 -0.95 -2.89 103.07 102.50 2ca4 h GLY 210 Ca -0.50 0.00 0.25 0.00 0.00 0.00 0.00 47.33 47.08 2ca4 h GLY 210 CO 0.52 0.00 0.66 0.00 0.00 0.00 0.00 176.54 177.73 2ca4 h THR 211 N 0.00 0.57 0.00 4.70 1.03 -1.89 0.11 112.91 117.42 2ca4 h THR 211 Ca 0.13 -0.10 0.00 0.00 -0.01 0.00 0.00 66.41 66.43 2ca4 h THR 211 Cb 0.69 0.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.02 2ca4 h THR 211 CO -0.00 0.05 0.00 1.88 -0.01 0.00 0.00 175.52 177.44 2ca4 h TYR 212 N 0.29 0.00 -0.64 0.00 0.05 -1.86 -3.40 116.97 111.41 2ca4 h TYR 212 Ca 0.52 0.00 -0.72 0.00 0.05 0.00 0.00 58.73 58.58 2ca4 h TYR 212 Cb 1.51 0.00 -0.09 0.00 1.01 0.00 0.00 36.73 39.17 2ca4 h TYR 212 CO -0.00 0.00 2.60 0.91 -1.05 0.00 0.00 178.16 180.62 2ca4 n TRP 213 N -2.75 3.52 -1.93 4.88 7.02 0.38 -4.84 117.44 123.71 2ca4 n TRP 213 Ca 0.03 -2.92 -0.42 0.00 -1.02 0.00 0.00 57.50 53.16 2ca4 n TRP 213 Cb 0.39 -2.35 -0.03 0.00 -2.42 0.00 0.00 31.31 26.90 2ca4 n TRP 213 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 2ca4 s VAL 214 N 2.30 2.92 0.32 -0.99 1.01 -1.24 -4.59 120.40 120.13 2ca4 s VAL 214 Ca 0.45 0.48 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 2ca4 s VAL 214 Cb 0.11 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2ca4 s VAL 214 CO -0.04 0.01 0.59 -0.54 0.00 0.00 0.00 175.10 175.12 2ca4 s LYS 215 N 2.17 3.62 -1.46 2.72 1.02 -1.26 -0.63 119.74 125.92 2ca4 s LYS 215 Ca 0.73 0.03 -0.08 0.00 0.02 0.00 0.00 55.97 56.66 2ca4 s LYS 215 Cb -0.41 -2.60 0.04 0.00 -0.52 0.00 0.00 37.83 34.34 2ca4 s LYS 215 CO 0.32 0.15 0.72 0.72 -0.92 0.00 0.00 175.35 176.34 2ca4 n HIS 216 N -1.17 -2.11 -1.91 3.18 8.25 -0.47 -4.35 115.22 116.63 2ca4 n HIS 216 Ca -0.01 0.64 -0.43 0.00 -0.26 0.00 0.00 57.72 57.66 2ca4 n HIS 216 Cb 0.54 -4.07 -0.03 0.00 1.12 0.00 0.00 29.99 27.55 2ca4 n HIS 216 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2ca4 s LEU 217 N -6.83 4.05 0.00 2.41 2.96 -0.23 -1.47 118.68 119.57 2ca4 s LEU 217 Ca 0.43 2.05 0.00 0.00 -0.22 0.00 0.00 54.13 56.39 2ca4 s LEU 217 Cb -0.21 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 42.95 2ca4 s LEU 217 CO 0.54 -1.24 0.12 -0.46 -1.32 0.00 0.00 176.35 173.99 2ca4 n ASN 218 N 8.41 0.24 -3.58 3.68 6.94 -0.63 -4.77 115.26 125.54 2ca4 n ASN 218 Ca 0.20 -0.58 -0.19 0.00 -0.02 0.00 0.00 54.58 53.98 2ca4 n ASN 218 Cb 0.44 0.32 -0.15 0.00 -2.36 0.00 0.00 39.78 38.02 2ca4 n ASN 218 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2ca4 s GLU 219 N -0.32 0.10 -0.18 -3.83 2.12 -1.01 -0.44 118.70 115.15 2ca4 s GLU 219 Ca 0.00 0.28 0.00 0.00 0.36 0.00 0.00 54.97 55.61 2ca4 s GLU 219 Cb 0.00 -0.98 0.01 0.00 0.26 0.00 0.00 34.13 33.42 2ca4 s GLU 219 CO 0.00 -0.53 -0.17 0.42 -0.54 0.00 0.00 175.26 174.44 2ca4 s ILE 220 N 2.27 2.36 -0.17 -3.70 1.01 0.57 -1.16 121.20 122.37 2ca4 s ILE 220 Ca 0.04 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 59.85 2ca4 s ILE 220 Cb -0.14 -2.00 0.03 0.00 0.01 0.00 0.00 42.46 40.35 2ca4 s ILE 220 CO -0.09 0.52 -0.15 -0.89 0.00 0.00 0.00 174.94 174.33 2ca4 s THR 221 N 1.18 1.77 -0.18 2.92 2.01 -0.66 -0.58 115.64 122.10 2ca4 s THR 221 Ca 0.02 -0.85 -0.25 0.00 0.31 0.00 0.00 61.69 60.92 2ca4 s THR 221 Cb -0.14 -1.68 -0.01 0.00 0.01 0.00 0.00 72.50 70.67 2ca4 s THR 221 CO -0.08 0.40 0.82 -0.69 -0.69 0.00 0.00 174.62 174.38 2ca4 s VAL 222 N 1.39 4.89 0.18 3.82 1.01 -0.02 -0.63 120.40 131.03 2ca4 s VAL 222 Ca 0.03 1.59 0.08 0.00 0.00 0.00 0.00 61.98 63.68 2ca4 s VAL 222 Cb -0.14 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 2ca4 s VAL 222 CO -0.11 0.02 -0.17 0.27 0.00 0.00 0.00 175.10 175.11 2ca4 s ILE 223 N 2.22 1.80 -0.28 2.22 -4.36 -0.34 0.26 121.20 122.72 2ca4 s ILE 223 Ca 0.37 -2.02 0.11 0.00 -0.26 0.00 0.00 60.65 58.86 2ca4 s ILE 223 Cb -0.16 -1.91 0.57 0.00 1.25 0.00 0.00 42.46 42.21 2ca4 s ILE 223 CO 0.12 -0.41 1.55 -0.90 0.24 0.00 0.00 174.94 175.54 2ca4 n ASP 224 N 0.06 3.44 -3.50 4.36 5.68 -1.26 -0.75 116.55 124.58 2ca4 n ASP 224 Ca -0.11 -3.43 -0.18 0.00 -0.50 0.00 0.00 54.79 50.57 2ca4 n ASP 224 Cb 0.58 -0.65 -0.08 0.00 -1.14 0.00 0.00 41.12 39.83 2ca4 n ASP 224 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 2ca4 s LYS 225 N -3.08 1.67 0.09 0.11 -2.85 -1.26 -4.67 119.74 109.76 2ca4 s LYS 225 Ca 0.47 -1.96 -0.30 0.00 -1.00 0.00 0.00 55.97 53.18 2ca4 s LYS 225 Cb 0.40 0.30 -0.05 0.00 -2.06 0.00 0.00 37.83 36.42 2ca4 s LYS 225 CO 0.06 -0.61 0.96 -2.00 0.10 0.00 0.00 175.35 173.86 2ca4 s GLU 226 N -3.56 4.68 -0.08 1.78 2.12 -1.26 -4.22 118.70 118.15 2ca4 s GLU 226 Ca 0.40 1.44 -0.30 0.00 0.36 0.00 0.00 54.97 56.88 2ca4 s GLU 226 Cb 0.03 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 31.01 2ca4 s GLU 226 CO 0.25 0.18 1.05 0.12 -0.54 0.00 0.00 175.26 176.32 2ca4 s PHE 227 N 0.14 3.47 -0.28 5.30 5.36 -1.26 -4.94 117.98 125.77 2ca4 s PHE 227 Ca 0.47 1.53 0.10 0.00 -0.96 0.00 0.00 56.93 58.07 2ca4 s PHE 227 Cb -0.23 -3.23 0.50 0.00 -0.34 0.00 0.00 43.02 39.72 2ca4 s PHE 227 CO 0.29 -0.43 1.44 -0.40 -1.46 0.00 0.00 175.22 174.67 2ca4 n ASP 228 N 4.87 2.54 -4.73 6.13 5.68 -1.26 -4.72 116.55 125.05 2ca4 n ASP 228 Ca 0.09 -3.71 -0.37 0.00 -0.50 0.00 0.00 54.79 50.29 2ca4 n ASP 228 Cb 0.48 -0.62 0.07 0.00 -1.14 0.00 0.00 41.12 39.91 2ca4 n ASP 228 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ca4 n GLY 229 N -1.08 0.56 0.33 6.12 0.00 -1.26 -4.68 105.19 105.17 2ca4 n GLY 229 Ca 0.31 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2ca4 n GLY 229 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ca4 h PHE 230 N 0.52 0.88 0.00 1.61 3.57 -1.92 0.20 116.94 121.79 2ca4 h PHE 230 Ca -0.51 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.03 2ca4 h PHE 230 Cb 1.34 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.83 2ca4 h PHE 230 CO 0.41 0.14 0.00 0.91 -2.23 0.00 0.00 178.31 177.54 2ca4 n TRP 231 N -4.87 0.00 -0.10 0.41 7.02 -1.26 -1.49 117.44 117.15 2ca4 n TRP 231 Ca 0.21 0.00 -0.16 0.00 -1.02 0.00 0.00 57.50 56.53 2ca4 n TRP 231 Cb 0.56 -0.35 -0.09 0.00 -2.42 0.00 0.00 31.31 29.01 2ca4 n TRP 231 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2ca4 n MET 232 N -1.35 0.50 0.03 -0.99 2.81 -0.87 -4.50 117.12 112.74 2ca4 n MET 232 Ca 0.10 0.14 -0.11 0.00 -1.81 0.00 0.00 57.70 56.02 2ca4 n MET 232 Cb 0.22 -1.37 -0.13 0.00 -0.71 0.00 0.00 33.22 31.22 2ca4 n MET 232 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2ca4 h LYS 233 N -0.19 0.08 0.00 0.03 3.64 -0.90 -3.43 116.57 115.80 2ca4 h LYS 233 Ca -0.48 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 58.73 2ca4 h LYS 233 Cb 1.65 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.51 2ca4 h LYS 233 CO -0.13 0.86 -1.15 2.41 -2.27 0.00 0.00 179.45 179.16 2ca4 n THR 234 N -3.27 0.15 -2.01 1.00 -1.04 -0.55 -5.00 114.28 103.55 2ca4 n THR 234 Ca -0.11 -0.04 -0.30 0.00 -2.04 0.00 0.00 64.05 61.56 2ca4 n THR 234 Cb 1.01 -1.44 0.02 0.00 -1.82 0.00 0.00 70.33 68.10 2ca4 n THR 234 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ca4 s ALA 235 N -2.05 3.10 -1.63 2.41 0.00 -0.62 -4.42 121.76 118.56 2ca4 s ALA 235 Ca -0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 2ca4 s ALA 235 Cb 0.01 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.17 2ca4 s ALA 235 CO 0.05 -0.77 0.47 0.66 0.00 0.00 0.00 175.76 176.17 2ca4 n TYR 236 N -2.74 -1.74 -3.76 0.00 4.02 -1.26 -4.39 117.16 107.28 2ca4 n TYR 236 Ca 0.05 0.40 -0.37 0.00 -0.01 0.00 0.00 57.90 57.97 2ca4 n TYR 236 Cb 0.55 -4.41 -0.06 0.00 -0.02 0.00 0.00 39.34 35.41 2ca4 n TYR 236 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2ca4 s ARG 237 N -5.55 3.59 0.24 -0.72 0.52 -1.26 -0.79 118.95 114.98 2ca4 s ARG 237 Ca 0.23 0.02 0.10 0.00 -0.52 0.00 0.00 55.73 55.56 2ca4 s ARG 237 Cb -0.10 -3.18 -0.04 0.00 0.52 0.00 0.00 34.95 32.15 2ca4 s ARG 237 CO 0.29 0.73 -0.07 0.96 0.02 0.00 0.00 175.30 177.23 2ca4 s ILE 238 N -1.09 3.19 0.23 1.52 -4.36 -0.00 -4.83 121.20 115.86 2ca4 s ILE 238 Ca 0.20 -1.91 -0.31 0.00 -0.26 0.00 0.00 60.65 58.36 2ca4 s ILE 238 Cb -0.13 -2.66 -0.13 0.00 1.25 0.00 0.00 42.46 40.79 2ca4 s ILE 238 CO 0.09 -0.29 1.45 -2.65 0.24 0.00 0.00 174.94 173.78 2ca4 n PRO 239 N -0.52 2.12 -2.29 0.37 -0.02 -1.26 -1.19 135.00 132.21 2ca4 n PRO 239 Ca -0.08 0.76 -0.43 0.00 -2.02 0.00 0.00 63.50 61.73 2ca4 n PRO 239 Cb 0.58 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2ca4 n PRO 239 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2ca4 n ASP 240 N 2.34 4.62 -3.68 2.55 2.03 -0.02 -4.39 116.55 120.00 2ca4 n ASP 240 Ca 0.12 -2.93 -0.05 0.00 0.52 0.00 0.00 54.79 52.45 2ca4 n ASP 240 Cb 0.32 -1.66 -0.01 0.00 -0.72 0.00 0.00 41.12 39.05 2ca4 n ASP 240 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2ca4 s ASN 241 N 3.20 -0.17 0.41 1.67 2.20 -1.26 -4.93 114.94 116.05 2ca4 s ASN 241 Ca 0.48 -0.56 0.17 0.00 -0.94 0.00 0.00 52.86 52.01 2ca4 s ASN 241 Cb 0.07 0.60 0.88 0.00 -2.00 0.00 0.00 41.25 40.81 2ca4 s ASN 241 CO -0.00 -1.12 1.87 0.00 -2.94 0.00 0.00 177.10 174.91 2ca4 h ALA 242 N 2.00 1.32 -0.03 3.54 0.00 -1.96 -2.32 119.26 121.81 2ca4 h ALA 242 Ca -0.23 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ca4 h ALA 242 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2ca4 h ALA 242 CO 0.27 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.90 2ca4 n ALA 244 N 0.87 -2.12 -2.94 0.00 0.00 -0.87 -4.93 120.51 110.52 2ca4 n ALA 244 Ca 0.16 -0.41 -0.10 0.00 0.00 0.00 0.00 53.44 53.09 2ca4 n ALA 244 Cb 0.50 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.59 2ca4 n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ca4 s THR 246 N -3.83 0.07 0.21 0.00 -4.23 -0.15 -4.90 115.64 102.80 2ca4 s THR 246 Ca 0.05 -1.98 -0.31 0.00 -1.18 0.00 0.00 61.69 58.27 2ca4 s THR 246 Cb 0.02 -2.38 -0.11 0.00 1.34 0.00 0.00 72.50 71.37 2ca4 s THR 246 CO -0.10 -0.13 1.63 -0.70 -0.54 0.00 0.00 174.62 174.78 2ca4 s GLU 247 N -4.12 4.17 -0.45 3.99 2.12 -1.26 -4.19 118.70 118.95 2ca4 s GLU 247 Ca 0.35 2.50 -0.44 0.00 0.36 0.00 0.00 54.97 57.73 2ca4 s GLU 247 Cb 0.07 -3.10 -0.19 0.00 0.26 0.00 0.00 34.13 31.17 2ca4 s GLU 247 CO 0.09 -0.66 1.50 -2.30 -0.54 0.00 0.00 175.26 173.34 2ca4 n PRO 248 N 3.65 0.00 -0.00 4.30 -0.02 -1.26 -0.20 135.00 141.47 2ca4 n PRO 248 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2ca4 n PRO 248 Cb 0.37 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 2ca4 n PRO 248 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ca4 n GLY 249 N 3.66 0.83 3.68 -1.23 0.00 -1.26 -5.05 105.19 105.82 2ca4 n GLY 249 Ca 0.29 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.96 2ca4 n GLY 249 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ca4 s LYS 250 N -0.72 3.65 0.42 1.61 1.02 0.72 -5.10 119.74 121.34 2ca4 s LYS 250 Ca 0.00 -0.33 -0.24 0.00 0.02 0.00 0.00 55.97 55.42 2ca4 s LYS 250 Cb 0.00 -3.10 -0.08 0.00 -0.52 0.00 0.00 37.83 34.13 2ca4 s LYS 250 CO 0.00 0.46 1.10 0.00 -0.92 0.00 0.00 175.35 175.99 2ca4 s ALA 251 N -0.15 3.05 0.62 5.17 0.00 -1.26 -4.62 121.76 124.57 2ca4 s ALA 251 Ca 0.07 0.81 -0.15 0.00 0.00 0.00 0.00 51.96 52.69 2ca4 s ALA 251 Cb -0.12 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2ca4 s ALA 251 CO 0.01 -0.39 1.06 -1.25 0.00 0.00 0.00 175.76 175.19 2ca4 s PRO 252 N -2.55 3.20 0.05 0.00 0.04 -1.26 -4.98 135.00 129.51 2ca4 s PRO 252 Ca 0.60 1.16 0.01 0.00 0.04 0.00 0.00 61.00 62.81 2ca4 s PRO 252 Cb -0.25 -2.02 -0.25 0.00 0.04 0.00 0.00 34.50 32.02 2ca4 s PRO 252 CO 0.31 -0.90 1.05 1.79 0.04 0.00 0.00 177.00 179.28 2ca4 h THR 253 N 0.16 1.39 -4.00 1.26 1.35 -1.99 -3.46 112.91 107.62 2ca4 h THR 253 Ca -0.46 -3.06 -0.38 0.00 -0.55 0.00 0.00 66.41 61.96 2ca4 h THR 253 Cb 1.22 2.80 -0.25 0.00 -1.73 0.00 0.00 68.15 70.19 2ca4 h THR 253 CO 0.57 0.85 -0.77 0.00 -0.25 0.00 0.00 175.52 175.92 2ca4 s ALA 254 N -2.65 0.83 0.20 6.62 0.00 -1.26 -5.09 121.76 120.41 2ca4 s ALA 254 Ca -0.04 -0.62 0.04 0.00 0.00 0.00 0.00 51.96 51.34 2ca4 s ALA 254 Cb 0.08 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 2ca4 s ALA 254 CO 0.85 0.14 -0.04 0.95 0.00 0.00 0.00 175.76 177.66 2ca4 s THR 255 N -0.71 1.10 0.05 0.00 -4.23 -1.26 -0.84 115.64 109.76 2ca4 s THR 255 Ca -0.00 -2.05 -0.01 0.00 -1.18 0.00 0.00 61.69 58.45 2ca4 s THR 255 Cb -0.06 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.57 2ca4 s THR 255 CO 0.00 -0.48 -0.03 0.27 -0.54 0.00 0.00 174.62 173.84 2ca4 s ILE 256 N -3.37 0.27 0.40 2.99 -4.36 -0.33 -4.72 121.20 112.09 2ca4 s ILE 256 Ca 0.24 -1.78 -0.26 0.00 -0.26 0.00 0.00 60.65 58.59 2ca4 s ILE 256 Cb 0.04 -1.48 -0.10 0.00 1.25 0.00 0.00 42.46 42.17 2ca4 s ILE 256 CO 0.06 -0.96 1.37 -2.65 0.24 0.00 0.00 174.94 173.00 2ca4 n PRO 257 N 0.17 2.24 -1.56 0.37 -0.02 -1.26 -0.82 135.00 134.11 2ca4 n PRO 257 Ca -0.14 0.79 -0.39 0.00 -2.02 0.00 0.00 63.50 61.74 2ca4 n PRO 257 Cb 0.61 -2.51 0.04 0.00 -0.02 0.00 0.00 33.50 31.62 2ca4 n PRO 257 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 2ca4 n ILE 258 N 0.05 2.89 0.00 4.25 3.06 0.03 -4.71 119.36 124.93 2ca4 n ILE 258 Ca 0.05 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.80 2ca4 n ILE 258 Cb 0.39 -0.96 0.00 0.00 0.54 0.00 0.00 39.64 39.61 2ca4 n ILE 258 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 2ca4 n ASN 259 N -0.01 0.00 -4.81 9.51 6.94 -1.26 -4.95 115.26 120.68 2ca4 n ASN 259 Ca 0.12 0.00 -0.37 0.00 -0.02 0.00 0.00 54.58 54.31 2ca4 n ASN 259 Cb 0.45 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.81 2ca4 n ASN 259 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2ca4 s ARG 260 N 1.44 4.26 0.43 -3.83 3.52 -1.26 -1.81 118.95 121.69 2ca4 s ARG 260 Ca 0.00 0.85 -0.24 0.00 -0.13 0.00 0.00 55.73 56.22 2ca4 s ARG 260 Cb 0.00 -2.97 -0.11 0.00 -1.56 0.00 0.00 34.95 30.32 2ca4 s ARG 260 CO 0.00 0.45 0.91 1.19 -0.81 0.00 0.00 175.30 177.04 2ca4 n PHE 261 N 0.93 0.82 -2.48 5.12 3.72 0.07 -4.87 117.46 120.77 2ca4 n PHE 261 Ca -0.04 0.57 -0.25 0.00 -0.05 0.00 0.00 57.45 57.68 2ca4 n PHE 261 Cb 0.51 -2.18 0.04 0.00 -0.94 0.00 0.00 39.48 36.91 2ca4 n PHE 261 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2ca4 s ASP 262 N -0.81 5.39 0.07 4.37 1.47 -1.26 -3.60 116.67 122.30 2ca4 s ASP 262 Ca 0.64 0.46 -0.31 0.00 1.18 0.00 0.00 52.55 54.52 2ca4 s ASP 262 Cb -0.56 -1.39 -0.08 0.00 -0.34 0.00 0.00 42.92 40.55 2ca4 s ASP 262 CO 0.56 -1.15 1.53 -0.69 0.68 0.00 0.00 175.17 176.11 2ca4 s VAL 263 N -2.94 3.22 0.17 2.11 1.01 -1.26 -4.58 120.40 118.12 2ca4 s VAL 263 Ca 0.55 0.72 0.06 0.00 0.00 0.00 0.00 61.98 63.31 2ca4 s VAL 263 Cb -0.10 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2ca4 s VAL 263 CO 0.43 0.01 -0.12 -0.13 0.00 0.00 0.00 175.10 175.29 2ca4 s ARG 264 N 2.15 1.16 0.02 2.72 0.52 -0.18 -4.61 118.95 120.72 2ca4 s ARG 264 Ca 0.69 -1.48 -0.21 0.00 -0.52 0.00 0.00 55.73 54.22 2ca4 s ARG 264 Cb -0.37 -0.86 0.04 0.00 0.52 0.00 0.00 34.95 34.27 2ca4 s ARG 264 CO 0.30 0.13 0.46 -1.54 0.02 0.00 0.00 175.30 174.68 2ca4 s SER 265 N -3.13 -0.37 0.03 0.23 1.04 -1.26 -1.47 113.70 108.77 2ca4 s SER 265 Ca 0.18 0.19 -0.02 0.00 0.48 0.00 0.00 55.95 56.78 2ca4 s SER 265 Cb 0.00 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 2ca4 s SER 265 CO 0.03 -0.62 0.00 -0.36 0.98 0.00 0.00 173.24 173.28 2ca4 s PHE 266 N -1.99 0.31 -0.24 5.02 0.08 0.07 -4.66 117.98 116.57 2ca4 s PHE 266 Ca -0.08 -0.66 -0.15 0.00 0.12 0.00 0.00 56.93 56.16 2ca4 s PHE 266 Cb -0.02 -0.23 -0.04 0.00 -0.57 0.00 0.00 43.02 42.16 2ca4 s PHE 266 CO 0.01 -0.28 0.36 0.42 -0.10 0.00 0.00 175.22 175.63 2ca4 s ILE 267 N -2.39 5.20 -0.09 0.64 1.01 -1.26 -1.68 121.20 122.63 2ca4 s ILE 267 Ca -0.07 0.57 0.18 0.00 0.00 0.00 0.00 60.65 61.32 2ca4 s ILE 267 Cb -0.03 -3.68 -0.26 0.00 0.01 0.00 0.00 42.46 38.50 2ca4 s ILE 267 CO -0.04 0.21 0.26 0.35 0.00 0.00 0.00 174.94 175.71 2ca4 n THR 268 N 4.77 0.54 0.83 2.92 -2.24 -0.49 -4.58 114.28 116.04 2ca4 n THR 268 Ca -0.09 -0.57 0.13 0.00 -2.27 0.00 0.00 64.05 61.24 2ca4 n THR 268 Cb 0.51 -0.20 0.34 0.00 -2.10 0.00 0.00 70.33 68.87 2ca4 n THR 268 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2ca4 n ASN 269 N -2.38 0.47 -4.19 3.42 6.94 -1.20 -4.53 115.26 113.78 2ca4 n ASN 269 Ca -0.15 0.14 -0.18 0.00 -0.02 0.00 0.00 54.58 54.37 2ca4 n ASN 269 Cb 0.75 -0.09 -0.12 0.00 -2.36 0.00 0.00 39.78 37.97 2ca4 n ASN 269 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2ca4 s VAL 270 N -3.06 1.19 0.38 3.53 -7.23 -1.26 -5.05 120.40 108.90 2ca4 s VAL 270 Ca 0.10 -1.42 0.04 0.00 -1.81 0.00 0.00 61.98 58.89 2ca4 s VAL 270 Cb 0.16 -1.21 -0.04 0.00 0.56 0.00 0.00 36.38 35.85 2ca4 s VAL 270 CO 0.65 -0.27 0.09 -1.61 -0.31 0.00 0.00 175.10 173.65 2ca4 s GLU 271 N -1.98 1.84 0.13 4.82 2.02 -1.26 -4.91 118.70 119.36 2ca4 s GLU 271 Ca 0.01 -2.09 -0.35 0.00 0.02 0.00 0.00 54.97 52.56 2ca4 s GLU 271 Cb -0.09 -0.82 -0.15 0.00 0.10 0.00 0.00 34.13 33.17 2ca4 s GLU 271 CO 0.02 -0.34 1.46 -1.71 0.02 0.00 0.00 175.26 174.72 2ca4 n ASN 272 N -1.04 2.45 0.00 -0.19 2.85 -1.26 -1.57 115.26 116.49 2ca4 n ASN 272 Ca -0.06 1.10 0.00 0.00 -0.11 0.00 0.00 54.58 55.51 2ca4 n ASN 272 Cb 0.66 -1.33 0.00 0.00 1.24 0.00 0.00 39.78 40.35 2ca4 n ASN 272 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2ca4 n GLY 273 N 2.97 0.46 3.70 8.20 0.00 0.16 -5.00 105.19 115.68 2ca4 n GLY 273 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2ca4 n GLY 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ca4 n ALA 274 N 1.00 1.07 -2.68 4.61 0.00 -0.61 -4.61 120.51 119.29 2ca4 n ALA 274 Ca 0.00 0.08 -0.37 0.00 0.00 0.00 0.00 53.44 53.15 2ca4 n ALA 274 Cb 0.08 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.19 2ca4 n ALA 274 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ca4 s SER 275 N -1.06 6.56 0.23 0.00 1.04 -1.26 -1.10 113.70 118.10 2ca4 s SER 275 Ca 0.74 0.66 0.04 0.00 0.48 0.00 0.00 55.95 57.87 2ca4 s SER 275 Cb -0.42 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.46 2ca4 s SER 275 CO 0.48 0.22 -0.03 0.68 0.98 0.00 0.00 173.24 175.56 2ca4 s VAL 276 N -0.26 1.18 -0.25 5.02 -7.23 -0.53 -4.96 120.40 113.37 2ca4 s VAL 276 Ca 0.19 -2.06 -0.18 0.00 -1.81 0.00 0.00 61.98 58.13 2ca4 s VAL 276 Cb -0.14 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 2ca4 s VAL 276 CO 0.07 -0.38 0.50 -0.75 -0.31 0.00 0.00 175.10 174.24 2ca4 s LYS 277 N -3.82 4.09 0.22 4.82 2.20 -1.26 -1.84 119.74 124.15 2ca4 s LYS 277 Ca 0.27 0.32 -0.31 0.00 -0.36 0.00 0.00 55.97 55.88 2ca4 s LYS 277 Cb 0.05 -3.63 -0.14 0.00 -1.51 0.00 0.00 37.83 32.59 2ca4 s LYS 277 CO 0.08 -0.29 1.26 0.00 -0.36 0.00 0.00 175.35 176.04 2ca4 n ALA 278 N 5.34 0.20 0.00 3.13 0.00 0.17 -4.53 120.51 124.83 2ca4 n ALA 278 Ca -0.05 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2ca4 n ALA 278 Cb 0.50 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.80 2ca4 n ALA 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ca4 n GLY 279 N 1.95 0.26 3.58 0.00 0.00 0.25 -4.95 105.19 106.28 2ca4 n GLY 279 Ca 0.12 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 2ca4 n GLY 279 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ca4 s GLU 280 N -0.84 3.21 -0.32 1.61 0.41 -1.26 -0.56 118.70 120.95 2ca4 s GLU 280 Ca 0.00 0.90 -0.12 0.00 -0.41 0.00 0.00 54.97 55.34 2ca4 s GLU 280 Cb 0.00 -4.19 -0.03 0.00 -1.78 0.00 0.00 34.13 28.13 2ca4 s GLU 280 CO 0.00 -2.02 0.23 0.08 -0.49 0.00 0.00 175.26 173.06 2ca4 s VAL 281 N 6.91 5.29 -0.18 2.63 1.01 0.31 -4.89 120.40 131.47 2ca4 s VAL 281 Ca 0.66 -0.06 -0.27 0.00 0.00 0.00 0.00 61.98 62.32 2ca4 s VAL 281 Cb -0.16 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2ca4 s VAL 281 CO 0.28 0.08 0.92 -2.16 0.00 0.00 0.00 175.10 174.22 2ca4 s PRO 282 N 1.76 4.30 0.15 2.72 0.05 -1.26 -1.04 135.00 141.68 2ca4 s PRO 282 Ca 0.07 1.18 0.08 0.00 0.05 0.00 0.00 61.00 62.38 2ca4 s PRO 282 Cb -0.17 -3.59 -0.04 0.00 0.05 0.00 0.00 34.50 30.75 2ca4 s PRO 282 CO 0.11 -0.42 -0.11 -0.51 0.05 0.00 0.00 177.00 176.11 2ca4 s LEU 283 N 2.47 2.93 0.14 -3.56 1.43 0.74 -5.00 118.68 117.83 2ca4 s LEU 283 Ca 0.42 -0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 52.85 2ca4 s LEU 283 Cb -0.16 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.40 2ca4 s LEU 283 CO 0.11 0.14 0.36 0.00 0.23 0.00 0.00 176.35 177.20 2ca4 s ARG 284 N -2.53 1.12 0.00 1.70 1.70 -1.26 -0.76 118.95 118.91 2ca4 s ARG 284 Ca 0.23 -0.89 0.00 0.00 -0.47 0.00 0.00 55.73 54.60 2ca4 s ARG 284 Cb -0.10 0.44 0.00 0.00 -0.57 0.00 0.00 34.95 34.72 2ca4 s ARG 284 CO 0.14 -0.43 0.00 0.41 -1.08 0.00 0.00 175.30 174.34 2ca4 n GLY 285 N -0.22 0.99 3.08 3.88 0.00 -0.77 -1.40 105.19 110.75 2ca4 n GLY 285 Ca -0.13 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2ca4 n GLY 285 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ca4 s ILE 286 N -1.13 0.43 0.03 -0.61 -4.36 -0.68 -1.55 121.20 113.33 2ca4 s ILE 286 Ca 0.00 -1.47 -0.06 0.00 -0.26 0.00 0.00 60.65 58.86 2ca4 s ILE 286 Cb 0.00 -1.07 -0.01 0.00 1.25 0.00 0.00 42.46 42.63 2ca4 s ILE 286 CO 0.00 -0.69 0.10 0.00 0.24 0.00 0.00 174.94 174.58 2ca4 s ALA 287 N -2.65 -0.13 0.18 2.27 0.00 0.58 -0.75 121.76 121.26 2ca4 s ALA 287 Ca -0.01 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.34 2ca4 s ALA 287 Cb -0.01 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.35 2ca4 s ALA 287 CO -0.04 -0.27 0.53 -0.59 0.00 0.00 0.00 175.76 175.39 2ca4 s PHE 288 N -2.13 -0.25 0.00 0.00 -0.12 -0.54 0.41 117.98 115.34 2ca4 s PHE 288 Ca -0.09 -0.06 0.00 0.00 -0.05 0.00 0.00 56.93 56.73 2ca4 s PHE 288 Cb -0.04 0.43 0.00 0.00 -0.63 0.00 0.00 43.02 42.78 2ca4 s PHE 288 CO -0.02 -0.88 0.00 -0.40 -0.05 0.00 0.00 175.22 173.87 2ca4 n ASP 289 N -0.34 0.00 -0.95 1.98 5.75 -1.26 -1.01 116.55 120.72 2ca4 n ASP 289 Ca -0.13 -0.09 0.02 0.00 -0.01 0.00 0.00 54.79 54.58 2ca4 n ASP 289 Cb 0.63 0.00 0.12 0.00 -1.03 0.00 0.00 41.12 40.84 2ca4 n ASP 289 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ca4 n GLY 290 N 0.00 1.99 0.00 6.12 0.00 -1.24 -4.83 105.19 107.23 2ca4 n GLY 290 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2ca4 n GLY 290 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ca4 n GLY 291 N 0.19 1.21 0.07 -0.02 0.00 -1.26 -4.55 105.19 100.83 2ca4 n GLY 291 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2ca4 n GLY 291 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ca4 n TYR 292 N -1.21 0.60 0.00 1.61 4.01 -1.26 -4.80 117.16 116.11 2ca4 n TYR 292 Ca 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2ca4 n TYR 292 Cb 0.00 -0.71 0.00 0.00 -0.31 0.00 0.00 39.34 38.32 2ca4 n TYR 292 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ca4 n GLY 293 N 1.27 2.16 3.70 2.72 0.00 -1.26 -4.17 105.19 109.62 2ca4 n GLY 293 Ca 0.01 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 2ca4 n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ca4 s ILE 294 N -1.10 4.84 -0.16 -0.61 -1.09 -1.26 -1.48 121.20 120.33 2ca4 s ILE 294 Ca 0.00 2.05 0.02 0.00 -2.23 0.00 0.00 60.65 60.49 2ca4 s ILE 294 Cb 0.00 -4.32 -0.23 0.00 -1.58 0.00 0.00 42.46 36.34 2ca4 s ILE 294 CO 0.00 0.10 0.21 0.41 -1.23 0.00 0.00 174.94 174.43 2ca4 n THR 295 N 4.16 1.62 -3.51 2.92 -1.04 -0.02 -4.85 114.28 113.56 2ca4 n THR 295 Ca 0.07 -0.68 -0.09 0.00 -2.04 0.00 0.00 64.05 61.31 2ca4 n THR 295 Cb 0.50 -1.36 -0.03 0.00 -1.82 0.00 0.00 70.33 67.62 2ca4 n THR 295 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ca4 s GLN 296 N -2.55 0.80 -0.09 -2.82 1.03 -1.08 -5.01 119.66 109.94 2ca4 s GLN 296 Ca -0.21 -0.23 0.01 0.00 0.04 0.00 0.00 55.36 54.97 2ca4 s GLN 296 Cb 0.07 0.37 0.02 0.00 0.03 0.00 0.00 33.01 33.50 2ca4 s GLN 296 CO 0.74 -0.34 -0.10 0.08 -2.54 0.00 0.00 175.29 173.14 2ca4 s VAL 297 N -2.80 1.07 0.04 3.63 1.01 -1.26 -1.16 120.40 120.93 2ca4 s VAL 297 Ca 0.04 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2ca4 s VAL 297 Cb -0.01 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 2ca4 s VAL 297 CO -0.07 0.36 0.04 -0.44 0.00 0.00 0.00 175.10 174.99 2ca4 s SER 298 N 1.22 5.31 0.08 3.32 0.01 0.10 -0.82 113.70 122.93 2ca4 s SER 298 Ca -0.04 -0.02 0.09 0.00 1.31 0.00 0.00 55.95 57.29 2ca4 s SER 298 Cb -0.14 -1.40 -0.03 0.00 0.21 0.00 0.00 66.02 64.66 2ca4 s SER 298 CO -0.03 0.23 -0.23 -0.69 0.41 0.00 0.00 173.24 172.92 2ca4 s VAL 299 N -1.24 1.91 0.00 3.43 1.01 0.78 -0.80 120.40 125.49 2ca4 s VAL 299 Ca 0.24 -1.47 0.01 0.00 0.00 0.00 0.00 61.98 60.77 2ca4 s VAL 299 Cb -0.12 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 2ca4 s VAL 299 CO 0.16 0.13 -0.05 -0.55 0.00 0.00 0.00 175.10 174.79 2ca4 s SER 300 N -1.61 0.54 0.00 3.32 0.15 0.75 -0.08 113.70 116.77 2ca4 s SER 300 Ca 0.09 -0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.63 2ca4 s SER 300 Cb -0.10 -0.05 0.02 0.00 -1.71 0.00 0.00 66.02 64.19 2ca4 s SER 300 CO 0.04 0.02 0.80 0.00 1.20 0.00 0.00 173.24 175.30 2ca4 n ALA 301 N 2.81 2.23 -2.50 5.45 0.00 -1.26 -0.18 120.51 127.07 2ca4 n ALA 301 Ca -0.14 -0.78 -0.22 0.00 0.00 0.00 0.00 53.44 52.30 2ca4 n ALA 301 Cb 0.58 -0.04 0.01 0.00 0.00 0.00 0.00 19.45 20.00 2ca4 n ALA 301 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ca4 n ASP 302 N -0.20 3.83 -3.62 0.00 5.68 -1.24 -3.91 116.55 117.09 2ca4 n ASP 302 Ca 0.01 -3.43 -0.26 0.00 -0.50 0.00 0.00 54.79 50.61 2ca4 n ASP 302 Cb 0.16 -0.47 -0.02 0.00 -1.14 0.00 0.00 41.12 39.65 2ca4 n ASP 302 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ca4 n ALA 303 N -0.40 -1.11 -0.29 2.12 0.00 -0.75 -1.84 120.51 118.24 2ca4 n ALA 303 Ca 0.31 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2ca4 n ALA 303 Cb 0.72 -2.65 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2ca4 n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ca4 n GLY 304 N -1.13 0.83 0.15 0.00 0.00 -1.26 -4.97 105.19 98.80 2ca4 n GLY 304 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 2ca4 n GLY 304 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ca4 h LYS 305 N 3.30 0.43 -4.78 1.61 6.56 -1.79 -3.46 116.57 118.43 2ca4 h LYS 305 Ca 0.00 -0.26 -0.26 0.00 -1.06 0.00 0.00 60.65 59.07 2ca4 h LYS 305 Cb 0.00 0.02 -0.16 0.00 -0.57 0.00 0.00 32.23 31.53 2ca4 h LYS 305 CO 0.00 0.85 -0.71 -1.54 -2.06 0.00 0.00 179.45 175.99 2ca4 s SER 306 N -6.30 1.30 0.01 0.86 1.04 -1.26 -5.11 113.70 104.25 2ca4 s SER 306 Ca -0.14 -0.95 0.05 0.00 0.48 0.00 0.00 55.95 55.39 2ca4 s SER 306 Cb 0.06 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.22 2ca4 s SER 306 CO 0.78 -0.39 -0.14 0.26 0.98 0.00 0.00 173.24 174.73 2ca4 s TRP 307 N -3.23 1.25 0.00 5.02 0.52 -1.26 -4.36 118.94 116.89 2ca4 s TRP 307 Ca 0.10 -0.28 0.06 0.00 0.02 0.00 0.00 56.10 56.00 2ca4 s TRP 307 Cb 0.02 -0.78 -0.03 0.00 -1.15 0.00 0.00 33.47 31.53 2ca4 s TRP 307 CO -0.03 0.00 -0.18 0.99 0.02 0.00 0.00 176.95 177.76 2ca4 s THR 308 N -0.53 2.78 -0.13 2.01 2.01 0.88 -4.92 115.64 117.75 2ca4 s THR 308 Ca 0.04 -1.02 -0.29 0.00 0.31 0.00 0.00 61.69 60.72 2ca4 s THR 308 Cb -0.06 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.31 2ca4 s THR 308 CO 0.00 0.45 1.18 0.21 -0.69 0.00 0.00 174.62 175.77 2ca4 s ASN 309 N -1.09 7.04 0.63 3.53 2.47 -1.26 -0.15 114.94 126.10 2ca4 s ASN 309 Ca 0.13 1.68 -0.14 0.00 0.42 0.00 0.00 52.86 54.94 2ca4 s ASN 309 Cb -0.10 -2.55 -0.02 0.00 -1.45 0.00 0.00 41.25 37.13 2ca4 s ASN 309 CO 0.03 -0.65 1.06 0.00 -3.72 0.00 0.00 177.10 173.82 2ca4 s ALA 310 N 2.80 2.72 -0.23 1.71 0.00 0.00 -4.93 121.76 123.84 2ca4 s ALA 310 Ca 0.53 0.30 -0.19 0.00 0.00 0.00 0.00 51.96 52.60 2ca4 s ALA 310 Cb -0.21 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2ca4 s ALA 310 CO 0.17 -0.94 0.54 0.99 0.00 0.00 0.00 175.76 176.52 2ca4 s THR 311 N -2.63 5.07 0.17 0.00 2.01 0.84 -4.71 115.64 116.39 2ca4 s THR 311 Ca 0.62 0.98 -0.30 0.00 0.31 0.00 0.00 61.69 63.30 2ca4 s THR 311 Cb -0.15 -3.86 -0.07 0.00 0.01 0.00 0.00 72.50 68.42 2ca4 s THR 311 CO 0.42 0.12 1.03 -0.76 -0.69 0.00 0.00 174.62 174.74 2ca4 s LEU 312 N 1.98 4.52 0.90 4.42 1.43 -1.26 -0.98 118.68 129.70 2ca4 s LEU 312 Ca 0.24 1.98 -0.11 0.00 -1.03 0.00 0.00 54.13 55.21 2ca4 s LEU 312 Cb -0.16 -3.60 0.14 0.00 0.03 0.00 0.00 46.19 42.60 2ca4 s LEU 312 CO 0.09 -0.10 1.11 -1.81 0.23 0.00 0.00 176.35 175.88 2ca4 s ASP 313 N -0.31 3.16 0.33 2.29 1.01 0.26 -4.95 116.67 118.45 2ca4 s ASP 313 Ca 0.47 1.96 -0.29 0.00 0.71 0.00 0.00 52.55 55.39 2ca4 s ASP 313 Cb -0.27 -2.49 -0.12 0.00 1.01 0.00 0.00 42.92 41.06 2ca4 s ASP 313 CO 0.33 -2.91 1.51 -0.81 0.21 0.00 0.00 175.17 173.49 2ca4 n PRO 314 N -4.10 2.57 -2.92 8.23 -0.04 -1.26 -4.78 135.00 132.71 2ca4 n PRO 314 Ca 0.10 0.91 -0.26 0.00 -0.04 0.00 0.00 63.50 64.20 2ca4 n PRO 314 Cb 0.53 -2.64 -0.01 0.00 -0.04 0.00 0.00 33.50 31.34 2ca4 n PRO 314 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2ca4 s GLY 315 N 0.15 1.47 -0.12 0.55 0.00 -1.26 -4.80 107.32 103.30 2ca4 s GLY 315 Ca 0.59 -0.64 0.16 0.00 0.00 0.00 0.00 44.72 44.84 2ca4 s GLY 315 CO 0.56 -0.51 1.52 1.04 0.00 0.00 0.00 173.10 175.71 2ca4 n LEU 316 N -2.03 4.31 0.00 0.66 4.77 -1.26 -5.06 117.00 118.38 2ca4 n LEU 316 Ca -0.01 -2.58 0.00 0.00 -0.03 0.00 0.00 56.01 53.39 2ca4 n LEU 316 Cb 0.55 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2ca4 n LEU 316 CO 0.51 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.92 2ca4 n GLY 317 N 0.51 3.33 0.24 -0.72 0.00 -1.26 -4.59 105.19 102.70 2ca4 n GLY 317 Ca 0.22 -1.91 0.16 0.00 0.00 0.00 0.00 46.02 44.50 2ca4 n GLY 317 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2ca4 h LYS 318 N 0.00 0.00 -0.01 1.61 2.10 -1.89 -2.63 116.57 115.75 2ca4 h LYS 318 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2ca4 h LYS 318 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2ca4 h LYS 318 CO 0.00 0.00 -0.54 0.66 -2.00 0.00 0.00 179.45 177.57 2ca4 n TYR 319 N -2.78 0.00 -2.44 0.07 4.01 -1.26 -4.03 117.16 110.74 2ca4 n TYR 319 Ca 0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.46 2ca4 n TYR 319 Cb 0.21 -0.05 0.01 0.00 -0.31 0.00 0.00 39.34 39.20 2ca4 n TYR 319 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2ca4 s SER 320 N -2.64 6.14 0.20 7.72 0.15 -0.99 -1.30 113.70 122.97 2ca4 s SER 320 Ca 0.17 0.99 -0.32 0.00 0.70 0.00 0.00 55.95 57.49 2ca4 s SER 320 Cb 0.18 -2.20 -0.14 0.00 -1.71 0.00 0.00 66.02 62.14 2ca4 s SER 320 CO 0.63 -0.73 1.33 0.49 1.20 0.00 0.00 173.24 176.17 2ca4 n PHE 321 N -2.42 1.82 -3.65 3.44 3.72 -1.26 -4.75 117.46 114.36 2ca4 n PHE 321 Ca 0.02 0.52 -0.38 0.00 -0.05 0.00 0.00 57.45 57.56 2ca4 n PHE 321 Cb 0.55 -2.40 -0.12 0.00 -0.94 0.00 0.00 39.48 36.58 2ca4 n PHE 321 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2ca4 s ARG 322 N -0.19 3.68 0.59 -1.08 6.06 0.17 -4.65 118.95 123.53 2ca4 s ARG 322 Ca 0.72 -0.49 -0.15 0.00 -2.50 0.00 0.00 55.73 53.32 2ca4 s ARG 322 Cb -0.75 -3.54 -0.04 0.00 0.06 0.00 0.00 34.95 30.69 2ca4 s ARG 322 CO 0.49 -0.26 1.04 0.20 -2.50 0.00 0.00 175.30 174.28 2ca4 s GLY 323 N 1.68 2.04 0.07 8.12 0.00 -1.26 -0.30 107.32 117.66 2ca4 s GLY 323 Ca 0.06 0.30 -0.09 0.00 0.00 0.00 0.00 44.72 44.99 2ca4 s GLY 323 CO 0.07 0.61 0.20 0.66 0.00 0.00 0.00 173.10 174.65 2ca4 s TRP 324 N -2.58 0.10 -0.01 1.90 1.48 -0.59 -0.58 118.94 118.66 2ca4 s TRP 324 Ca 0.62 -0.45 -0.04 0.00 -1.06 0.00 0.00 56.10 55.16 2ca4 s TRP 324 Cb -0.15 -0.03 0.00 0.00 -1.16 0.00 0.00 33.47 32.13 2ca4 s TRP 324 CO 0.39 -0.51 0.09 0.15 -4.06 0.00 0.00 176.95 173.00 2ca4 s LYS 325 N -3.42 0.28 0.02 3.25 1.02 -0.15 -1.85 119.74 118.89 2ca4 s LYS 325 Ca 0.01 -0.19 -0.14 0.00 0.02 0.00 0.00 55.97 55.67 2ca4 s LYS 325 Cb 0.03 0.11 0.02 0.00 -0.52 0.00 0.00 37.83 37.47 2ca4 s LYS 325 CO -0.09 -0.05 0.31 0.00 -0.92 0.00 0.00 175.35 174.60 2ca4 s ALA 326 N -0.72 -0.72 -0.15 5.17 0.00 0.06 -0.11 121.76 125.29 2ca4 s ALA 326 Ca -0.08 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.00 2ca4 s ALA 326 Cb -0.05 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.33 2ca4 s ALA 326 CO 0.00 -0.36 -0.16 0.08 0.00 0.00 0.00 175.76 175.33 2ca4 s VAL 327 N -2.12 1.66 -0.13 0.00 1.01 -1.26 -0.19 120.40 119.38 2ca4 s VAL 327 Ca -0.08 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2ca4 s VAL 327 Cb -0.02 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 2ca4 s VAL 327 CO -0.01 0.47 -0.15 -0.76 0.00 0.00 0.00 175.10 174.66 2ca4 s LEU 328 N 1.37 2.60 -0.11 3.92 1.02 -0.20 -4.88 118.68 122.41 2ca4 s LEU 328 Ca 0.03 -0.37 -0.29 0.00 0.02 0.00 0.00 54.13 53.52 2ca4 s LEU 328 Cb -0.13 -1.58 -0.05 0.00 0.02 0.00 0.00 46.19 44.46 2ca4 s LEU 328 CO -0.10 0.16 1.66 -2.16 0.02 0.00 0.00 176.35 175.94 2ca4 s PRO 329 N 0.36 4.02 -0.15 1.29 0.04 -1.26 -0.53 135.00 138.78 2ca4 s PRO 329 Ca -0.12 2.02 0.02 0.00 0.04 0.00 0.00 61.00 62.96 2ca4 s PRO 329 Cb -0.16 -4.02 0.02 0.00 0.04 0.00 0.00 34.50 30.38 2ca4 s PRO 329 CO 0.06 -1.03 -0.19 -0.51 0.04 0.00 0.00 177.00 175.37 2ca4 s LEU 330 N 4.56 1.97 0.84 -3.56 1.02 0.27 -4.96 118.68 118.81 2ca4 s LEU 330 Ca 0.74 -0.56 -0.11 0.00 0.02 0.00 0.00 54.13 54.21 2ca4 s LEU 330 Cb -0.31 -1.34 0.09 0.00 0.02 0.00 0.00 46.19 44.65 2ca4 s LEU 330 CO 0.29 0.02 1.09 0.42 0.02 0.00 0.00 176.35 178.20 2ca4 s THR 331 N 1.09 2.95 0.53 5.49 -4.23 -1.26 -0.59 115.64 119.62 2ca4 s THR 331 Ca -0.02 0.31 -0.22 0.00 -1.18 0.00 0.00 61.69 60.58 2ca4 s THR 331 Cb -0.14 -2.90 -0.05 0.00 1.34 0.00 0.00 72.50 70.75 2ca4 s THR 331 CO -0.06 -0.40 1.32 -0.54 -0.54 0.00 0.00 174.62 174.39 2ca4 s LYS 332 N -5.02 3.23 0.00 3.99 1.02 -1.26 -4.67 119.74 117.03 2ca4 s LYS 332 Ca 0.62 2.13 0.00 0.00 0.02 0.00 0.00 55.97 58.74 2ca4 s LYS 332 Cb -0.16 -2.26 0.00 0.00 -0.52 0.00 0.00 37.83 34.89 2ca4 s LYS 332 CO 0.56 -1.09 0.00 0.41 -0.92 0.00 0.00 175.35 174.31 2ca4 n GLY 333 N 0.67 -0.09 3.79 -3.33 0.00 0.10 -4.93 105.19 101.40 2ca4 n GLY 333 Ca 0.10 -2.21 -0.39 0.00 0.00 0.00 0.00 46.02 43.52 2ca4 n GLY 333 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ca4 s ASP 334 N -4.00 7.16 -0.02 1.61 1.11 -1.26 -0.32 116.67 120.96 2ca4 s ASP 334 Ca 0.00 1.38 -0.01 0.00 0.18 0.00 0.00 52.55 54.10 2ca4 s ASP 334 Cb 0.00 -2.41 0.01 0.00 1.07 0.00 0.00 42.92 41.59 2ca4 s ASP 334 CO 0.00 0.20 0.05 -1.00 1.18 0.00 0.00 175.17 175.60 2ca4 s HIS 335 N -0.87 -0.04 -0.46 4.23 3.76 -0.35 -4.97 115.29 116.59 2ca4 s HIS 335 Ca 0.32 0.15 -0.14 0.00 -0.15 0.00 0.00 55.06 55.24 2ca4 s HIS 335 Cb -0.20 -0.05 0.07 0.00 1.11 0.00 0.00 32.58 33.51 2ca4 s HIS 335 CO 0.21 -0.05 0.37 0.08 -0.85 0.00 0.00 174.74 174.50 2ca4 s VAL 336 N 0.37 5.03 0.05 -0.90 1.01 -1.25 -0.35 120.40 124.36 2ca4 s VAL 336 Ca -0.03 -1.13 -0.22 0.00 0.00 0.00 0.00 61.98 60.60 2ca4 s VAL 336 Cb -0.04 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.26 2ca4 s VAL 336 CO -0.01 -0.56 0.66 -0.76 0.00 0.00 0.00 175.10 174.43 2ca4 s LEU 337 N 1.60 4.48 0.08 3.92 1.43 -0.03 -1.80 118.68 128.36 2ca4 s LEU 337 Ca 0.04 1.33 0.04 0.00 -1.03 0.00 0.00 54.13 54.51 2ca4 s LEU 337 Cb -0.24 -3.06 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 2ca4 s LEU 337 CO 0.06 0.13 -0.11 -0.04 0.23 0.00 0.00 176.35 176.62 2ca4 s MET 338 N -0.49 0.80 0.04 1.70 -1.94 0.75 -0.18 119.30 119.98 2ca4 s MET 338 Ca 0.33 -1.03 0.04 0.00 -1.71 0.00 0.00 55.69 53.33 2ca4 s MET 338 Cb -0.20 -0.62 -0.02 0.00 2.01 0.00 0.00 34.83 36.00 2ca4 s MET 338 CO 0.20 0.12 -0.12 0.00 -0.01 0.00 0.00 175.02 175.21 2ca4 s ARG 340 N -1.29 0.03 0.08 0.00 3.52 0.02 -4.10 118.95 117.20 2ca4 s ARG 340 Ca -0.01 0.31 0.06 0.00 -0.13 0.00 0.00 55.73 55.96 2ca4 s ARG 340 Cb -0.08 -0.23 -0.04 0.00 -1.56 0.00 0.00 34.95 33.04 2ca4 s ARG 340 CO 0.01 -0.18 -0.08 0.00 -0.81 0.00 0.00 175.30 174.24 2ca4 s ALA 341 N 1.25 3.02 0.10 6.12 0.00 -1.26 0.03 121.76 131.02 2ca4 s ALA 341 Ca -0.08 -1.18 0.04 0.00 0.00 0.00 0.00 51.96 50.75 2ca4 s ALA 341 Cb -0.12 -0.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 2ca4 s ALA 341 CO -0.05 0.65 -0.11 0.95 0.00 0.00 0.00 175.76 177.20 2ca4 s THR 342 N -1.18 1.06 0.47 0.00 -4.23 -0.31 -3.39 115.64 108.06 2ca4 s THR 342 Ca 0.21 -1.66 0.06 0.00 -1.18 0.00 0.00 61.69 59.12 2ca4 s THR 342 Cb -0.11 -1.41 -0.02 0.00 1.34 0.00 0.00 72.50 72.30 2ca4 s THR 342 CO 0.13 -0.51 0.23 0.54 -0.54 0.00 0.00 174.62 174.47 2ca4 s ASN 343 N -2.45 4.48 0.51 3.99 2.20 -0.59 -0.84 114.94 122.24 2ca4 s ASN 343 Ca 0.06 -1.20 0.34 0.00 -0.94 0.00 0.00 52.86 51.12 2ca4 s ASN 343 Cb -0.03 -0.05 1.61 0.00 -2.00 0.00 0.00 41.25 40.77 2ca4 s ASN 343 CO 0.01 -0.78 2.02 0.00 -2.94 0.00 0.00 177.10 175.41 2ca4 h ALA 344 N 1.18 1.00 -0.60 3.54 0.00 -1.42 0.12 119.26 123.08 2ca4 h ALA 344 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2ca4 h ALA 344 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ca4 h ALA 344 CO 0.66 0.00 0.00 2.89 0.00 0.00 0.00 179.25 182.80 2ca4 n ARG 345 N -2.84 3.82 -1.01 0.00 1.85 -1.26 -4.95 116.66 112.27 2ca4 n ARG 345 Ca -0.00 -2.75 -0.00 0.00 -1.00 0.00 0.00 57.85 54.09 2ca4 n ARG 345 Cb 0.19 -1.95 -0.00 0.00 -1.05 0.00 0.00 32.46 29.65 2ca4 n ARG 345 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2ca4 n GLY 346 N 0.98 0.47 3.78 2.89 0.00 0.43 -5.03 105.19 108.71 2ca4 n GLY 346 Ca 0.25 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 2ca4 n GLY 346 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ca4 s GLU 347 N -0.86 4.28 0.27 1.61 2.02 -1.26 -4.83 118.70 119.93 2ca4 s GLU 347 Ca 0.00 1.44 0.01 0.00 0.02 0.00 0.00 54.97 56.43 2ca4 s GLU 347 Cb 0.00 -2.58 -0.03 0.00 0.10 0.00 0.00 34.13 31.62 2ca4 s GLU 347 CO 0.00 -0.02 0.27 -0.08 0.02 0.00 0.00 175.26 175.45 2ca4 s THR 348 N -1.69 0.00 0.04 3.63 -1.32 -1.26 -1.54 115.64 113.51 2ca4 s THR 348 Ca 0.56 -1.88 -0.21 0.00 -1.21 0.00 0.00 61.69 58.96 2ca4 s THR 348 Cb -0.20 -2.49 -0.06 0.00 -1.51 0.00 0.00 72.50 68.23 2ca4 s THR 348 CO 0.26 0.00 0.60 -1.10 -2.21 0.00 0.00 174.62 172.17 2ca4 s GLN 349 N -3.72 4.29 0.51 7.08 -0.21 -1.22 -4.82 119.66 121.57 2ca4 s GLN 349 Ca 0.37 0.78 -0.20 0.00 0.02 0.00 0.00 55.36 56.33 2ca4 s GLN 349 Cb 0.03 -3.29 -0.08 0.00 1.00 0.00 0.00 33.01 30.68 2ca4 s GLN 349 CO 0.18 0.50 1.06 -1.25 -2.12 0.00 0.00 175.29 173.66 2ca4 s PRO 350 N -0.67 3.67 0.19 2.91 0.04 -1.26 -4.75 135.00 135.13 2ca4 s PRO 350 Ca 0.31 1.40 0.09 0.00 0.04 0.00 0.00 61.00 62.84 2ca4 s PRO 350 Cb -0.19 -2.07 0.03 0.00 0.04 0.00 0.00 34.50 32.31 2ca4 s PRO 350 CO 0.19 -0.55 1.42 0.52 0.04 0.00 0.00 177.00 178.62 2ca4 h MET 351 N 1.40 0.00 -6.07 4.56 2.86 -1.95 -1.35 114.93 114.37 2ca4 h MET 351 Ca -0.49 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.46 2ca4 h MET 351 Cb 1.23 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.69 2ca4 h MET 351 CO 0.58 0.83 -0.70 -0.65 1.06 0.00 0.00 176.91 178.03 2ca4 s GLN 352 N -3.08 2.81 0.39 1.72 -0.21 -1.26 -4.57 119.66 115.45 2ca4 s GLN 352 Ca 0.00 -0.57 -0.26 0.00 0.02 0.00 0.00 55.36 54.55 2ca4 s GLN 352 Cb 0.11 -2.59 -0.09 0.00 1.00 0.00 0.00 33.01 31.45 2ca4 s GLN 352 CO 0.79 0.61 1.21 0.00 -2.12 0.00 0.00 175.29 175.78 2ca4 s ALA 353 N -0.67 3.23 0.54 6.09 0.00 -1.26 -4.91 121.76 124.78 2ca4 s ALA 353 Ca 0.10 1.05 0.09 0.00 0.00 0.00 0.00 51.96 53.20 2ca4 s ALA 353 Cb -0.11 -3.41 0.07 0.00 0.00 0.00 0.00 23.12 19.66 2ca4 s ALA 353 CO 0.02 -0.58 0.71 0.95 0.00 0.00 0.00 175.76 176.86 2ca4 s THR 354 N -1.33 2.25 0.01 0.00 -4.23 -1.26 -5.10 115.64 105.97 2ca4 s THR 354 Ca 0.55 -1.05 -0.02 0.00 -1.18 0.00 0.00 61.69 59.99 2ca4 s THR 354 Cb -0.33 -2.30 -0.01 0.00 1.34 0.00 0.00 72.50 71.20 2ca4 s THR 354 CO 0.42 0.00 0.02 0.86 -0.54 0.00 0.00 174.62 175.38 2ca4 s TRP 355 N -2.62 0.14 0.11 3.99 -0.00 -1.26 -4.88 118.94 114.42 2ca4 s TRP 355 Ca 0.58 -0.29 -0.07 0.00 -0.00 0.00 0.00 56.10 56.32 2ca4 s TRP 355 Cb -0.06 -0.11 -0.01 0.00 -0.00 0.00 0.00 33.47 33.29 2ca4 s TRP 355 CO 0.36 -0.16 0.18 0.54 -0.00 0.00 0.00 176.95 177.87 2ca4 s ASN 356 N -1.05 0.16 0.49 5.86 4.22 -1.26 -0.98 114.94 122.38 2ca4 s ASN 356 Ca -0.11 -0.82 0.13 0.00 -2.14 0.00 0.00 52.86 49.92 2ca4 s ASN 356 Cb -0.07 0.35 1.14 0.00 1.28 0.00 0.00 41.25 43.95 2ca4 s ASN 356 CO -0.00 -0.76 2.12 -0.65 -2.04 0.00 0.00 177.10 175.77 2ca4 h PRO 357 N 2.75 0.17 0.00 3.55 0.11 -1.95 -2.47 132.00 134.16 2ca4 h PRO 357 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2ca4 h PRO 357 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2ca4 h PRO 357 CO 0.55 0.11 -0.08 0.00 -0.21 0.00 0.00 178.00 178.38 2ca4 h ALA 358 N 1.92 0.96 -2.12 -0.75 0.00 -1.91 -3.43 119.26 113.92 2ca4 h ALA 358 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2ca4 h ALA 358 Cb -0.01 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.81 2ca4 h ALA 358 CO -0.01 0.00 -0.24 0.41 0.00 0.00 0.00 179.25 179.41 2ca4 n GLY 359 N 1.16 0.22 3.92 0.00 0.00 -0.93 -4.93 105.19 104.63 2ca4 n GLY 359 Ca 0.04 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 2ca4 n GLY 359 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ca4 s TYR 360 N -2.80 3.48 -1.23 1.61 2.02 -1.26 -4.36 117.35 114.81 2ca4 s TYR 360 Ca 0.13 0.46 0.00 0.00 -0.37 0.00 0.00 57.07 57.29 2ca4 s TYR 360 Cb -0.06 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.55 2ca4 s TYR 360 CO 0.16 0.27 0.00 -1.33 -1.57 0.00 0.00 175.55 173.08 2ca4 n MET 361 N -0.88 -0.82 -1.72 -0.62 2.81 -0.91 -4.80 117.12 110.18 2ca4 n MET 361 Ca -0.03 0.90 -0.43 0.00 -1.81 0.00 0.00 57.70 56.32 2ca4 n MET 361 Cb 0.54 -4.90 -0.02 0.00 -0.71 0.00 0.00 33.22 28.13 2ca4 n MET 361 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 2ca4 n ARG 362 N -2.64 2.52 -0.80 0.03 0.63 -1.26 -4.88 116.66 110.26 2ca4 n ARG 362 Ca -0.12 0.90 -0.01 0.00 -0.92 0.00 0.00 57.85 57.70 2ca4 n ARG 362 Cb 0.39 -2.66 -0.02 0.00 0.45 0.00 0.00 32.46 30.63 2ca4 n ARG 362 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2ca4 n ASN 363 N 2.47 -0.11 -4.70 6.15 6.94 -1.26 -5.00 115.26 119.75 2ca4 n ASN 363 Ca 0.11 -1.65 -0.34 0.00 -0.02 0.00 0.00 54.58 52.67 2ca4 n ASN 363 Cb 0.35 -0.01 0.11 0.00 -2.36 0.00 0.00 39.78 37.87 2ca4 n ASN 363 CO 0.00 0.00 0.00 0.55 -1.03 0.00 0.00 177.26 176.78 2ca4 n VAL 364 N 0.08 2.85 -1.74 3.53 3.14 -1.26 -4.34 118.33 120.59 2ca4 n VAL 364 Ca -0.07 -0.29 -0.42 0.00 -2.96 0.00 0.00 64.34 60.60 2ca4 n VAL 364 Cb 0.71 -1.28 -0.03 0.00 -1.06 0.00 0.00 33.84 32.18 2ca4 n VAL 364 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2ca4 s VAL 365 N -1.92 2.82 0.13 1.55 1.01 -0.51 -4.92 120.40 118.56 2ca4 s VAL 365 Ca 0.76 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 2ca4 s VAL 365 Cb -0.32 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.91 2ca4 s VAL 365 CO 0.48 -0.00 1.02 -1.61 0.00 0.00 0.00 175.10 174.98 2ca4 s GLU 366 N 3.39 4.65 -0.08 2.72 0.41 -1.26 -4.98 118.70 123.54 2ca4 s GLU 366 Ca 0.82 1.56 0.02 0.00 -0.41 0.00 0.00 54.97 56.96 2ca4 s GLU 366 Cb -0.43 -3.34 -0.02 0.00 -1.78 0.00 0.00 34.13 28.55 2ca4 s GLU 366 CO 0.37 0.14 -0.12 0.00 -0.49 0.00 0.00 175.26 175.16 2ca4 s ALA 367 N -0.02 2.74 -0.20 5.21 0.00 -1.26 -3.47 121.76 124.76 2ca4 s ALA 367 Ca 0.48 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.49 2ca4 s ALA 367 Cb -0.26 -1.11 0.06 0.00 0.00 0.00 0.00 23.12 21.82 2ca4 s ALA 367 CO 0.31 0.47 0.02 0.99 0.00 0.00 0.00 175.76 177.56 2ca4 s THR 368 N -0.44 0.69 -0.07 0.00 2.01 0.75 -4.95 115.64 113.63 2ca4 s THR 368 Ca 0.06 -0.68 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 2ca4 s THR 368 Cb -0.12 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 2ca4 s THR 368 CO 0.02 -0.20 1.15 -0.60 -0.69 0.00 0.00 174.62 174.30 2ca4 s ARG 369 N 1.78 4.37 0.29 4.92 3.52 -1.26 -0.85 118.95 131.72 2ca4 s ARG 369 Ca -0.02 1.60 0.10 0.00 -0.13 0.00 0.00 55.73 57.29 2ca4 s ARG 369 Cb -0.17 -3.56 -0.05 0.00 -1.56 0.00 0.00 34.95 29.60 2ca4 s ARG 369 CO -0.08 -0.42 -0.14 0.14 -0.81 0.00 0.00 175.30 173.98 2ca4 s VAL 370 N 2.20 2.21 -0.27 7.11 -7.23 0.53 0.39 120.40 125.34 2ca4 s VAL 370 Ca 0.54 -2.29 -0.02 0.00 -1.81 0.00 0.00 61.98 58.40 2ca4 s VAL 370 Cb -0.23 -2.39 0.03 0.00 0.56 0.00 0.00 36.38 34.35 2ca4 s VAL 370 CO 0.21 -0.35 -0.03 -0.63 -0.31 0.00 0.00 175.10 173.99 2ca4 s ILE 371 N -2.66 3.05 -0.16 -0.62 1.01 -0.26 -1.21 121.20 120.35 2ca4 s ILE 371 Ca 0.30 -1.08 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 2ca4 s ILE 371 Cb -0.01 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 2ca4 s ILE 371 CO 0.14 0.10 0.31 0.00 0.00 0.00 0.00 174.94 175.49 2ca4 s ALA 372 N 1.33 3.58 0.00 9.38 0.00 0.57 -1.45 121.76 135.16 2ca4 s ALA 372 Ca -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.50 2ca4 s ALA 372 Cb -0.18 -2.42 0.00 0.00 0.00 0.00 0.00 23.12 20.52 2ca4 s ALA 372 CO -0.03 0.05 0.21 0.00 0.00 0.00 0.00 175.76 176.00