#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qa4 n GLN 2 N 0.00 0.00 -2.12 -0.52 1.13 -1.26 -5.01 117.38 109.60 2qa4 n GLN 2 Ca 0.00 0.37 -0.40 0.00 -1.94 0.00 0.00 57.00 55.03 2qa4 n GLN 2 Cb 0.00 -0.84 -0.02 0.00 0.11 0.00 0.00 30.24 29.50 2qa4 n GLN 2 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 2qa4 s PRO 3 N -0.24 4.19 1.27 -1.09 0.02 -1.26 -4.99 135.00 132.90 2qa4 s PRO 3 Ca 0.00 2.14 -0.19 0.00 0.02 0.00 0.00 61.00 62.98 2qa4 s PRO 3 Cb 0.00 -2.91 0.29 0.00 0.02 0.00 0.00 34.50 31.89 2qa4 s PRO 3 CO 0.00 -0.30 0.69 0.43 -0.33 0.00 0.00 177.00 177.48 2qa4 n SER 4 N 0.48 -3.11 0.00 2.53 7.64 -1.26 -5.07 113.62 114.83 2qa4 n SER 4 Ca 0.02 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.39 2qa4 n SER 4 Cb 0.43 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2qa4 n SER 4 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2qa4 n ARG 5 N -4.35 0.00 -1.54 1.43 0.63 -1.26 -5.16 116.66 106.41 2qa4 n ARG 5 Ca 0.07 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.68 2qa4 n ARG 5 Cb 0.54 0.00 0.06 0.00 0.45 0.00 0.00 32.46 33.52 2qa4 n ARG 5 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2qa4 s PRO 6 N -0.71 2.62 1.08 -0.14 0.02 -1.26 -5.00 135.00 131.61 2qa4 s PRO 6 Ca 0.00 1.23 -0.12 0.00 0.02 0.00 0.00 61.00 62.13 2qa4 s PRO 6 Cb 0.00 -1.94 0.24 0.00 0.02 0.00 0.00 34.50 32.82 2qa4 s PRO 6 CO 0.00 -1.37 1.06 -0.98 -0.33 0.00 0.00 177.00 175.38 2qa4 s ARG 7 N -4.55 -0.27 -0.57 5.54 1.70 -1.26 -4.96 118.95 114.58 2qa4 s ARG 7 Ca 0.63 0.99 -0.19 0.00 -0.47 0.00 0.00 55.73 56.69 2qa4 s ARG 7 Cb -0.18 -1.62 0.09 0.00 -0.57 0.00 0.00 34.95 32.67 2qa4 s ARG 7 CO 0.49 -3.33 0.68 0.15 -1.08 0.00 0.00 175.30 172.21 2qa4 s LYS 8 N -4.56 3.06 0.00 3.89 -0.14 -1.26 -4.94 119.74 115.79 2qa4 s LYS 8 Ca 0.67 -1.22 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 2qa4 s LYS 8 Cb -0.24 -4.23 0.00 0.00 -1.68 0.00 0.00 37.83 31.69 2qa4 s LYS 8 CO 0.62 -1.46 0.00 0.41 -0.76 0.00 0.00 175.35 174.16 2qa4 n GLY 9 N 5.26 0.84 3.85 -3.33 0.00 -1.21 -4.80 105.19 105.80 2qa4 n GLY 9 Ca -0.09 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.75 2qa4 n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qa4 s SER 10 N -1.11 6.54 -0.01 1.61 0.15 -1.26 -4.96 113.70 114.67 2qa4 s SER 10 Ca 0.00 0.65 0.08 0.00 0.70 0.00 0.00 55.95 57.37 2qa4 s SER 10 Cb 0.00 -2.14 0.23 0.00 -1.71 0.00 0.00 66.02 62.40 2qa4 s SER 10 CO 0.00 0.36 1.17 0.18 1.20 0.00 0.00 173.24 176.15 2qa4 n LEU 11 N 2.03 1.45 -0.72 3.45 7.99 -1.26 -3.97 117.00 125.97 2qa4 n LEU 11 Ca -0.17 -0.73 0.13 0.00 -0.01 0.00 0.00 56.01 55.23 2qa4 n LEU 11 Cb 0.54 -0.20 0.32 0.00 -0.11 0.00 0.00 43.42 43.97 2qa4 n LEU 11 CO 0.34 0.34 0.75 0.61 -1.51 0.00 0.00 177.39 177.92 2qa4 n GLY 12 N 0.86 0.51 0.58 -0.72 0.00 -1.26 -4.01 105.19 101.15 2qa4 n GLY 12 Ca 0.09 -0.57 0.06 0.00 0.00 0.00 0.00 46.02 45.60 2qa4 n GLY 12 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qa4 n PHE 13 N 0.76 0.00 -3.81 1.61 3.01 -1.25 -5.05 117.46 112.73 2qa4 n PHE 13 Ca 0.17 -1.32 -0.21 0.00 1.01 0.00 0.00 57.45 57.10 2qa4 n PHE 13 Cb 0.47 -0.22 -0.03 0.00 -0.01 0.00 0.00 39.48 39.69 2qa4 n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2qa4 s GLY 14 N -3.05 1.70 -0.06 1.37 0.00 -1.26 -3.70 107.32 102.33 2qa4 s GLY 14 Ca 0.36 -1.59 -0.30 0.00 0.00 0.00 0.00 44.72 43.19 2qa4 s GLY 14 CO -0.06 -1.53 1.06 2.56 0.00 0.00 0.00 173.10 175.13 2qa4 s PRO 15 N -4.00 4.44 -0.80 2.90 0.04 -1.26 -5.05 135.00 131.27 2qa4 s PRO 15 Ca 0.40 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.74 2qa4 s PRO 15 Cb -0.07 -3.51 -0.18 0.00 0.04 0.00 0.00 34.50 30.78 2qa4 s PRO 15 CO 0.27 -0.29 1.91 0.54 0.04 0.00 0.00 177.00 179.47 2qa4 n ARG 16 N 4.74 0.13 -4.47 4.56 3.00 -1.24 -4.82 116.66 118.55 2qa4 n ARG 16 Ca 0.09 -1.12 -0.24 0.00 -0.01 0.00 0.00 57.85 56.57 2qa4 n ARG 16 Cb 0.48 -3.10 -0.08 0.00 0.00 0.00 0.00 32.46 29.76 2qa4 n ARG 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 2qa4 s LYS 17 N 7.73 1.89 0.37 5.56 -2.85 -1.26 -4.27 119.74 126.91 2qa4 s LYS 17 Ca 0.67 -2.14 -0.27 0.00 -1.00 0.00 0.00 55.97 53.24 2qa4 s LYS 17 Cb -0.09 -0.43 -0.09 0.00 -2.06 0.00 0.00 37.83 35.16 2qa4 s LYS 17 CO 0.15 -0.51 1.23 1.03 0.10 0.00 0.00 175.35 177.35 2qa4 s ARG 18 N -3.67 4.16 0.45 1.78 0.52 -1.26 -4.60 118.95 116.31 2qa4 s ARG 18 Ca 0.27 2.00 -0.21 0.00 -0.52 0.00 0.00 55.73 57.27 2qa4 s ARG 18 Cb 0.03 -2.84 -0.10 0.00 0.52 0.00 0.00 34.95 32.56 2qa4 s ARG 18 CO 0.17 -0.28 0.99 0.45 0.02 0.00 0.00 175.30 176.64 2qa4 s SER 19 N -0.86 6.72 0.28 0.23 0.15 -0.97 -5.00 113.70 114.27 2qa4 s SER 19 Ca 0.54 1.80 0.11 0.00 0.70 0.00 0.00 55.95 59.10 2qa4 s SER 19 Cb -0.35 -2.55 0.39 0.00 -1.71 0.00 0.00 66.02 61.80 2qa4 s SER 19 CO 0.45 -0.51 1.63 0.74 1.20 0.00 0.00 173.24 176.74 2qa4 h THR 20 N 1.81 1.39 -3.52 6.45 2.02 -1.94 -3.44 112.91 115.68 2qa4 h THR 20 Ca -0.49 -2.06 -0.46 0.00 0.77 0.00 0.00 66.41 64.17 2qa4 h THR 20 Cb 1.20 2.12 -0.33 0.00 -1.74 0.00 0.00 68.15 69.40 2qa4 h THR 20 CO 0.60 0.58 -0.79 -0.44 0.37 0.00 0.00 175.52 175.84 2qa4 s SER 21 N -6.81 1.36 0.00 4.18 0.01 -1.26 -4.98 113.70 106.19 2qa4 s SER 21 Ca -0.01 -0.22 0.16 0.00 1.31 0.00 0.00 55.95 57.20 2qa4 s SER 21 Cb 0.13 -0.59 0.85 0.00 0.21 0.00 0.00 66.02 66.62 2qa4 s SER 21 CO 0.76 0.01 1.46 1.21 0.41 0.00 0.00 173.24 177.09 2qa4 n GLU 22 N 3.78 0.27 -4.08 12.44 2.13 -1.26 -4.47 120.64 129.44 2qa4 n GLU 22 Ca -0.23 0.11 -0.35 0.00 0.66 0.00 0.00 57.16 57.36 2qa4 n GLU 22 Cb 0.52 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.62 2qa4 n GLU 22 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2qa4 s THR 23 N -2.50 4.37 0.49 6.31 2.01 -1.26 -4.67 115.64 120.39 2qa4 s THR 23 Ca 0.17 -0.18 -0.22 0.00 0.31 0.00 0.00 61.69 61.77 2qa4 s THR 23 Cb 0.11 -2.97 -0.07 0.00 0.01 0.00 0.00 72.50 69.59 2qa4 s THR 23 CO 0.24 0.44 1.20 -2.84 -0.69 0.00 0.00 174.62 172.97 2qa4 s PRO 24 N 0.66 3.58 -0.11 4.92 0.02 -1.26 -5.02 135.00 137.79 2qa4 s PRO 24 Ca 0.01 1.85 -0.00 0.00 0.02 0.00 0.00 61.00 62.88 2qa4 s PRO 24 Cb -0.14 -2.33 0.02 0.00 0.02 0.00 0.00 34.50 32.08 2qa4 s PRO 24 CO 0.02 -0.72 -0.08 1.03 -0.33 0.00 0.00 177.00 176.92 2qa4 s ARG 25 N -2.81 1.55 0.31 5.54 1.81 -1.26 -4.95 118.95 119.15 2qa4 s ARG 25 Ca 0.66 -0.27 -0.28 0.00 -1.72 0.00 0.00 55.73 54.12 2qa4 s ARG 25 Cb -0.30 -1.57 -0.09 0.00 -0.45 0.00 0.00 34.95 32.53 2qa4 s ARG 25 CO 0.36 -0.23 1.07 -0.06 -0.68 0.00 0.00 175.30 175.77 2qa4 s PHE 26 N 1.58 3.51 -0.20 -0.53 0.40 -1.26 -4.97 117.98 116.51 2qa4 s PHE 26 Ca 0.03 1.70 0.17 0.00 -0.60 0.00 0.00 56.93 58.22 2qa4 s PHE 26 Cb -0.13 -3.22 -0.24 0.00 0.51 0.00 0.00 43.02 39.94 2qa4 s PHE 26 CO -0.07 -0.51 0.05 0.27 0.70 0.00 0.00 175.22 175.66 2qa4 n ASN 27 N 0.83 0.23 -4.56 1.36 2.04 -1.26 -5.00 115.26 108.90 2qa4 n ASN 27 Ca 0.01 -0.01 -0.23 0.00 -0.44 0.00 0.00 54.58 53.90 2qa4 n ASN 27 Cb 0.46 0.89 -0.09 0.00 -2.53 0.00 0.00 39.78 38.52 2qa4 n ASN 27 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 2qa4 s SER 28 N -5.52 4.07 0.10 0.53 0.01 -1.26 -5.16 113.70 106.47 2qa4 s SER 28 Ca -0.12 -0.83 0.02 0.00 1.31 0.00 0.00 55.95 56.33 2qa4 s SER 28 Cb 0.06 -0.58 -0.04 0.00 0.21 0.00 0.00 66.02 65.67 2qa4 s SER 28 CO 0.80 0.02 -0.08 0.26 0.41 0.00 0.00 173.24 174.65 2qa4 s TRP 29 N -2.41 0.93 0.38 2.43 0.52 -1.26 -5.10 118.94 114.43 2qa4 s TRP 29 Ca 0.31 -0.81 -0.26 0.00 0.02 0.00 0.00 56.10 55.36 2qa4 s TRP 29 Cb -0.06 -0.53 -0.09 0.00 -1.15 0.00 0.00 33.47 31.65 2qa4 s TRP 29 CO 0.17 -0.09 1.16 -2.14 0.02 0.00 0.00 176.95 176.07 2qa4 s PRO 30 N -3.39 4.16 0.82 4.98 0.02 -1.26 -4.98 135.00 135.34 2qa4 s PRO 30 Ca 0.09 1.82 -0.11 0.00 0.02 0.00 0.00 61.00 62.82 2qa4 s PRO 30 Cb 0.02 -2.75 0.08 0.00 0.02 0.00 0.00 34.50 31.87 2qa4 s PRO 30 CO -0.03 -0.23 1.10 -1.54 -0.33 0.00 0.00 177.00 175.97 2qa4 s SER 31 N -1.11 4.08 -1.21 2.53 1.04 -1.26 -4.93 113.70 112.83 2qa4 s SER 31 Ca 0.55 1.81 -0.18 0.00 0.48 0.00 0.00 55.95 58.62 2qa4 s SER 31 Cb -0.30 -2.47 0.09 0.00 0.10 0.00 0.00 66.02 63.44 2qa4 s SER 31 CO 0.39 -2.31 1.59 -1.81 0.98 0.00 0.00 173.24 172.08 2qa4 s ASP 32 N -3.29 6.82 0.00 7.02 1.01 -1.26 -4.82 116.67 122.15 2qa4 s ASP 32 Ca 0.62 -2.38 0.00 0.00 0.71 0.00 0.00 52.55 51.50 2qa4 s ASP 32 Cb -0.18 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.22 2qa4 s ASP 32 CO 0.57 -1.12 0.00 0.47 0.21 0.00 0.00 175.17 175.29 2qa4 n ASP 33 N 7.75 0.00 -3.58 0.27 8.00 -1.26 -4.86 116.55 122.87 2qa4 n ASP 33 Ca 0.42 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.92 2qa4 n ASP 33 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 2qa4 n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qa4 n GLY 34 N 2.77 -2.82 3.59 0.44 0.00 -1.26 -4.67 105.19 103.24 2qa4 n GLY 34 Ca 0.00 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 2qa4 n GLY 34 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qa4 n GLN 35 N -0.28 -1.19 -1.68 1.61 6.02 -1.26 -3.39 117.38 117.20 2qa4 n GLN 35 Ca 0.00 -0.29 -0.44 0.00 -0.01 0.00 0.00 57.00 56.26 2qa4 n GLN 35 Cb 0.00 -2.29 -0.02 0.00 1.02 0.00 0.00 30.24 28.95 2qa4 n GLN 35 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2qa4 n PRO 36 N -4.48 2.07 -3.59 -1.09 -0.02 -1.26 -4.49 135.00 122.14 2qa4 n PRO 36 Ca 0.09 0.73 -0.04 0.00 -2.02 0.00 0.00 63.50 62.25 2qa4 n PRO 36 Cb 0.53 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 2qa4 n PRO 36 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2qa4 s GLY 37 N -0.03 -0.35 0.20 -1.23 0.00 -1.17 -4.89 107.32 99.85 2qa4 s GLY 37 Ca 0.61 1.24 -0.29 0.00 0.00 0.00 0.00 44.72 46.28 2qa4 s GLY 37 CO 0.56 0.39 0.90 0.14 0.00 0.00 0.00 173.10 175.09 2qa4 s VAL 38 N -2.64 4.21 -0.64 1.40 1.01 -1.26 -1.94 120.40 120.55 2qa4 s VAL 38 Ca 0.09 1.99 0.01 0.00 0.00 0.00 0.00 61.98 64.07 2qa4 s VAL 38 Cb -0.00 -4.28 0.41 0.00 0.00 0.00 0.00 36.38 32.51 2qa4 s VAL 38 CO -0.05 0.48 1.72 0.00 0.00 0.00 0.00 175.10 177.25 2qa4 n GLN 39 N 1.73 3.00 0.00 2.72 6.02 0.48 -4.90 117.38 126.43 2qa4 n GLN 39 Ca -0.02 -3.76 0.00 0.00 -0.01 0.00 0.00 57.00 53.21 2qa4 n GLN 39 Cb 0.48 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.46 2qa4 n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qa4 n GLY 40 N -0.65 2.68 0.00 1.08 0.00 -1.26 -4.41 105.19 102.64 2qa4 n GLY 40 Ca 0.52 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2qa4 n GLY 40 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qa4 n PHE 41 N -0.71 0.00 -3.79 1.61 7.35 -0.50 -4.94 117.46 116.49 2qa4 n PHE 41 Ca 0.00 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.67 2qa4 n PHE 41 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2qa4 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qa4 s ALA 42 N -2.00 -1.76 0.00 3.13 0.00 -1.26 -1.95 121.76 117.92 2qa4 s ALA 42 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.01 2qa4 s ALA 42 Cb 0.00 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.77 2qa4 s ALA 42 CO 0.00 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.11 2qa4 n GLY 43 N -0.57 -0.02 3.51 0.00 0.00 -1.09 -4.57 105.19 102.44 2qa4 n GLY 43 Ca -0.05 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 2qa4 n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qa4 s TYR 44 N -2.00 2.96 0.18 1.61 1.51 0.17 -1.45 117.35 120.34 2qa4 s TYR 44 Ca 0.00 -0.24 -0.32 0.00 -1.01 0.00 0.00 57.07 55.51 2qa4 s TYR 44 Cb 0.00 -1.85 -0.11 0.00 -0.11 0.00 0.00 41.96 39.89 2qa4 s TYR 44 CO 0.00 0.07 1.68 0.21 -1.11 0.00 0.00 175.55 176.40 2qa4 s LYS 45 N -0.06 4.16 -0.20 -0.62 2.20 -0.95 -0.53 119.74 123.73 2qa4 s LYS 45 Ca 0.01 2.51 -0.10 0.00 -0.36 0.00 0.00 55.97 58.03 2qa4 s LYS 45 Cb -0.13 -3.17 -0.09 0.00 -1.51 0.00 0.00 37.83 32.93 2qa4 s LYS 45 CO 0.03 -0.71 -0.26 0.00 -0.36 0.00 0.00 175.35 174.04 2qa4 n ALA 46 N 4.19 1.68 0.00 3.13 0.00 -0.43 -0.31 120.51 128.77 2qa4 n ALA 46 Ca 0.15 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.79 2qa4 n ALA 46 Cb 0.37 0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2qa4 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa4 n GLY 47 N 1.73 -1.36 3.55 0.00 0.00 -1.10 -4.79 105.19 103.22 2qa4 n GLY 47 Ca -0.39 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.23 2qa4 n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qa4 s MET 48 N -1.30 2.43 0.04 1.61 -1.94 -1.26 0.86 119.30 119.73 2qa4 s MET 48 Ca 0.00 -0.78 -0.28 0.00 -1.71 0.00 0.00 55.69 52.92 2qa4 s MET 48 Cb 0.00 -2.41 0.09 0.00 2.01 0.00 0.00 34.83 34.52 2qa4 s MET 48 CO 0.00 0.59 0.98 0.95 -0.01 0.00 0.00 175.02 177.53 2qa4 s THR 49 N -0.95 0.00 0.11 2.05 -4.23 -0.68 -4.98 115.64 106.97 2qa4 s THR 49 Ca 0.16 -0.27 0.05 0.00 -1.18 0.00 0.00 61.69 60.45 2qa4 s THR 49 Cb -0.11 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 2qa4 s THR 49 CO 0.06 0.00 0.04 -1.38 -0.54 0.00 0.00 174.62 172.80 2qa4 s HIS 50 N -3.05 3.03 -0.07 3.99 -3.43 -1.26 0.12 115.29 114.62 2qa4 s HIS 50 Ca 0.09 -0.02 0.03 0.00 -0.80 0.00 0.00 55.06 54.36 2qa4 s HIS 50 Cb -0.01 -1.53 0.01 0.00 -1.43 0.00 0.00 32.58 29.63 2qa4 s HIS 50 CO -0.04 0.50 -0.14 0.54 -2.00 0.00 0.00 174.74 173.59 2qa4 s VAL 51 N -1.46 1.30 0.12 -5.38 0.11 -0.13 -1.93 120.40 113.04 2qa4 s VAL 51 Ca 0.27 -0.58 -0.24 0.00 -2.93 0.00 0.00 61.98 58.50 2qa4 s VAL 51 Cb -0.11 -1.17 -0.07 0.00 -1.53 0.00 0.00 36.38 33.50 2qa4 s VAL 51 CO 0.20 0.39 0.74 -0.69 -3.33 0.00 0.00 175.10 172.41 2qa4 s VAL 52 N 0.55 4.53 0.26 2.04 1.01 0.17 -1.27 120.40 127.69 2qa4 s VAL 52 Ca -0.14 1.61 0.01 0.00 0.00 0.00 0.00 61.98 63.46 2qa4 s VAL 52 Cb -0.16 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2qa4 s VAL 52 CO 0.04 0.48 0.10 -0.76 0.00 0.00 0.00 175.10 174.97 2qa4 s LEU 53 N -0.81 1.60 -0.26 3.92 1.02 0.15 -1.67 118.68 122.64 2qa4 s LEU 53 Ca 0.35 -1.40 -0.11 0.00 0.02 0.00 0.00 54.13 52.99 2qa4 s LEU 53 Cb -0.22 0.06 -0.05 0.00 0.02 0.00 0.00 46.19 46.00 2qa4 s LEU 53 CO 0.24 -0.75 0.20 -0.69 0.02 0.00 0.00 176.35 175.36 2qa4 s VAL 54 N -3.77 5.32 -0.30 -1.59 1.01 -1.24 0.02 120.40 119.84 2qa4 s VAL 54 Ca 0.38 0.21 -0.33 0.00 0.00 0.00 0.00 61.98 62.23 2qa4 s VAL 54 Cb 0.08 -3.53 -0.10 0.00 0.00 0.00 0.00 36.38 32.82 2qa4 s VAL 54 CO 0.14 0.28 2.18 -3.20 0.00 0.00 0.00 175.10 174.50 2qa4 n ASN 55 N 4.78 2.47 -0.01 3.32 2.85 -0.02 -4.75 115.26 123.90 2qa4 n ASN 55 Ca -0.14 0.39 -0.05 0.00 -0.11 0.00 0.00 54.58 54.67 2qa4 n ASN 55 Cb 0.52 -1.34 -0.04 0.00 1.24 0.00 0.00 39.78 40.16 2qa4 n ASN 55 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 2qa4 h ASP 56 N 12.88 -0.08 -0.01 1.20 1.82 -1.94 -0.23 116.42 130.06 2qa4 h ASP 56 Ca -0.32 -0.25 -0.51 0.00 -0.39 0.00 0.00 57.03 55.57 2qa4 h ASP 56 Cb 1.30 0.02 -0.03 0.00 0.68 0.00 0.00 39.33 41.30 2qa4 h ASP 56 CO 1.00 0.52 0.86 1.21 -1.61 0.00 0.00 179.24 181.22 2qa4 n GLU 57 N -4.81 0.00 0.14 0.28 2.13 -1.26 -4.79 120.64 112.33 2qa4 n GLU 57 Ca -0.04 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.89 2qa4 n GLU 57 Cb 0.16 -0.99 0.53 0.00 0.27 0.00 0.00 31.44 31.41 2qa4 n GLU 57 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2qa4 n PRO 58 N 4.90 0.16 -0.31 5.31 -0.04 -1.26 -1.75 135.00 142.01 2qa4 n PRO 58 Ca 0.36 0.54 0.09 0.00 -0.04 0.00 0.00 63.50 64.44 2qa4 n PRO 58 Cb -0.03 -1.91 0.25 0.00 -0.04 0.00 0.00 33.50 31.77 2qa4 n PRO 58 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2qa4 n ASN 59 N -2.22 3.56 -4.70 3.54 3.02 -1.26 -4.89 115.26 112.30 2qa4 n ASN 59 Ca 0.00 -2.08 -0.38 0.00 -0.03 0.00 0.00 54.58 52.10 2qa4 n ASN 59 Cb 0.12 -0.38 -0.07 0.00 -0.61 0.00 0.00 39.78 38.84 2qa4 n ASN 59 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2qa4 s SER 60 N -1.03 6.58 0.39 6.41 0.15 -0.72 -4.94 113.70 120.54 2qa4 s SER 60 Ca 0.37 0.69 0.07 0.00 0.70 0.00 0.00 55.95 57.78 2qa4 s SER 60 Cb 0.20 -2.26 0.78 0.00 -1.71 0.00 0.00 66.02 63.03 2qa4 s SER 60 CO 0.24 -0.03 1.99 -0.65 1.20 0.00 0.00 173.24 175.98 2qa4 h PRO 61 N 6.97 0.48 0.00 5.44 0.11 -1.90 -1.37 132.00 141.73 2qa4 h PRO 61 Ca -0.39 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qa4 h PRO 61 Cb 1.17 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qa4 h PRO 61 CO 0.75 0.41 0.00 0.54 -0.21 0.00 0.00 178.00 179.49 2qa4 n ARG 62 N -4.39 0.37 -1.03 1.05 1.74 -1.26 -4.91 116.66 108.23 2qa4 n ARG 62 Ca 0.02 0.07 -0.40 0.00 -0.77 0.00 0.00 57.85 56.77 2qa4 n ARG 62 Cb 0.14 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 2qa4 n ARG 62 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2qa4 n GLU 63 N -1.15 0.00 -0.25 5.56 2.13 -0.52 -1.89 120.64 124.51 2qa4 n GLU 63 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 2qa4 n GLU 63 Cb 0.10 -0.97 0.00 0.00 0.27 0.00 0.00 31.44 30.84 2qa4 n GLU 63 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qa4 n GLY 64 N 1.64 0.84 3.99 8.31 0.00 -0.10 -4.94 105.19 114.93 2qa4 n GLY 64 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 2qa4 n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qa4 s MET 65 N -0.62 2.47 0.73 1.61 -1.94 -0.79 -4.61 119.30 116.15 2qa4 s MET 65 Ca 0.00 -0.95 -0.14 0.00 -1.71 0.00 0.00 55.69 52.89 2qa4 s MET 65 Cb 0.00 -2.52 0.04 0.00 2.01 0.00 0.00 34.83 34.36 2qa4 s MET 65 CO 0.00 -0.74 1.18 -1.21 -0.01 0.00 0.00 175.02 174.24 2qa4 s GLU 66 N -4.73 2.18 -0.30 2.03 0.41 -1.26 -0.84 118.70 116.18 2qa4 s GLU 66 Ca 0.58 1.66 -0.16 0.00 -0.41 0.00 0.00 54.97 56.65 2qa4 s GLU 66 Cb -0.09 -1.85 0.18 0.00 -1.78 0.00 0.00 34.13 30.59 2qa4 s GLU 66 CO 0.38 -1.79 1.10 -2.00 -0.49 0.00 0.00 175.26 172.47 2qa4 s GLU 67 N -4.03 0.17 -0.19 1.61 2.12 0.10 -4.73 118.70 113.75 2qa4 s GLU 67 Ca 0.72 0.37 -0.26 0.00 0.36 0.00 0.00 54.97 56.16 2qa4 s GLU 67 Cb -0.27 0.22 -0.01 0.00 0.26 0.00 0.00 34.13 34.33 2qa4 s GLU 67 CO 0.46 -0.12 0.89 0.99 -0.54 0.00 0.00 175.26 176.95 2qa4 s THR 68 N 2.58 4.82 -0.04 -1.70 2.01 -1.26 0.34 115.64 122.39 2qa4 s THR 68 Ca -0.02 1.75 0.07 0.00 0.31 0.00 0.00 61.69 63.80 2qa4 s THR 68 Cb -0.07 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.24 2qa4 s THR 68 CO -0.14 -0.04 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.82 2qa4 s VAL 69 N 2.52 2.22 0.17 3.82 1.01 -0.40 -4.97 120.40 124.78 2qa4 s VAL 69 Ca 0.40 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 2qa4 s VAL 69 Cb -0.16 -1.80 -0.07 0.00 0.00 0.00 0.00 36.38 34.35 2qa4 s VAL 69 CO 0.10 0.58 1.07 -2.84 0.00 0.00 0.00 175.10 174.01 2qa4 s PRO 70 N -0.48 4.62 -0.05 2.72 0.02 -1.26 -0.95 135.00 139.61 2qa4 s PRO 70 Ca 0.06 1.66 -0.00 0.00 0.02 0.00 0.00 61.00 62.74 2qa4 s PRO 70 Cb -0.11 -3.30 0.03 0.00 0.02 0.00 0.00 34.50 31.14 2qa4 s PRO 70 CO 0.01 0.11 -0.01 0.08 -0.33 0.00 0.00 177.00 176.85 2qa4 s VAL 71 N -0.21 0.38 -0.35 3.83 1.01 0.33 -1.75 120.40 123.63 2qa4 s VAL 71 Ca 0.49 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.28 2qa4 s VAL 71 Cb -0.28 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2qa4 s VAL 71 CO 0.34 0.22 0.72 -0.89 0.00 0.00 0.00 175.10 175.49 2qa4 s THR 72 N 1.36 4.80 0.31 3.92 2.01 0.14 -1.68 115.64 126.50 2qa4 s THR 72 Ca -0.04 0.81 -0.28 0.00 0.31 0.00 0.00 61.69 62.48 2qa4 s THR 72 Cb -0.13 -4.15 -0.10 0.00 0.01 0.00 0.00 72.50 68.14 2qa4 s THR 72 CO -0.02 -0.36 1.14 -0.69 -0.69 0.00 0.00 174.62 174.00 2qa4 s VAL 73 N 2.92 3.31 -0.10 3.82 1.01 0.25 -1.39 120.40 130.22 2qa4 s VAL 73 Ca 0.29 1.27 -0.06 0.00 0.00 0.00 0.00 61.98 63.47 2qa4 s VAL 73 Cb -0.14 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.49 2qa4 s VAL 73 CO 0.15 0.27 0.25 -0.63 0.00 0.00 0.00 175.10 175.14 2qa4 s ILE 74 N -1.22 -0.03 -0.31 2.22 1.01 -0.86 -1.32 121.20 120.70 2qa4 s ILE 74 Ca 0.48 0.10 -0.22 0.00 0.00 0.00 0.00 60.65 61.00 2qa4 s ILE 74 Cb -0.33 -0.37 -0.00 0.00 0.01 0.00 0.00 42.46 41.77 2qa4 s ILE 74 CO 0.42 0.04 0.72 -1.61 0.00 0.00 0.00 174.94 174.51 2qa4 s GLU 75 N 0.87 3.91 -0.57 2.79 2.02 0.31 -1.37 118.70 126.66 2qa4 s GLU 75 Ca -0.06 0.44 0.05 0.00 0.02 0.00 0.00 54.97 55.41 2qa4 s GLU 75 Cb -0.07 -3.74 0.36 0.00 0.10 0.00 0.00 34.13 30.78 2qa4 s GLU 75 CO -0.06 -0.65 1.03 0.25 0.02 0.00 0.00 175.26 175.85 2qa4 n THR 76 N 5.50 3.03 -1.76 3.63 -2.24 -0.59 -0.65 114.28 121.19 2qa4 n THR 76 Ca 0.02 -5.44 -0.38 0.00 -2.27 0.00 0.00 64.05 55.98 2qa4 n THR 76 Cb 0.48 -1.37 0.05 0.00 -2.10 0.00 0.00 70.33 67.39 2qa4 n THR 76 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2qa4 s PRO 77 N -3.53 3.00 0.02 -0.78 0.02 -1.25 -4.60 135.00 127.88 2qa4 s PRO 77 Ca 0.48 2.22 -0.39 0.00 0.02 0.00 0.00 61.00 63.33 2qa4 s PRO 77 Cb 0.31 -2.17 -0.19 0.00 0.02 0.00 0.00 34.50 32.47 2qa4 s PRO 77 CO -0.15 -1.30 1.14 -2.30 -0.33 0.00 0.00 177.00 174.06 2qa4 n PRO 78 N -1.22 0.29 -2.79 5.54 -0.02 -1.26 -4.84 135.00 130.69 2qa4 n PRO 78 Ca 0.12 0.11 -0.22 0.00 -2.02 0.00 0.00 63.50 61.48 2qa4 n PRO 78 Cb 0.45 -1.64 0.09 0.00 -0.02 0.00 0.00 33.50 32.38 2qa4 n PRO 78 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2qa4 s MET 79 N 0.12 1.93 -0.05 -0.52 -1.94 -0.82 -4.54 119.30 113.49 2qa4 s MET 79 Ca 0.89 -1.38 -0.02 0.00 -1.71 0.00 0.00 55.69 53.48 2qa4 s MET 79 Cb -1.19 -2.47 0.03 0.00 2.01 0.00 0.00 34.83 33.21 2qa4 s MET 79 CO 0.54 -1.21 0.03 1.03 -0.01 0.00 0.00 175.02 175.41 2qa4 s ARG 80 N -4.94 0.25 -0.29 2.03 0.52 -0.75 -2.33 118.95 113.44 2qa4 s ARG 80 Ca 0.65 0.25 -0.29 0.00 -0.52 0.00 0.00 55.73 55.81 2qa4 s ARG 80 Cb -0.05 -0.72 0.01 0.00 0.52 0.00 0.00 34.95 34.70 2qa4 s ARG 80 CO 0.42 -0.31 1.18 0.00 0.02 0.00 0.00 175.30 176.61 2qa4 s ALA 81 N 2.05 3.47 -1.83 2.13 0.00 -0.08 -2.35 121.76 125.14 2qa4 s ALA 81 Ca 0.05 0.08 0.19 0.00 0.00 0.00 0.00 51.96 52.28 2qa4 s ALA 81 Cb -0.12 -3.70 0.01 0.00 0.00 0.00 0.00 23.12 19.31 2qa4 s ALA 81 CO -0.04 -1.54 0.98 0.28 0.00 0.00 0.00 175.76 175.45 2qa4 n VAL 82 N 5.92 0.00 -3.59 0.00 0.31 -0.28 -3.56 118.33 117.13 2qa4 n VAL 82 Ca 0.13 -0.32 -0.04 0.00 -0.01 0.00 0.00 64.34 64.10 2qa4 n VAL 82 Cb 0.47 1.25 -0.02 0.00 -0.91 0.00 0.00 33.84 34.62 2qa4 n VAL 82 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qa4 s ALA 83 N -2.12 -2.05 -0.21 3.52 0.00 -1.21 -3.20 121.76 116.50 2qa4 s ALA 83 Ca 0.17 1.35 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 2qa4 s ALA 83 Cb 0.16 0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.32 2qa4 s ALA 83 CO 0.46 -0.69 -0.08 -1.17 0.00 0.00 0.00 175.76 174.28 2qa4 s LEU 84 N -2.36 2.72 -0.10 0.00 1.98 0.09 -1.16 118.68 119.86 2qa4 s LEU 84 Ca 0.10 -0.44 -0.03 0.00 -2.89 0.00 0.00 54.13 50.87 2qa4 s LEU 84 Cb -0.00 -1.68 -0.03 0.00 0.66 0.00 0.00 46.19 45.14 2qa4 s LEU 84 CO -0.05 -0.00 0.01 -0.60 -1.89 0.00 0.00 176.35 173.82 2qa4 s ARG 85 N 1.35 3.16 -0.08 1.98 3.52 0.94 -0.84 118.95 128.98 2qa4 s ARG 85 Ca 0.04 -0.41 0.02 0.00 -0.13 0.00 0.00 55.73 55.26 2qa4 s ARG 85 Cb -0.14 -2.85 0.01 0.00 -1.56 0.00 0.00 34.95 30.41 2qa4 s ARG 85 CO -0.05 0.62 -0.13 0.00 -0.81 0.00 0.00 175.30 174.93 2qa4 s ALA 86 N -0.64 1.36 0.11 6.12 0.00 -0.92 -1.60 121.76 126.19 2qa4 s ALA 86 Ca 0.10 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2qa4 s ALA 86 Cb -0.12 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 2qa4 s ALA 86 CO 0.02 0.05 0.22 0.71 0.00 0.00 0.00 175.76 176.76 2qa4 s TYR 87 N 0.78 3.43 0.34 0.00 1.51 -1.10 0.15 117.35 122.47 2qa4 s TYR 87 Ca -0.12 0.15 0.09 0.00 -1.01 0.00 0.00 57.07 56.18 2qa4 s TYR 87 Cb -0.16 -1.68 -0.06 0.00 -0.11 0.00 0.00 41.96 39.96 2qa4 s TYR 87 CO 0.02 0.54 -0.01 -1.83 -1.11 0.00 0.00 175.55 173.16 2qa4 s GLU 88 N -2.88 2.01 -0.34 -0.62 -1.05 0.07 0.08 118.70 115.97 2qa4 s GLU 88 Ca 0.34 -1.81 -0.13 0.00 -0.15 0.00 0.00 54.97 53.22 2qa4 s GLU 88 Cb -0.12 -1.86 -0.01 0.00 -0.44 0.00 0.00 34.13 31.70 2qa4 s GLU 88 CO 0.27 0.13 0.23 -0.51 0.95 0.00 0.00 175.26 176.33 2qa4 s ASP 89 N -3.69 5.99 0.30 0.83 1.01 -0.55 -2.45 116.67 118.10 2qa4 s ASP 89 Ca 0.34 -0.50 0.11 0.00 0.71 0.00 0.00 52.55 53.21 2qa4 s ASP 89 Cb 0.01 -2.12 -0.06 0.00 1.01 0.00 0.00 42.92 41.76 2qa4 s ASP 89 CO 0.19 -0.25 -0.16 0.42 0.21 0.00 0.00 175.17 175.58 2qa4 s THR 90 N 1.70 2.33 -1.71 -1.27 -4.23 -0.70 -4.95 115.64 106.81 2qa4 s THR 90 Ca 0.06 -2.32 0.00 0.00 -1.18 0.00 0.00 61.69 58.25 2qa4 s THR 90 Cb -0.18 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2qa4 s THR 90 CO 0.10 -0.34 0.56 -2.65 -0.54 0.00 0.00 174.62 171.75 2qa4 n PRO 91 N -0.67 0.66 -1.22 3.99 -0.02 -1.26 -2.20 135.00 134.28 2qa4 n PRO 91 Ca -0.05 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.44 2qa4 n PRO 91 Cb 0.61 -1.10 0.11 0.00 -0.02 0.00 0.00 33.50 33.11 2qa4 n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qa4 n TYR 92 N -0.30 0.39 -1.58 6.00 4.02 -1.26 -5.11 117.16 119.32 2qa4 n TYR 92 Ca 0.00 -1.29 0.00 0.00 -0.01 0.00 0.00 57.90 56.60 2qa4 n TYR 92 Cb 0.05 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.14 2qa4 n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qa4 n GLY 93 N -0.50 0.17 3.36 2.72 0.00 -0.93 -4.90 105.19 105.11 2qa4 n GLY 93 Ca 0.17 -1.48 -0.32 0.00 0.00 0.00 0.00 46.02 44.38 2qa4 n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qa4 s GLN 94 N 0.00 2.96 0.07 1.61 -0.21 -1.26 -1.72 119.66 121.10 2qa4 s GLN 94 Ca 0.00 -0.75 0.07 0.00 0.02 0.00 0.00 55.36 54.69 2qa4 s GLN 94 Cb 0.00 -2.44 -0.03 0.00 1.00 0.00 0.00 33.01 31.54 2qa4 s GLN 94 CO 0.00 0.35 -0.18 1.03 -2.12 0.00 0.00 175.29 174.37 2qa4 s ARG 95 N -0.03 1.09 0.51 2.91 0.52 -1.03 -4.93 118.95 117.99 2qa4 s ARG 95 Ca -0.05 -0.99 -0.22 0.00 -0.52 0.00 0.00 55.73 53.95 2qa4 s ARG 95 Cb -0.14 -1.22 -0.06 0.00 0.52 0.00 0.00 34.95 34.04 2qa4 s ARG 95 CO 0.04 0.29 1.28 -2.14 0.02 0.00 0.00 175.30 174.80 2qa4 s PRO 96 N -1.55 3.42 -0.18 3.54 0.02 -1.26 -0.75 135.00 138.25 2qa4 s PRO 96 Ca 0.04 2.05 -0.13 0.00 0.02 0.00 0.00 61.00 62.97 2qa4 s PRO 96 Cb -0.09 -2.34 -0.07 0.00 0.02 0.00 0.00 34.50 32.02 2qa4 s PRO 96 CO 0.03 -0.91 -0.29 -0.11 -0.33 0.00 0.00 177.00 175.39 2qa4 n LEU 97 N -0.77 1.72 -3.85 -5.54 0.00 0.40 -4.75 117.00 104.20 2qa4 n LEU 97 Ca 0.09 0.29 -0.06 0.00 0.00 0.00 0.00 56.01 56.33 2qa4 n LEU 97 Cb 0.46 -0.67 0.02 0.00 0.00 0.00 0.00 43.42 43.23 2qa4 n LEU 97 CO 0.51 0.01 0.69 0.42 0.00 0.00 0.00 177.39 179.03 2qa4 s THR 98 N -2.61 0.00 0.01 1.96 -4.23 -1.21 -5.02 115.64 104.54 2qa4 s THR 98 Ca -0.28 -0.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.48 2qa4 s THR 98 Cb 0.07 -2.92 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 2qa4 s THR 98 CO 0.38 0.00 -0.03 -1.61 -0.54 0.00 0.00 174.62 172.82 2qa4 s GLU 99 N -2.17 0.25 -0.21 3.99 2.02 -1.26 -2.16 118.70 119.17 2qa4 s GLU 99 Ca 0.19 -0.25 0.01 0.00 0.02 0.00 0.00 54.97 54.95 2qa4 s GLU 99 Cb -0.04 -0.16 0.03 0.00 0.10 0.00 0.00 34.13 34.07 2qa4 s GLU 99 CO 0.08 0.04 -0.17 0.08 0.02 0.00 0.00 175.26 175.31 2qa4 s VAL 100 N -0.44 2.13 0.23 2.63 1.01 -0.02 -4.90 120.40 121.03 2qa4 s VAL 100 Ca -0.03 -1.14 0.03 0.00 0.00 0.00 0.00 61.98 60.84 2qa4 s VAL 100 Cb -0.03 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.37 2qa4 s VAL 100 CO -0.00 0.36 0.25 0.79 0.00 0.00 0.00 175.10 176.50 2qa4 n TRP 101 N 4.57 -1.95 -2.34 5.22 7.02 -1.26 -0.73 117.44 127.96 2qa4 n TRP 101 Ca -0.19 -0.90 0.00 0.00 -1.02 0.00 0.00 57.50 55.39 2qa4 n TRP 101 Cb 0.48 -0.20 0.00 0.00 -2.42 0.00 0.00 31.31 29.16 2qa4 n TRP 101 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2qa4 n THR 102 N -1.28 0.00 0.00 -0.99 -2.24 -1.19 -4.88 114.28 103.69 2qa4 n THR 102 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2qa4 n THR 102 Cb 0.25 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2qa4 n THR 102 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qa4 n ASP 103 N 0.00 1.71 -4.55 3.42 8.00 -1.26 -4.98 116.55 118.88 2qa4 n ASP 103 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 2qa4 n ASP 103 Cb 0.00 0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 2qa4 n ASP 103 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2qa4 s GLU 104 N -1.36 3.17 -0.02 -1.24 2.02 -1.26 -4.99 118.70 115.03 2qa4 s GLU 104 Ca 0.00 -0.23 -0.00 0.00 0.02 0.00 0.00 54.97 54.75 2qa4 s GLU 104 Cb 0.00 -4.24 -0.04 0.00 0.10 0.00 0.00 34.13 29.95 2qa4 s GLU 104 CO 0.00 -2.19 0.06 -0.06 0.02 0.00 0.00 175.26 173.09 2qa4 s PHE 105 N 5.90 3.23 0.30 1.61 0.40 -1.26 -4.95 117.98 123.22 2qa4 s PHE 105 Ca 0.37 0.19 -0.29 0.00 -0.60 0.00 0.00 56.93 56.60 2qa4 s PHE 105 Cb -0.08 -1.73 -0.11 0.00 0.51 0.00 0.00 43.02 41.61 2qa4 s PHE 105 CO 0.14 0.53 1.46 -1.58 0.70 0.00 0.00 175.22 176.48 2qa4 s HIS 106 N -1.13 2.86 0.46 0.36 5.65 -1.26 -4.83 115.29 117.39 2qa4 s HIS 106 Ca 0.21 1.07 0.06 0.00 0.25 0.00 0.00 55.06 56.65 2qa4 s HIS 106 Cb -0.12 -3.90 0.35 0.00 -1.18 0.00 0.00 32.58 27.73 2qa4 s HIS 106 CO 0.11 -2.82 1.10 0.66 -0.65 0.00 0.00 174.74 173.14 2qa4 h SER 107 N 4.22 0.00 -0.01 9.88 4.64 -2.03 -0.35 113.55 129.90 2qa4 h SER 107 Ca -0.48 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.74 2qa4 h SER 107 Cb 1.22 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.10 2qa4 h SER 107 CO 0.73 0.00 -0.79 -0.62 -0.87 0.00 0.00 176.83 175.27 2qa4 n GLU 108 N -2.25 0.76 0.00 4.77 1.02 -1.26 -4.75 120.64 118.93 2qa4 n GLU 108 Ca -0.00 -2.62 0.14 0.00 -0.02 0.00 0.00 57.16 54.66 2qa4 n GLU 108 Cb 0.72 -0.77 0.67 0.00 -0.02 0.00 0.00 31.44 32.05 2qa4 n GLU 108 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2qa4 n LEU 109 N -0.25 0.14 0.00 -4.62 7.94 -0.14 -3.28 117.00 116.79 2qa4 n LEU 109 Ca 0.12 0.25 0.13 0.00 -1.11 0.00 0.00 56.01 55.40 2qa4 n LEU 109 Cb 0.94 -0.30 0.46 0.00 0.53 0.00 0.00 43.42 45.05 2qa4 n LEU 109 CO -0.04 0.03 0.75 -0.90 -1.11 0.00 0.00 177.39 176.12 2qa4 n ASP 110 N -1.26 0.24 0.14 1.96 5.75 -1.26 -1.99 116.55 120.13 2qa4 n ASP 110 Ca 0.12 0.20 0.13 0.00 -0.01 0.00 0.00 54.79 55.23 2qa4 n ASP 110 Cb 0.27 -0.20 0.49 0.00 -1.03 0.00 0.00 41.12 40.65 2qa4 n ASP 110 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2qa4 h ARG 111 N 0.00 0.00 0.00 0.11 3.08 -1.94 -3.35 114.38 112.29 2qa4 h ARG 111 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qa4 h ARG 111 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2qa4 h ARG 111 CO 0.00 0.00 -0.84 2.41 -1.07 0.00 0.00 179.97 180.47 2qa4 n THR 112 N -2.33 0.00 -3.71 2.04 -1.04 -1.23 -4.97 114.28 103.04 2qa4 n THR 112 Ca 0.03 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.84 2qa4 n THR 112 Cb 0.28 -0.86 -0.02 0.00 -1.82 0.00 0.00 70.33 67.91 2qa4 n THR 112 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2qa4 s LEU 113 N -5.23 3.92 -1.06 -4.42 1.43 -0.84 -5.02 118.68 107.45 2qa4 s LEU 113 Ca 0.00 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.81 2qa4 s LEU 113 Cb 0.00 -2.59 0.29 0.00 0.03 0.00 0.00 46.19 43.92 2qa4 s LEU 113 CO 0.00 -0.31 1.22 0.47 0.23 0.00 0.00 176.35 177.96 2qa4 n ASP 114 N -1.48 5.70 -4.59 2.29 8.00 -1.26 -4.37 116.55 120.83 2qa4 n ASP 114 Ca -0.03 -3.22 -0.58 0.00 0.71 0.00 0.00 54.79 51.68 2qa4 n ASP 114 Cb 0.58 -1.28 -0.07 0.00 -0.02 0.00 0.00 41.12 40.33 2qa4 n ASP 114 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2qa4 n VAL 115 N 2.01 0.04 -1.58 2.53 0.31 -1.26 -4.90 118.33 115.49 2qa4 n VAL 115 Ca 0.25 -0.01 -0.40 0.00 -0.01 0.00 0.00 64.34 64.18 2qa4 n VAL 115 Cb 0.36 -0.50 0.03 0.00 -0.91 0.00 0.00 33.84 32.82 2qa4 n VAL 115 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2qa4 n PRO 116 N 2.67 1.01 -0.01 5.55 -0.02 -1.26 -4.97 135.00 137.96 2qa4 n PRO 116 Ca 0.22 0.37 -0.01 0.00 -2.02 0.00 0.00 63.50 62.06 2qa4 n PRO 116 Cb 0.11 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 31.58 2qa4 n PRO 116 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qa4 n GLU 117 N -0.24 0.98 -3.44 -0.52 1.02 -1.26 -4.97 120.64 112.20 2qa4 n GLU 117 Ca 0.11 0.01 -0.24 0.00 -0.02 0.00 0.00 57.16 57.02 2qa4 n GLU 117 Cb 0.43 -1.04 -0.11 0.00 -0.02 0.00 0.00 31.44 30.71 2qa4 n GLU 117 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qa4 s ASP 118 N -3.92 2.42 0.27 1.62 1.01 -1.26 -5.14 116.67 111.67 2qa4 s ASP 118 Ca -0.02 -1.66 0.09 0.00 0.71 0.00 0.00 52.55 51.67 2qa4 s ASP 118 Cb 0.01 -0.01 -0.04 0.00 1.01 0.00 0.00 42.92 43.88 2qa4 s ASP 118 CO 0.05 -0.33 0.01 -2.28 0.21 0.00 0.00 175.17 172.82 2qa4 s HIS 119 N 1.54 2.72 -0.62 4.23 5.65 -1.26 -5.10 115.29 122.45 2qa4 s HIS 119 Ca 0.15 -0.22 0.02 0.00 0.25 0.00 0.00 55.06 55.26 2qa4 s HIS 119 Cb -0.18 -1.21 0.16 0.00 -1.18 0.00 0.00 32.58 30.16 2qa4 s HIS 119 CO -0.12 0.61 0.41 0.34 -0.65 0.00 0.00 174.74 175.33 2qa4 s ASP 120 N -3.69 4.84 0.00 9.88 -1.08 -1.26 -4.95 116.67 120.41 2qa4 s ASP 120 Ca 0.32 -3.19 0.15 0.00 -0.52 0.00 0.00 52.55 49.30 2qa4 s ASP 120 Cb -0.06 -1.73 0.80 0.00 -1.46 0.00 0.00 42.92 40.47 2qa4 s ASP 120 CO 0.20 -0.24 1.37 -2.65 0.52 0.00 0.00 175.17 174.37 2qa4 n PRO 121 N 2.94 0.31 -0.11 4.34 -0.02 -1.26 -3.08 135.00 138.12 2qa4 n PRO 121 Ca 0.10 0.09 -0.20 0.00 -2.02 0.00 0.00 63.50 61.47 2qa4 n PRO 121 Cb 0.35 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.24 2qa4 n PRO 121 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2qa4 n ASP 122 N -1.17 1.96 0.09 2.55 9.92 -1.26 -3.97 116.55 124.67 2qa4 n ASP 122 Ca 0.09 0.09 -0.03 0.00 -0.53 0.00 0.00 54.79 54.41 2qa4 n ASP 122 Cb 0.09 -0.51 0.20 0.00 -0.64 0.00 0.00 41.12 40.26 2qa4 n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2qa4 h ALA 123 N -0.43 1.06 -0.09 2.24 0.00 -1.98 0.28 119.26 120.34 2qa4 h ALA 123 Ca -0.53 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 53.88 2qa4 h ALA 123 Cb 1.62 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2qa4 h ALA 123 CO -0.22 0.62 -0.17 0.00 0.00 0.00 0.00 179.25 179.48 2qa4 h ALA 124 N 1.34 0.15 -0.14 0.00 0.00 -1.79 0.17 119.26 118.99 2qa4 h ALA 124 Ca 0.01 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2qa4 h ALA 124 Cb 0.88 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 2qa4 h ALA 124 CO 0.07 0.06 -0.17 1.49 0.00 0.00 0.00 179.25 180.70 2qa4 h GLU 125 N -0.17 -0.20 -0.19 0.00 4.81 -1.64 0.96 114.58 118.14 2qa4 h GLU 125 Ca 0.01 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 2qa4 h GLU 125 Cb 0.75 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.10 2qa4 h GLU 125 CO 0.04 -0.14 -0.45 1.49 -0.73 0.00 0.00 179.01 179.23 2qa4 h GLU 126 N -0.21 -0.45 -0.79 1.92 4.81 -0.33 0.28 114.58 119.80 2qa4 h GLU 126 Ca 0.10 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 2qa4 h GLU 126 Cb 0.36 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 2qa4 h GLU 126 CO -0.26 -0.30 0.52 0.37 -0.73 0.00 0.00 179.01 178.60 2qa4 h GLN 127 N -0.47 0.61 0.49 1.92 4.15 0.12 -1.82 115.11 120.11 2qa4 h GLN 127 Ca 0.08 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 2qa4 h GLN 127 Cb 0.63 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.18 2qa4 h GLN 127 CO -0.45 0.41 -0.23 0.82 -1.93 0.00 0.00 178.83 177.45 2qa4 h ILE 128 N 0.63 0.49 -0.60 2.39 2.04 0.12 -1.90 117.51 120.67 2qa4 h ILE 128 Ca 0.38 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 66.06 2qa4 h ILE 128 Cb 0.60 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2qa4 h ILE 128 CO -0.15 0.04 0.40 0.03 0.00 0.00 0.00 178.15 178.48 2qa4 h ARG 129 N -0.81 0.52 -0.43 2.37 3.08 -0.81 -0.58 114.38 117.73 2qa4 h ARG 129 Ca -0.07 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 2qa4 h ARG 129 Cb 0.57 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2qa4 h ARG 129 CO 0.11 0.35 -0.07 -0.44 -1.07 0.00 0.00 179.97 178.85 2qa4 h ASP 130 N 0.54 0.72 0.00 7.04 3.32 -1.14 -0.01 116.42 126.89 2qa4 h ASP 130 Ca 0.27 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 2qa4 h ASP 130 Cb 0.35 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2qa4 h ASP 130 CO -0.08 0.83 -0.38 0.00 -1.72 0.00 0.00 179.24 177.89 2qa4 h ALA 131 N 1.24 0.93 -0.53 3.45 0.00 -0.32 -2.39 119.26 121.63 2qa4 h ALA 131 Ca 0.12 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 2qa4 h ALA 131 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2qa4 h ALA 131 CO 0.03 0.63 -0.12 1.25 0.00 0.00 0.00 179.25 181.04 2qa4 h HIS 132 N 0.42 1.13 -0.60 0.00 -0.00 -0.51 -1.21 115.15 114.37 2qa4 h HIS 132 Ca 0.04 -0.24 0.01 0.00 -0.00 0.00 0.00 60.37 60.18 2qa4 h HIS 132 Cb 0.86 -0.28 -0.03 0.00 -0.00 0.00 0.00 27.41 27.96 2qa4 h HIS 132 CO 0.03 1.05 0.40 0.93 -0.00 0.00 0.00 177.93 180.34 2qa4 h GLU 133 N 0.90 0.79 0.00 5.26 5.08 -0.81 -2.07 114.58 123.73 2qa4 h GLU 133 Ca 0.14 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2qa4 h GLU 133 Cb 0.68 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2qa4 h GLU 133 CO 0.05 0.52 -0.23 0.00 -1.00 0.00 0.00 179.01 178.35 2qa4 h ALA 134 N 1.22 1.31 0.00 3.43 0.00 -1.18 -3.47 119.26 120.56 2qa4 h ALA 134 Ca 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qa4 h ALA 134 Cb -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2qa4 h ALA 134 CO -0.05 0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.90 2qa4 n GLY 135 N -0.50 1.08 0.32 0.00 0.00 -0.53 -4.99 105.19 100.57 2qa4 n GLY 135 Ca -0.02 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 45.72 2qa4 n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qa4 n ASP 136 N 0.72 2.17 -4.50 1.61 8.00 -0.74 -4.98 116.55 118.82 2qa4 n ASP 136 Ca 0.00 -3.41 -0.43 0.00 0.71 0.00 0.00 54.79 51.66 2qa4 n ASP 136 Cb 0.08 -0.48 -0.06 0.00 -0.02 0.00 0.00 41.12 40.65 2qa4 n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2qa4 s LEU 137 N -3.02 4.50 0.96 0.64 2.96 -1.24 -1.48 118.68 122.00 2qa4 s LEU 137 Ca 0.35 -0.48 -0.14 0.00 -0.22 0.00 0.00 54.13 53.63 2qa4 s LEU 137 Cb 0.32 -2.71 0.21 0.00 0.50 0.00 0.00 46.19 44.52 2qa4 s LEU 137 CO -0.01 -0.95 1.31 -0.83 -1.32 0.00 0.00 176.35 174.55 2qa4 s GLY 138 N 2.45 1.81 1.02 7.98 0.00 0.11 -4.89 107.32 115.81 2qa4 s GLY 138 Ca 0.24 -1.40 -0.21 0.00 0.00 0.00 0.00 44.72 43.34 2qa4 s GLY 138 CO 0.17 -0.60 -0.79 2.09 0.00 0.00 0.00 173.10 173.98 2qa4 n ASP 139 N -3.72 -3.52 -4.11 1.64 5.75 -1.26 -4.26 116.55 107.06 2qa4 n ASP 139 Ca 0.17 0.06 -0.31 0.00 -0.01 0.00 0.00 54.79 54.70 2qa4 n ASP 139 Cb 0.59 -0.75 -0.17 0.00 -1.03 0.00 0.00 41.12 39.76 2qa4 n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2qa4 s LEU 140 N 4.83 1.92 0.02 -2.12 1.43 -1.26 -2.71 118.68 120.80 2qa4 s LEU 140 Ca 0.44 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 53.06 2qa4 s LEU 140 Cb -0.05 -1.28 -0.02 0.00 0.03 0.00 0.00 46.19 44.87 2qa4 s LEU 140 CO 0.71 0.05 -0.13 -0.13 0.23 0.00 0.00 176.35 177.07 2qa4 s ARG 141 N 0.92 0.92 -0.11 1.70 0.52 -0.63 -1.12 118.95 121.16 2qa4 s ARG 141 Ca -0.06 -0.62 -0.08 0.00 -0.52 0.00 0.00 55.73 54.45 2qa4 s ARG 141 Cb -0.15 -0.90 -0.04 0.00 0.52 0.00 0.00 34.95 34.38 2qa4 s ARG 141 CO -0.02 0.23 0.17 -0.51 0.02 0.00 0.00 175.30 175.19 2qa4 s LEU 142 N -0.81 4.40 -0.25 2.53 1.43 -0.56 -0.04 118.68 125.38 2qa4 s LEU 142 Ca 0.02 0.53 -0.28 0.00 -1.03 0.00 0.00 54.13 53.37 2qa4 s LEU 142 Cb -0.07 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 44.03 2qa4 s LEU 142 CO 0.01 0.39 0.99 -0.63 0.23 0.00 0.00 176.35 177.34 2qa4 s ILE 143 N -1.00 4.69 0.30 -0.59 -1.09 -0.31 -2.18 121.20 121.01 2qa4 s ILE 143 Ca 0.16 1.86 0.10 0.00 -2.23 0.00 0.00 60.65 60.54 2qa4 s ILE 143 Cb -0.13 -4.28 -0.06 0.00 -1.58 0.00 0.00 42.46 36.42 2qa4 s ILE 143 CO 0.05 -0.20 -0.15 -0.89 -1.23 0.00 0.00 174.94 172.51 2qa4 s THR 144 N 3.18 2.29 0.23 2.92 2.01 -0.13 -1.12 115.64 125.01 2qa4 s THR 144 Ca 0.42 -2.31 -0.16 0.00 0.31 0.00 0.00 61.69 59.95 2qa4 s THR 144 Cb -0.15 -2.40 0.01 0.00 0.01 0.00 0.00 72.50 69.97 2qa4 s THR 144 CO 0.08 -0.34 0.53 -1.38 -0.69 0.00 0.00 174.62 172.81 2qa4 s HIS 145 N -2.61 0.10 0.55 4.92 -3.43 -0.99 0.84 115.29 114.66 2qa4 s HIS 145 Ca 0.30 -0.48 0.05 0.00 -0.80 0.00 0.00 55.06 54.14 2qa4 s HIS 145 Cb -0.02 0.34 0.05 0.00 -1.43 0.00 0.00 32.58 31.53 2qa4 s HIS 145 CO 0.15 -1.00 0.44 0.25 -2.00 0.00 0.00 174.74 172.57 2qa4 n THR 146 N -0.37 0.00 -3.68 -5.38 -2.24 -1.17 -1.81 114.28 99.62 2qa4 n THR 146 Ca -0.05 -2.14 -0.27 0.00 -2.27 0.00 0.00 64.05 59.31 2qa4 n THR 146 Cb 0.62 -0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.68 2qa4 n THR 146 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2qa4 n VAL 147 N -1.81 1.33 0.29 2.28 0.31 -1.26 -4.52 118.33 114.94 2qa4 n VAL 147 Ca -0.01 -4.73 0.18 0.00 -0.01 0.00 0.00 64.34 59.78 2qa4 n VAL 147 Cb 0.62 -2.09 0.97 0.00 -0.91 0.00 0.00 33.84 32.43 2qa4 n VAL 147 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2qa4 h PRO 148 N 5.04 0.00 -0.70 5.55 0.11 -1.83 0.42 132.00 140.59 2qa4 h PRO 148 Ca 0.17 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.22 2qa4 h PRO 148 Cb 0.76 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.84 2qa4 h PRO 148 CO 0.69 0.00 0.21 0.22 -0.21 0.00 0.00 178.00 178.91 2qa4 h ASP 149 N 0.00 1.03 0.00 -2.05 3.58 -1.80 -2.44 116.42 114.74 2qa4 h ASP 149 Ca 0.03 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.27 2qa4 h ASP 149 Cb 0.33 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2qa4 h ASP 149 CO -0.00 0.97 0.15 0.00 -2.88 0.00 0.00 179.24 177.49 2qa4 h ALA 150 N 1.10 1.14 -3.27 -0.78 0.00 -0.52 -3.33 119.26 113.59 2qa4 h ALA 150 Ca 0.22 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.44 2qa4 h ALA 150 Cb 0.32 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 17.78 2qa4 h ALA 150 CO -0.00 -0.14 -0.61 0.08 0.00 0.00 0.00 179.25 178.57 2qa4 s VAL 151 N -3.94 3.22 0.19 0.00 1.01 -0.92 -4.98 120.40 114.97 2qa4 s VAL 151 Ca -0.04 -1.73 -0.12 0.00 0.00 0.00 0.00 61.98 60.09 2qa4 s VAL 151 Cb 0.09 -3.05 0.09 0.00 0.00 0.00 0.00 36.38 33.51 2qa4 s VAL 151 CO 0.29 -0.44 1.81 -0.65 0.00 0.00 0.00 175.10 176.12 2qa4 h PRO 152 N 8.04 0.60 -0.33 2.72 0.11 -1.80 -2.02 132.00 139.33 2qa4 h PRO 152 Ca -0.17 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.00 2qa4 h PRO 152 Cb 1.06 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 2qa4 h PRO 152 CO 0.63 0.40 0.26 0.77 -0.21 0.00 0.00 178.00 179.84 2qa4 h SER 153 N 0.62 0.00 -3.50 -2.05 0.02 -1.84 -3.37 113.55 103.43 2qa4 h SER 153 Ca 0.23 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.58 2qa4 h SER 153 Cb 0.08 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.52 2qa4 h SER 153 CO -0.13 0.00 0.50 -0.69 -1.14 0.00 0.00 176.83 175.37 2qa4 s VAL 154 N -4.91 4.66 0.28 2.27 1.01 -0.76 -4.90 120.40 118.05 2qa4 s VAL 154 Ca -0.05 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.96 2qa4 s VAL 154 Cb 0.18 -4.27 0.24 0.00 0.00 0.00 0.00 36.38 32.52 2qa4 s VAL 154 CO 0.66 -0.47 1.92 -0.65 0.00 0.00 0.00 175.10 176.56 2qa4 h PRO 155 N 8.45 1.13 -7.16 2.72 0.11 -1.82 -3.45 132.00 131.98 2qa4 h PRO 155 Ca -0.24 -0.10 -0.51 0.00 0.11 0.00 0.00 66.00 65.26 2qa4 h PRO 155 Cb 1.09 -0.24 0.10 0.00 0.11 0.00 0.00 31.00 32.05 2qa4 h PRO 155 CO 0.95 0.79 0.40 -1.59 -0.21 0.00 0.00 178.00 178.34 2qa4 s LYS 156 N -5.85 2.94 0.00 1.05 -2.85 -1.26 -4.97 119.74 108.80 2qa4 s LYS 156 Ca -0.12 1.51 0.00 0.00 -1.00 0.00 0.00 55.97 56.37 2qa4 s LYS 156 Cb 0.17 -1.96 0.00 0.00 -2.06 0.00 0.00 37.83 33.99 2qa4 s LYS 156 CO 0.81 -1.16 0.00 1.63 0.10 0.00 0.00 175.35 176.73 2qa4 n LYS 157 N -2.03 0.82 -1.53 1.78 5.02 -1.26 -4.12 118.16 116.84 2qa4 n LYS 157 Ca 0.11 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.98 2qa4 n LYS 157 Cb 0.51 -0.94 -0.05 0.00 -0.02 0.00 0.00 35.03 34.53 2qa4 n LYS 157 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2qa4 n LYS 158 N -2.24 1.15 -1.60 1.97 4.81 -1.26 -4.41 118.16 116.58 2qa4 n LYS 158 Ca 0.00 0.20 -0.44 0.00 -0.87 0.00 0.00 58.31 57.19 2qa4 n LYS 158 Cb 0.44 -2.94 -0.01 0.00 0.02 0.00 0.00 35.03 32.53 2qa4 n LYS 158 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2qa4 n PRO 159 N 8.70 1.40 -3.19 1.64 -0.02 -1.26 -4.94 135.00 137.33 2qa4 n PRO 159 Ca 0.40 0.49 -0.45 0.00 -2.02 0.00 0.00 63.50 61.92 2qa4 n PRO 159 Cb 0.39 -1.87 -0.05 0.00 -0.02 0.00 0.00 33.50 31.94 2qa4 n PRO 159 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qa4 s ASP 160 N -0.54 6.19 0.29 2.55 1.01 -1.26 -4.85 116.67 120.06 2qa4 s ASP 160 Ca 0.58 -1.51 -0.27 0.00 0.71 0.00 0.00 52.55 52.07 2qa4 s ASP 160 Cb -0.69 -2.27 -0.10 0.00 1.01 0.00 0.00 42.92 40.87 2qa4 s ASP 160 CO 0.60 -1.00 0.92 -0.69 0.21 0.00 0.00 175.17 175.22 2qa4 s VAL 161 N 2.29 4.21 -0.24 -1.27 1.01 -1.26 -3.07 120.40 122.07 2qa4 s VAL 161 Ca 0.09 1.85 -0.28 0.00 0.00 0.00 0.00 61.98 63.64 2qa4 s VAL 161 Cb -0.26 -4.08 0.15 0.00 0.00 0.00 0.00 36.38 32.19 2qa4 s VAL 161 CO 0.06 0.24 1.15 0.00 0.00 0.00 0.00 175.10 176.55 2qa4 s MET 162 N -1.82 0.37 -0.25 2.72 0.00 0.25 -4.97 119.30 115.60 2qa4 s MET 162 Ca 0.47 0.23 -0.21 0.00 0.00 0.00 0.00 55.69 56.18 2qa4 s MET 162 Cb -0.20 0.18 -0.02 0.00 0.00 0.00 0.00 34.83 34.79 2qa4 s MET 162 CO 0.25 -0.09 0.65 -2.00 0.00 0.00 0.00 175.02 173.84 2qa4 s GLU 163 N -0.54 4.12 0.20 3.16 2.12 -1.26 -0.96 118.70 125.55 2qa4 s GLU 163 Ca 0.03 0.60 0.08 0.00 0.36 0.00 0.00 54.97 56.04 2qa4 s GLU 163 Cb -0.03 -3.65 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 2qa4 s GLU 163 CO -0.05 -0.42 0.04 0.99 -0.54 0.00 0.00 175.26 175.27 2qa4 s THR 164 N 2.54 3.84 -0.11 -1.70 2.01 -0.93 -4.94 115.64 116.35 2qa4 s THR 164 Ca 0.27 -1.49 -0.07 0.00 0.31 0.00 0.00 61.69 60.71 2qa4 s THR 164 Cb -0.15 -2.98 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 2qa4 s THR 164 CO 0.08 -0.20 0.16 -0.60 -0.69 0.00 0.00 174.62 173.37 2qa4 s ARG 165 N -3.24 3.47 -0.19 4.92 3.52 -1.26 -1.50 118.95 124.67 2qa4 s ARG 165 Ca 0.29 -0.10 -0.03 0.00 -0.13 0.00 0.00 55.73 55.76 2qa4 s ARG 165 Cb -0.09 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.10 2qa4 s ARG 165 CO 0.20 0.77 -0.05 0.08 -0.81 0.00 0.00 175.30 175.49 2qa4 s VAL 166 N -1.04 3.44 -0.05 7.11 1.01 -0.27 -0.38 120.40 130.21 2qa4 s VAL 166 Ca 0.16 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 2qa4 s VAL 166 Cb -0.12 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.76 2qa4 s VAL 166 CO 0.05 0.45 0.09 -0.83 0.00 0.00 0.00 175.10 174.86 2qa4 s GLY 167 N 1.07 0.12 0.00 4.51 0.00 -0.82 -4.19 107.32 108.01 2qa4 s GLY 167 Ca 0.01 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.09 2qa4 s GLY 167 CO -0.00 1.25 0.00 0.61 0.00 0.00 0.00 173.10 174.95 2qa4 n GLY 168 N 4.91 5.44 0.00 0.20 0.00 -1.26 -3.05 105.19 111.44 2qa4 n GLY 168 Ca -0.12 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2qa4 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa4 n GLY 169 N 2.07 -1.60 3.46 -0.02 0.00 -1.22 -4.51 105.19 103.37 2qa4 n GLY 169 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2qa4 n GLY 169 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qa4 n SER 170 N 0.00 0.35 0.08 1.61 3.41 -1.26 -4.97 113.62 112.84 2qa4 n SER 170 Ca 0.00 -1.57 -0.21 0.00 -0.26 0.00 0.00 58.87 56.83 2qa4 n SER 170 Cb 0.00 -0.84 -0.12 0.00 -0.26 0.00 0.00 64.21 62.99 2qa4 n SER 170 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2qa4 h VAL 171 N -1.44 1.30 0.23 -3.33 -1.51 -2.00 -3.21 116.25 106.30 2qa4 h VAL 171 Ca -0.37 -2.46 -0.00 0.00 -1.23 0.00 0.00 66.70 62.64 2qa4 h VAL 171 Cb 1.07 2.64 -0.01 0.00 -2.13 0.00 0.00 31.29 32.86 2qa4 h VAL 171 CO 0.28 0.75 -0.18 0.28 -1.23 0.00 0.00 177.57 177.47 2qa4 h SER 172 N 0.28 -0.46 -0.41 4.19 0.02 -1.99 -1.62 113.55 113.56 2qa4 h SER 172 Ca -0.17 0.04 0.08 0.00 -0.84 0.00 0.00 61.79 60.90 2qa4 h SER 172 Cb 1.87 0.15 -0.08 0.00 0.14 0.00 0.00 62.40 64.48 2qa4 h SER 172 CO 0.23 -0.28 -0.12 0.44 -1.14 0.00 0.00 176.83 175.96 2qa4 h ASP 173 N -0.42 -0.42 1.29 3.07 3.32 -1.96 -0.83 116.42 120.47 2qa4 h ASP 173 Ca -0.01 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2qa4 h ASP 173 Cb 0.37 0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2qa4 h ASP 173 CO -0.01 -0.15 0.00 0.08 -1.72 0.00 0.00 179.24 177.44 2qa4 h ARG 174 N -0.02 0.00 -0.19 3.56 0.11 -1.53 0.70 114.38 117.01 2qa4 h ARG 174 Ca 0.20 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.22 2qa4 h ARG 174 Cb 0.32 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.40 2qa4 h ARG 174 CO -0.43 0.00 -0.12 1.25 0.10 0.00 0.00 179.97 180.77 2qa4 h LEU 175 N 0.00 0.44 0.20 0.08 6.46 -0.16 -0.23 115.31 122.09 2qa4 h LEU 175 Ca 0.00 -0.43 -0.01 0.00 -0.12 0.00 0.00 57.88 57.32 2qa4 h LEU 175 Cb 0.65 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.46 2qa4 h LEU 175 CO 0.00 0.78 -0.10 0.44 -0.62 0.00 0.00 178.44 178.94 2qa4 h ASP 176 N 0.10 -0.23 -0.98 1.25 3.32 -1.16 -0.27 116.42 118.44 2qa4 h ASP 176 Ca 0.04 -0.27 0.27 0.00 0.02 0.00 0.00 57.03 57.09 2qa4 h ASP 176 Cb 0.62 0.06 -0.13 0.00 0.22 0.00 0.00 39.33 40.10 2qa4 h ASP 176 CO 0.03 0.19 0.54 -0.74 -1.72 0.00 0.00 179.24 177.55 2qa4 h HIS 177 N -0.70 0.91 0.72 4.55 2.76 -0.89 0.20 115.15 122.70 2qa4 h HIS 177 Ca -0.03 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.14 2qa4 h HIS 177 Cb 0.49 -0.24 0.01 0.00 1.55 0.00 0.00 27.41 29.21 2qa4 h HIS 177 CO 0.05 -0.05 -0.35 0.00 -1.30 0.00 0.00 177.93 176.28 2qa4 h ALA 178 N 1.78 -0.97 -0.61 5.26 0.00 -0.84 -2.07 119.26 121.82 2qa4 h ALA 178 Ca 0.66 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.44 2qa4 h ALA 178 Cb 1.36 0.37 -0.11 0.00 0.00 0.00 0.00 17.79 19.42 2qa4 h ALA 178 CO -0.54 -0.96 -0.44 -0.07 0.00 0.00 0.00 179.25 177.24 2qa4 h LEU 179 N -1.13 -1.51 -0.17 0.00 3.38 0.11 -2.09 115.31 113.89 2qa4 h LEU 179 Ca -0.10 0.25 0.03 0.00 0.09 0.00 0.00 57.88 58.15 2qa4 h LEU 179 Cb 0.77 0.69 -0.03 0.00 0.09 0.00 0.00 40.66 42.18 2qa4 h LEU 179 CO 0.16 -0.33 -0.01 0.44 0.09 0.00 0.00 178.44 178.79 2qa4 h ASP 180 N -0.21 -0.10 -0.78 -0.43 3.32 -0.80 0.12 116.42 117.53 2qa4 h ASP 180 Ca 0.18 0.04 0.17 0.00 0.02 0.00 0.00 57.03 57.44 2qa4 h ASP 180 Cb 0.56 0.08 -0.11 0.00 0.22 0.00 0.00 39.33 40.08 2qa4 h ASP 180 CO -0.71 -0.03 0.27 0.40 -1.72 0.00 0.00 179.24 177.46 2qa4 h ILE 181 N 0.04 0.56 0.28 0.35 2.04 -0.71 -2.90 117.51 117.17 2qa4 h ILE 181 Ca 0.08 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2qa4 h ILE 181 Cb 0.11 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2qa4 h ILE 181 CO -0.15 0.07 -0.14 0.58 0.00 0.00 0.00 178.15 178.51 2qa4 h VAL 182 N 0.37 0.00 -0.37 1.67 2.07 -0.90 -2.71 116.25 116.38 2qa4 h VAL 182 Ca 0.45 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.90 2qa4 h VAL 182 Cb 0.75 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.45 2qa4 h VAL 182 CO -0.47 0.00 -0.08 -0.62 0.02 0.00 0.00 177.57 176.42 2qa4 n GLU 183 N -3.43 -0.03 0.00 1.57 -0.58 -0.02 -2.00 120.64 116.15 2qa4 n GLU 183 Ca -0.05 0.57 0.00 0.00 -0.42 0.00 0.00 57.16 57.27 2qa4 n GLU 183 Cb 0.15 -0.86 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 2qa4 n GLU 183 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2qa4 n ASP 184 N -4.57 0.00 0.00 1.62 8.00 -1.20 -4.84 116.55 115.55 2qa4 n ASP 184 Ca 0.06 0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.89 2qa4 n ASP 184 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 2qa4 n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qa4 n GLY 185 N -0.35 0.93 3.03 0.44 0.00 -0.84 -4.86 105.19 103.54 2qa4 n GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qa4 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa4 n GLY 186 N 0.00 1.89 3.71 -0.02 0.00 -1.02 -4.54 105.19 105.21 2qa4 n GLY 186 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2qa4 n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qa4 s GLU 187 N -0.01 4.15 0.14 1.61 2.12 -1.26 -0.91 118.70 124.54 2qa4 s GLU 187 Ca 0.00 2.54 -0.15 0.00 0.36 0.00 0.00 54.97 57.72 2qa4 s GLU 187 Cb 0.00 -3.29 0.03 0.00 0.26 0.00 0.00 34.13 31.13 2qa4 s GLU 187 CO 0.00 -0.76 0.40 -3.38 -0.54 0.00 0.00 175.26 170.98 2qa4 s HIS 188 N 1.77 -0.13 0.15 5.30 -3.43 -0.98 -4.97 115.29 113.00 2qa4 s HIS 188 Ca 0.76 -0.21 0.00 0.00 -0.80 0.00 0.00 55.06 54.82 2qa4 s HIS 188 Cb -0.47 0.24 -0.04 0.00 -1.43 0.00 0.00 32.58 30.88 2qa4 s HIS 188 CO 0.33 -0.73 0.04 0.00 -2.00 0.00 0.00 174.74 172.38 2qa4 s ALA 189 N -3.83 1.08 0.24 -1.38 0.00 -1.26 -1.94 121.76 114.67 2qa4 s ALA 189 Ca 0.05 -1.53 -0.15 0.00 0.00 0.00 0.00 51.96 50.33 2qa4 s ALA 189 Cb 0.02 0.74 0.29 0.00 0.00 0.00 0.00 23.12 24.17 2qa4 s ALA 189 CO -0.10 -0.42 1.57 1.98 0.00 0.00 0.00 175.76 178.79 2qa4 h MET 190 N 2.78 -0.02 -0.96 0.00 4.05 -1.94 0.68 114.93 119.52 2qa4 h MET 190 Ca -0.36 0.00 0.18 0.00 -0.28 0.00 0.00 59.70 59.25 2qa4 h MET 190 Cb 1.20 0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.92 2qa4 h MET 190 CO 0.61 -0.02 0.61 -0.91 0.23 0.00 0.00 176.91 177.43 2qa4 h ASN 191 N -0.03 0.66 -0.36 1.39 2.35 -1.97 0.53 115.58 118.16 2qa4 h ASN 191 Ca 0.37 0.07 0.09 0.00 -0.55 0.00 0.00 56.30 56.28 2qa4 h ASN 191 Cb 0.62 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 2qa4 h ASN 191 CO -0.93 0.27 0.26 0.44 -1.65 0.00 0.00 177.43 175.82 2qa4 h ASP 192 N 0.66 0.07 0.00 5.81 3.32 -0.03 -3.32 116.42 122.94 2qa4 h ASP 192 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2qa4 h ASP 192 Cb 0.93 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2qa4 h ASP 192 CO -0.28 0.04 -0.55 -0.38 -1.72 0.00 0.00 179.24 176.36 2qa4 n ILE 193 N -4.45 1.14 -2.50 0.35 5.41 0.47 -4.98 119.36 114.80 2qa4 n ILE 193 Ca 0.05 0.25 -0.23 0.00 1.00 0.00 0.00 62.75 63.82 2qa4 n ILE 193 Cb 0.39 -1.96 0.06 0.00 -0.71 0.00 0.00 39.64 37.42 2qa4 n ILE 193 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2qa4 s PHE 194 N -2.30 2.60 -0.16 1.39 0.40 0.16 -5.10 117.98 114.96 2qa4 s PHE 194 Ca -0.16 0.06 -0.11 0.00 -0.60 0.00 0.00 56.93 56.12 2qa4 s PHE 194 Cb 0.02 -2.94 0.05 0.00 0.51 0.00 0.00 43.02 40.66 2qa4 s PHE 194 CO 0.23 -1.21 0.40 0.50 0.70 0.00 0.00 175.22 175.84 2qa4 s ARG 195 N -4.99 0.41 0.43 0.44 6.06 -1.26 -4.25 118.95 115.80 2qa4 s ARG 195 Ca 0.60 0.69 -0.23 0.00 -2.50 0.00 0.00 55.73 54.29 2qa4 s ARG 195 Cb -0.09 0.07 -0.11 0.00 0.06 0.00 0.00 34.95 34.88 2qa4 s ARG 195 CO 0.41 -0.12 0.83 0.00 -2.50 0.00 0.00 175.30 173.93 2qa4 n ALA 196 N 3.73 -0.46 0.00 6.12 0.00 -1.26 -2.15 120.51 126.49 2qa4 n ALA 196 Ca -0.20 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2qa4 n ALA 196 Cb 0.56 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.04 2qa4 n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa4 n GLY 197 N 1.42 3.01 3.49 0.00 0.00 0.22 -1.82 105.19 111.51 2qa4 n GLY 197 Ca 0.11 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 2qa4 n GLY 197 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qa4 n GLU 198 N 0.00 -1.07 -4.31 1.61 1.02 -0.91 -4.11 120.64 112.87 2qa4 n GLU 198 Ca 0.00 -0.27 -0.34 0.00 -0.02 0.00 0.00 57.16 56.53 2qa4 n GLU 198 Cb 0.00 -2.08 -0.11 0.00 -0.02 0.00 0.00 31.44 29.23 2qa4 n GLU 198 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2qa4 s TYR 199 N -2.45 3.09 0.21 -0.32 1.51 -1.26 -1.62 117.35 116.51 2qa4 s TYR 199 Ca 0.63 -0.15 0.04 0.00 -1.01 0.00 0.00 57.07 56.58 2qa4 s TYR 199 Cb -0.21 -1.96 -0.05 0.00 -0.11 0.00 0.00 41.96 39.63 2qa4 s TYR 199 CO 0.64 0.08 -0.03 0.00 -1.11 0.00 0.00 175.55 175.12 2qa4 s ALA 200 N 0.19 1.75 -0.19 3.71 0.00 0.19 -1.61 121.76 125.80 2qa4 s ALA 200 Ca -0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.21 2qa4 s ALA 200 Cb -0.13 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 2qa4 s ALA 200 CO 0.02 -0.21 -0.05 -0.51 0.00 0.00 0.00 175.76 175.02 2qa4 s ASP 201 N -3.28 4.45 -0.40 0.00 1.01 0.34 0.17 116.67 118.96 2qa4 s ASP 201 Ca 0.26 -0.30 -0.12 0.00 0.71 0.00 0.00 52.55 53.10 2qa4 s ASP 201 Cb 0.05 -1.75 0.04 0.00 1.01 0.00 0.00 42.92 42.27 2qa4 s ASP 201 CO 0.07 0.05 0.25 -0.69 0.21 0.00 0.00 175.17 175.07 2qa4 s VAL 202 N 1.04 4.70 0.08 -1.27 1.01 -0.96 -2.44 120.40 122.56 2qa4 s VAL 202 Ca 0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 2qa4 s VAL 202 Cb -0.15 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 2qa4 s VAL 202 CO 0.00 -0.34 0.32 0.00 0.00 0.00 0.00 175.10 175.09 2qa4 s ALA 203 N 1.56 3.83 -0.06 5.51 0.00 -0.89 -1.69 121.76 130.01 2qa4 s ALA 203 Ca 0.03 -0.58 -0.30 0.00 0.00 0.00 0.00 51.96 51.11 2qa4 s ALA 203 Cb -0.20 -2.09 0.11 0.00 0.00 0.00 0.00 23.12 20.94 2qa4 s ALA 203 CO 0.06 0.67 0.96 0.20 0.00 0.00 0.00 175.76 177.66 2qa4 s GLY 204 N -2.12 -0.41 -0.54 0.00 0.00 0.10 -2.17 107.32 102.18 2qa4 s GLY 204 Ca 0.35 1.26 -0.21 0.00 0.00 0.00 0.00 44.72 46.11 2qa4 s GLY 204 CO 0.21 0.46 0.77 0.14 0.00 0.00 0.00 173.10 174.68 2qa4 s VAL 205 N -2.73 4.66 0.99 1.40 1.01 -1.26 -1.69 120.40 122.78 2qa4 s VAL 205 Ca 0.05 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 2qa4 s VAL 205 Cb -0.01 -4.43 -0.12 0.00 0.00 0.00 0.00 36.38 31.82 2qa4 s VAL 205 CO -0.07 -0.99 -0.68 0.35 0.00 0.00 0.00 175.10 173.71 2qa4 n THR 206 N 5.83 0.00 -1.76 3.92 -2.24 0.21 -3.70 114.28 116.54 2qa4 n THR 206 Ca -0.04 -0.41 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 2qa4 n THR 206 Cb 0.46 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2qa4 n THR 206 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2qa4 s LYS 207 N -2.26 4.14 0.08 -0.78 1.02 -1.26 -1.94 119.74 118.75 2qa4 s LYS 207 Ca 0.42 2.57 -0.24 0.00 0.02 0.00 0.00 55.97 58.74 2qa4 s LYS 207 Cb -0.16 -3.15 -0.06 0.00 -0.52 0.00 0.00 37.83 33.94 2qa4 s LYS 207 CO 0.79 -0.74 0.74 0.20 -0.92 0.00 0.00 175.35 175.42 2qa4 s GLY 208 N 1.35 2.82 -0.02 -3.33 0.00 -1.26 -2.99 107.32 103.88 2qa4 s GLY 208 Ca 0.75 0.27 0.03 0.00 0.00 0.00 0.00 44.72 45.77 2qa4 s GLY 208 CO 0.32 0.95 0.98 0.28 0.00 0.00 0.00 173.10 175.63 2qa4 n LYS 209 N 2.31 2.35 0.00 2.90 5.02 -0.67 -4.88 118.16 125.19 2qa4 n LYS 209 Ca -0.04 -1.57 0.00 0.00 -2.02 0.00 0.00 58.31 54.68 2qa4 n LYS 209 Cb 0.50 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.49 2qa4 n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qa4 n GLY 210 N -0.59 0.01 3.75 0.72 0.00 -1.23 -4.73 105.19 103.12 2qa4 n GLY 210 Ca 0.03 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 2qa4 n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qa4 s THR 211 N 0.00 4.06 0.03 2.61 -4.23 -1.26 -2.07 115.64 114.79 2qa4 s THR 211 Ca 0.00 1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 62.49 2qa4 s THR 211 Cb 0.00 -4.27 -0.02 0.00 1.34 0.00 0.00 72.50 69.55 2qa4 s THR 211 CO 0.00 0.44 0.00 -1.10 -0.54 0.00 0.00 174.62 173.43 2qa4 s GLN 212 N -0.99 0.47 1.37 3.99 -1.52 0.24 -4.96 119.66 118.27 2qa4 s GLN 212 Ca 0.43 -0.84 -0.22 0.00 -1.95 0.00 0.00 55.36 52.78 2qa4 s GLN 212 Cb -0.26 0.17 0.35 0.00 -0.22 0.00 0.00 33.01 33.05 2qa4 s GLN 212 CO 0.33 -0.09 0.97 0.20 -0.25 0.00 0.00 175.29 176.44 2qa4 s GLY 213 N -2.08 1.45 0.26 3.09 0.00 -1.26 -2.32 107.32 106.45 2qa4 s GLY 213 Ca -0.06 -0.82 0.13 0.00 0.00 0.00 0.00 44.72 43.97 2qa4 s GLY 213 CO -0.05 0.16 1.48 -2.55 0.00 0.00 0.00 173.10 172.14 2qa4 h PRO 214 N -3.24 0.00 0.21 2.90 0.11 -1.81 -1.10 132.00 129.07 2qa4 h PRO 214 Ca -0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2qa4 h PRO 214 Cb 1.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.44 2qa4 h PRO 214 CO 0.30 0.62 -0.11 0.28 -0.21 0.00 0.00 178.00 178.88 2qa4 h VAL 215 N 0.00 0.76 0.00 3.15 2.07 -1.81 1.22 116.25 121.64 2qa4 h VAL 215 Ca -0.01 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2qa4 h VAL 215 Cb 1.35 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2qa4 h VAL 215 CO 0.08 0.00 -0.41 0.50 0.02 0.00 0.00 177.57 177.76 2qa4 h LYS 216 N -0.30 0.00 0.00 1.57 3.64 -1.89 -0.62 116.57 118.96 2qa4 h LYS 216 Ca -0.02 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 2qa4 h LYS 216 Cb 0.24 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2qa4 h LYS 216 CO 0.03 0.35 -1.34 -0.09 -2.27 0.00 0.00 179.45 176.14 2qa4 h ARG 217 N 0.00 0.00 0.00 1.90 2.43 -0.91 -3.40 114.38 114.40 2qa4 h ARG 217 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2qa4 h ARG 217 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2qa4 h ARG 217 CO 0.05 0.31 0.00 0.91 -1.51 0.00 0.00 179.97 179.73 2qa4 n TRP 218 N -2.92 0.00 -3.17 2.20 7.02 0.42 -5.00 117.44 115.99 2qa4 n TRP 218 Ca -0.09 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.24 2qa4 n TRP 218 Cb 0.83 0.00 0.06 0.00 -2.42 0.00 0.00 31.31 29.78 2qa4 n TRP 218 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2qa4 n GLY 219 N 0.03 -0.07 3.97 6.99 0.00 -0.24 -3.36 105.19 112.50 2qa4 n GLY 219 Ca 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 2qa4 n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qa4 s VAL 220 N -3.22 2.37 0.13 1.61 -7.23 -1.23 -4.86 120.40 107.96 2qa4 s VAL 220 Ca 0.30 -0.51 -0.05 0.00 -1.81 0.00 0.00 61.98 59.91 2qa4 s VAL 220 Cb -0.13 -2.87 -0.05 0.00 0.56 0.00 0.00 36.38 33.89 2qa4 s VAL 220 CO 0.49 0.00 0.37 -1.10 -0.31 0.00 0.00 175.10 174.55 2qa4 s GLN 221 N -5.06 3.62 0.90 4.82 -0.21 -1.26 -4.61 119.66 117.86 2qa4 s GLN 221 Ca 0.61 -0.08 -0.12 0.00 0.02 0.00 0.00 55.36 55.79 2qa4 s GLN 221 Cb -0.09 -2.87 0.13 0.00 1.00 0.00 0.00 33.01 31.18 2qa4 s GLN 221 CO 0.42 0.48 1.12 0.15 -2.12 0.00 0.00 175.29 175.35 2qa4 s LYS 222 N -2.57 1.22 0.57 2.91 1.02 -1.26 -4.77 119.74 116.86 2qa4 s LYS 222 Ca 0.40 0.42 -0.19 0.00 0.02 0.00 0.00 55.97 56.62 2qa4 s LYS 222 Cb -0.12 -1.84 -0.05 0.00 -0.52 0.00 0.00 37.83 35.30 2qa4 s LYS 222 CO 0.24 -2.17 1.17 1.03 -0.92 0.00 0.00 175.35 174.70 2qa4 s ARG 223 N -5.19 3.15 0.03 1.68 1.81 -0.12 -5.00 118.95 115.30 2qa4 s ARG 223 Ca 0.63 1.70 0.00 0.00 -1.72 0.00 0.00 55.73 56.35 2qa4 s ARG 223 Cb -0.15 -1.97 0.00 0.00 -0.45 0.00 0.00 34.95 32.38 2qa4 s ARG 223 CO 0.54 -1.04 0.02 1.63 -0.68 0.00 0.00 175.30 175.78 2qa4 n LYS 224 N -1.49 1.41 0.00 3.54 4.76 -1.26 -4.48 118.16 120.64 2qa4 n LYS 224 Ca 0.13 -0.18 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 2qa4 n LYS 224 Cb 0.50 0.02 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 2qa4 n LYS 224 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qa4 n GLY 225 N 4.65 0.70 0.19 0.72 0.00 -1.26 -0.97 105.19 109.21 2qa4 n GLY 225 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2qa4 n GLY 225 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qa4 h LYS 226 N 0.00 0.11 -0.95 1.61 3.64 -2.01 -3.10 116.57 115.87 2qa4 h LYS 226 Ca 0.00 -0.05 0.21 0.00 -1.27 0.00 0.00 60.65 59.55 2qa4 h LYS 226 Cb 0.00 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.74 2qa4 h LYS 226 CO 0.00 0.50 0.62 0.45 -2.27 0.00 0.00 179.45 178.75 2qa4 h HIS 227 N 0.09 0.65 0.00 1.91 3.86 -1.43 -1.96 115.15 118.27 2qa4 h HIS 227 Ca 0.01 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.19 2qa4 h HIS 227 Cb 0.77 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 29.03 2qa4 h HIS 227 CO 0.01 0.15 -0.22 0.00 0.86 0.00 0.00 177.93 178.73 2qa4 h ALA 228 N 1.61 1.02 -0.41 2.45 0.00 -0.98 -2.54 119.26 120.42 2qa4 h ALA 228 Ca 0.51 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qa4 h ALA 228 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2qa4 h ALA 228 CO -0.23 0.27 0.00 0.54 0.00 0.00 0.00 179.25 179.83 2qa4 n ARG 229 N -3.38 3.67 0.02 0.00 1.74 -0.74 -4.37 116.66 113.60 2qa4 n ARG 229 Ca 0.00 -2.20 0.11 0.00 -0.77 0.00 0.00 57.85 54.99 2qa4 n ARG 229 Cb 0.42 -2.01 -0.05 0.00 -1.02 0.00 0.00 32.46 29.81 2qa4 n ARG 229 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qa4 n GLN 230 N 0.47 0.32 0.00 5.56 1.13 -0.96 -4.95 117.38 118.95 2qa4 n GLN 230 Ca 0.19 -0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.21 2qa4 n GLN 230 Cb 0.89 -1.57 0.00 0.00 0.11 0.00 0.00 30.24 29.68 2qa4 n GLN 230 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qa4 n GLY 231 N 1.36 1.22 2.85 1.08 0.00 -1.26 -5.09 105.19 105.35 2qa4 n GLY 231 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2qa4 n GLY 231 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qa4 s TRP 232 N -1.86 -0.13 0.00 1.61 0.51 -1.26 -5.03 118.94 112.77 2qa4 s TRP 232 Ca 0.00 0.48 0.00 0.00 -2.12 0.00 0.00 56.10 54.46 2qa4 s TRP 232 Cb 0.00 -0.21 0.00 0.00 -0.81 0.00 0.00 33.47 32.45 2qa4 s TRP 232 CO 0.00 -0.21 0.00 0.54 -0.51 0.00 0.00 176.95 176.77 2qa4 n ARG 233 N 4.77 0.64 -2.45 4.98 1.74 -1.26 -4.40 116.66 120.68 2qa4 n ARG 233 Ca -0.15 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.80 2qa4 n ARG 233 Cb 0.51 -0.78 0.03 0.00 -1.02 0.00 0.00 32.46 31.20 2qa4 n ARG 233 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qa4 n ARG 234 N -1.85 2.61 -3.87 5.56 1.74 -1.26 -0.95 116.66 118.64 2qa4 n ARG 234 Ca 0.00 -3.85 -0.12 0.00 -0.77 0.00 0.00 57.85 53.11 2qa4 n ARG 234 Cb 0.28 -1.91 -0.13 0.00 -1.02 0.00 0.00 32.46 29.67 2qa4 n ARG 234 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2qa4 s ARG 235 N -3.64 0.06 1.05 5.56 1.70 -1.26 -4.55 118.95 117.87 2qa4 s ARG 235 Ca 0.39 -0.02 -0.15 0.00 -0.47 0.00 0.00 55.73 55.49 2qa4 s ARG 235 Cb 0.38 0.03 0.12 0.00 -0.57 0.00 0.00 34.95 34.90 2qa4 s ARG 235 CO -0.01 -0.01 0.45 0.44 -1.08 0.00 0.00 175.30 175.09 2qa4 n ILE 236 N 2.93 0.00 -0.04 4.99 -5.35 -1.26 -4.86 119.36 115.76 2qa4 n ILE 236 Ca -0.13 -0.25 -0.13 0.00 -0.27 0.00 0.00 62.75 61.97 2qa4 n ILE 236 Cb 0.59 -0.72 -0.07 0.00 -1.74 0.00 0.00 39.64 37.70 2qa4 n ILE 236 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2qa4 h GLY 237 N -1.97 0.27 -3.03 3.28 0.00 -2.01 -3.47 103.07 96.14 2qa4 h GLY 237 Ca -0.50 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 46.50 2qa4 h GLY 237 CO 0.39 0.23 -0.27 0.54 0.00 0.00 0.00 176.54 177.43 2qa4 s ASN 238 N -5.93 0.00 0.00 0.19 4.22 -1.26 -5.02 114.94 107.15 2qa4 s ASN 238 Ca -0.15 -0.61 0.26 0.00 -2.14 0.00 0.00 52.86 50.23 2qa4 s ASN 238 Cb 0.05 0.40 0.66 0.00 1.28 0.00 0.00 41.25 43.64 2qa4 s ASN 238 CO 0.72 -0.81 1.51 0.18 -2.04 0.00 0.00 177.10 176.67 2qa4 n LEU 239 N -0.14 0.69 0.00 3.54 4.77 -1.26 -5.02 117.00 119.58 2qa4 n LEU 239 Ca -0.14 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2qa4 n LEU 239 Cb 0.63 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2qa4 n LEU 239 CO 0.21 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2qa4 n GLY 240 N 1.43 -2.25 3.96 -0.72 0.00 -1.26 -4.41 105.19 101.94 2qa4 n GLY 240 Ca 0.09 -1.32 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 2qa4 n GLY 240 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qa4 s PRO 241 N -1.97 0.97 0.01 1.61 0.04 -1.26 -5.03 135.00 129.36 2qa4 s PRO 241 Ca 0.00 -0.77 -0.05 0.00 0.04 0.00 0.00 61.00 60.22 2qa4 s PRO 241 Cb 0.00 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 2qa4 s PRO 241 CO 0.00 -2.08 0.95 2.35 0.04 0.00 0.00 177.00 178.27 2qa4 h TRP 242 N -1.22 -0.17 -3.67 0.56 2.91 -2.01 -3.43 115.95 108.92 2qa4 h TRP 242 Ca -0.40 -0.00 -0.68 0.00 1.13 0.00 0.00 58.89 58.93 2qa4 h TRP 242 Cb 1.24 0.06 -0.19 0.00 -0.51 0.00 0.00 29.16 29.75 2qa4 h TRP 242 CO -0.85 -0.10 -0.70 -0.80 -1.03 0.00 0.00 178.44 174.96 2qa4 s ASN 243 N -2.43 4.61 0.24 2.65 0.01 -1.26 -2.44 114.94 116.32 2qa4 s ASN 243 Ca -0.03 -0.04 -0.31 0.00 -0.71 0.00 0.00 52.86 51.78 2qa4 s ASN 243 Cb 0.00 -1.18 -0.11 0.00 0.41 0.00 0.00 41.25 40.38 2qa4 s ASN 243 CO 0.08 0.35 1.54 -2.16 -1.51 0.00 0.00 177.10 175.40 2qa4 s PRO 244 N -0.75 4.20 -0.92 -0.60 0.04 -1.26 -5.03 135.00 130.68 2qa4 s PRO 244 Ca 0.11 2.42 -0.21 0.00 0.04 0.00 0.00 61.00 63.37 2qa4 s PRO 244 Cb -0.11 -3.09 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 2qa4 s PRO 244 CO 0.01 -0.56 1.97 0.43 0.04 0.00 0.00 177.00 178.90 2qa4 n SER 245 N 2.86 2.81 -3.61 6.66 7.64 -1.02 -4.70 113.62 124.27 2qa4 n SER 245 Ca 0.10 -2.71 -0.02 0.00 1.01 0.00 0.00 58.87 57.24 2qa4 n SER 245 Cb 0.39 -1.25 -0.02 0.00 -1.01 0.00 0.00 64.21 62.32 2qa4 n SER 245 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qa4 s ARG 246 N 4.79 0.30 -0.24 1.43 1.70 -1.26 -5.13 118.95 120.54 2qa4 s ARG 246 Ca 0.56 -0.13 -0.12 0.00 -0.47 0.00 0.00 55.73 55.57 2qa4 s ARG 246 Cb 0.13 0.13 -0.05 0.00 -0.57 0.00 0.00 34.95 34.59 2qa4 s ARG 246 CO 0.09 -0.14 0.23 0.08 -1.08 0.00 0.00 175.30 174.48 2qa4 s VAL 247 N -2.38 5.31 1.14 4.99 1.01 -1.26 -4.80 120.40 124.41 2qa4 s VAL 247 Ca 0.11 0.32 -0.19 0.00 0.00 0.00 0.00 61.98 62.22 2qa4 s VAL 247 Cb 0.01 -3.57 0.27 0.00 0.00 0.00 0.00 36.38 33.09 2qa4 s VAL 247 CO -0.04 0.30 1.20 -0.13 0.00 0.00 0.00 175.10 176.43 2qa4 s ARG 248 N 1.25 -0.78 -0.08 2.72 0.52 -1.26 -4.99 118.95 116.34 2qa4 s ARG 248 Ca 0.10 -0.28 0.21 0.00 -0.52 0.00 0.00 55.73 55.25 2qa4 s ARG 248 Cb -0.14 -1.67 -0.31 0.00 0.52 0.00 0.00 34.95 33.35 2qa4 s ARG 248 CO 0.06 -3.38 0.36 -1.13 0.02 0.00 0.00 175.30 171.23 2qa4 n SER 249 N -4.48 0.06 0.09 0.23 3.41 -1.26 -4.03 113.62 107.64 2qa4 n SER 249 Ca 0.15 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.84 2qa4 n SER 249 Cb 0.60 1.71 0.39 0.00 -0.26 0.00 0.00 64.21 66.64 2qa4 n SER 249 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qa4 n THR 250 N -2.39 1.21 -3.20 6.66 -2.24 -1.26 -4.57 114.28 108.49 2qa4 n THR 250 Ca -0.12 0.49 -0.39 0.00 -2.27 0.00 0.00 64.05 61.76 2qa4 n THR 250 Cb 0.73 -1.44 -0.06 0.00 -2.10 0.00 0.00 70.33 67.47 2qa4 n THR 250 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2qa4 s VAL 251 N -3.29 5.11 -0.13 2.28 0.11 -1.26 -5.02 120.40 118.21 2qa4 s VAL 251 Ca 0.01 1.13 -0.29 0.00 -2.93 0.00 0.00 61.98 59.90 2qa4 s VAL 251 Cb 0.06 -3.90 -0.06 0.00 -1.53 0.00 0.00 36.38 30.95 2qa4 s VAL 251 CO 0.21 0.25 1.94 -2.16 -3.33 0.00 0.00 175.10 172.00 2qa4 s PRO 252 N 1.03 3.71 0.35 1.54 0.04 -1.26 -4.98 135.00 135.42 2qa4 s PRO 252 Ca 0.29 2.12 0.03 0.00 0.04 0.00 0.00 61.00 63.49 2qa4 s PRO 252 Cb -0.16 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.15 2qa4 s PRO 252 CO 0.12 -1.43 0.11 -0.65 0.04 0.00 0.00 177.00 175.19 2qa4 s GLN 253 N 5.13 1.73 0.49 4.56 -0.21 -1.26 -4.89 119.66 125.21 2qa4 s GLN 253 Ca 0.87 -2.00 -0.24 0.00 0.02 0.00 0.00 55.36 54.01 2qa4 s GLN 253 Cb -0.34 -0.55 -0.07 0.00 1.00 0.00 0.00 33.01 33.05 2qa4 s GLN 253 CO 0.35 -0.37 1.38 -1.14 -2.12 0.00 0.00 175.29 173.40 2qa4 s GLN 254 N -3.82 3.46 0.00 2.91 -0.44 -1.26 -4.60 119.66 115.91 2qa4 s GLN 254 Ca 0.31 2.31 0.00 0.00 -2.50 0.00 0.00 55.36 55.48 2qa4 s GLN 254 Cb 0.05 -2.48 0.00 0.00 -1.64 0.00 0.00 33.01 28.95 2qa4 s GLN 254 CO 0.15 -0.96 0.00 0.41 0.50 0.00 0.00 175.29 175.39 2qa4 n GLY 255 N 0.64 -0.61 3.74 2.59 0.00 -0.98 -4.98 105.19 105.59 2qa4 n GLY 255 Ca 0.07 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 2qa4 n GLY 255 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qa4 s GLN 256 N -0.42 4.59 0.01 1.61 -0.44 -1.26 -0.59 119.66 123.15 2qa4 s GLN 256 Ca 0.00 1.23 0.04 0.00 -2.50 0.00 0.00 55.36 54.13 2qa4 s GLN 256 Cb 0.00 -3.36 -0.01 0.00 -1.64 0.00 0.00 33.01 28.00 2qa4 s GLN 256 CO 0.00 0.29 -0.13 0.95 0.50 0.00 0.00 175.29 176.90 2qa4 s THR 257 N -0.16 1.02 0.18 -0.34 -4.23 -0.88 -4.62 115.64 106.61 2qa4 s THR 257 Ca 0.41 -0.71 0.00 0.00 -1.18 0.00 0.00 61.69 60.22 2qa4 s THR 257 Cb -0.22 -0.89 0.00 0.00 1.34 0.00 0.00 72.50 72.73 2qa4 s THR 257 CO 0.26 0.17 0.00 0.61 -0.54 0.00 0.00 174.62 175.12 2qa4 n GLY 258 N 2.44 -2.51 3.14 3.99 0.00 -1.26 -1.67 105.19 109.32 2qa4 n GLY 258 Ca -0.16 -1.35 -0.18 0.00 0.00 0.00 0.00 46.02 44.34 2qa4 n GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qa4 n TYR 259 N -2.93 -2.23 -4.36 1.61 9.36 -0.82 -4.56 117.16 113.24 2qa4 n TYR 259 Ca -0.02 0.80 -0.25 0.00 3.32 0.00 0.00 57.90 61.75 2qa4 n TYR 259 Cb 0.22 -4.26 -0.09 0.00 -0.63 0.00 0.00 39.34 34.58 2qa4 n TYR 259 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 2qa4 s HIS 260 N -3.26 2.51 0.10 2.98 3.76 -1.26 -2.28 115.29 117.84 2qa4 s HIS 260 Ca 0.40 -0.27 -0.17 0.00 -0.15 0.00 0.00 55.06 54.87 2qa4 s HIS 260 Cb -0.18 -1.17 -0.07 0.00 1.11 0.00 0.00 32.58 32.28 2qa4 s HIS 260 CO 0.58 0.58 0.55 -1.14 -0.85 0.00 0.00 174.74 174.47 2qa4 s GLN 261 N -3.16 4.09 -0.03 1.40 0.74 -1.26 -0.62 119.66 120.81 2qa4 s GLN 261 Ca 0.27 0.62 -0.02 0.00 0.05 0.00 0.00 55.36 56.28 2qa4 s GLN 261 Cb -0.07 -3.11 0.02 0.00 1.10 0.00 0.00 33.01 30.94 2qa4 s GLN 261 CO 0.15 0.58 0.07 1.03 -0.55 0.00 0.00 175.29 176.57 2qa4 s ARG 262 N -1.46 0.06 -0.92 1.67 1.81 -0.68 -4.95 118.95 114.49 2qa4 s ARG 262 Ca 0.32 0.15 -0.01 0.00 -1.72 0.00 0.00 55.73 54.47 2qa4 s ARG 262 Cb -0.17 -0.04 0.26 0.00 -0.45 0.00 0.00 34.95 34.55 2qa4 s ARG 262 CO 0.19 -0.06 1.04 2.41 -0.68 0.00 0.00 175.30 178.20 2qa4 n THR 263 N 3.41 3.78 -1.62 0.02 -1.04 -1.26 -0.72 114.28 116.85 2qa4 n THR 263 Ca -0.17 -5.44 -0.45 0.00 -2.04 0.00 0.00 64.05 55.94 2qa4 n THR 263 Cb 0.57 -2.23 -0.04 0.00 -1.82 0.00 0.00 70.33 66.81 2qa4 n THR 263 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2qa4 n GLU 264 N 1.65 2.17 -2.36 -2.82 2.13 -0.68 -4.81 120.64 115.92 2qa4 n GLU 264 Ca 0.25 0.73 -0.39 0.00 0.66 0.00 0.00 57.16 58.41 2qa4 n GLU 264 Cb 0.37 -2.91 -0.03 0.00 0.27 0.00 0.00 31.44 29.14 2qa4 n GLU 264 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2qa4 s LEU 265 N 5.91 4.34 -1.23 4.31 1.02 -1.26 -2.26 118.68 129.51 2qa4 s LEU 265 Ca 0.96 2.34 -0.02 0.00 0.02 0.00 0.00 54.13 57.43 2qa4 s LEU 265 Cb -0.53 -3.85 -0.01 0.00 0.02 0.00 0.00 46.19 41.82 2qa4 s LEU 265 CO 0.44 -0.45 0.84 0.59 0.02 0.00 0.00 176.35 177.78 2qa4 n ASN 266 N 0.54 -2.27 -4.73 2.29 4.13 -1.24 -4.98 115.26 109.00 2qa4 n ASN 266 Ca 0.02 -0.74 -0.39 0.00 1.68 0.00 0.00 54.58 55.14 2qa4 n ASN 266 Cb 0.46 -4.55 -0.05 0.00 -1.54 0.00 0.00 39.78 34.10 2qa4 n ASN 266 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2qa4 s LYS 267 N -5.58 4.42 0.20 3.52 -0.14 0.45 -4.79 119.74 117.82 2qa4 s LYS 267 Ca 0.07 0.85 -0.21 0.00 -1.36 0.00 0.00 55.97 55.32 2qa4 s LYS 267 Cb -0.02 -3.42 -0.08 0.00 -1.68 0.00 0.00 37.83 32.64 2qa4 s LYS 267 CO 0.78 0.16 0.74 0.50 -0.76 0.00 0.00 175.35 176.76 2qa4 s ARG 268 N 0.49 4.35 -0.41 1.68 3.52 -1.26 0.57 118.95 127.89 2qa4 s ARG 268 Ca 0.36 0.96 -0.15 0.00 -0.13 0.00 0.00 55.73 56.77 2qa4 s ARG 268 Cb -0.18 -3.00 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 2qa4 s ARG 268 CO 0.18 0.45 0.30 -0.51 -0.81 0.00 0.00 175.30 174.91 2qa4 s LEU 269 N -1.71 5.10 -0.01 -0.88 1.43 -0.64 -2.18 118.68 119.79 2qa4 s LEU 269 Ca 0.41 -0.90 -0.24 0.00 -1.03 0.00 0.00 54.13 52.37 2qa4 s LEU 269 Cb -0.19 -2.16 -0.16 0.00 0.03 0.00 0.00 46.19 43.72 2qa4 s LEU 269 CO 0.22 -0.45 1.09 0.40 0.23 0.00 0.00 176.35 177.85 2qa4 h ILE 270 N 5.64 0.61 -2.77 -0.59 1.08 -1.72 0.64 117.51 120.40 2qa4 h ILE 270 Ca -0.27 -0.69 -0.05 0.00 -0.39 0.00 0.00 64.86 63.46 2qa4 h ILE 270 Cb 1.12 0.92 -0.15 0.00 -3.07 0.00 0.00 36.82 35.63 2qa4 h ILE 270 CO 0.73 0.12 0.08 -0.62 -0.69 0.00 0.00 178.15 177.77 2qa4 s ASP 271 N -5.10 -0.48 -0.28 1.72 2.15 -1.26 -4.28 116.67 109.15 2qa4 s ASP 271 Ca -0.13 0.17 0.01 0.00 0.43 0.00 0.00 52.55 53.03 2qa4 s ASP 271 Cb 0.02 0.52 0.08 0.00 -0.30 0.00 0.00 42.92 43.24 2qa4 s ASP 271 CO 0.49 -0.76 0.02 -0.63 -0.17 0.00 0.00 175.17 174.12 2qa4 s ILE 272 N -2.64 1.44 0.00 4.11 1.01 -1.26 -0.81 121.20 123.04 2qa4 s ILE 272 Ca -0.04 -1.49 0.00 0.00 0.00 0.00 0.00 60.65 59.12 2qa4 s ILE 272 Cb -0.00 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.55 2qa4 s ILE 272 CO -0.03 -0.40 0.00 0.61 0.00 0.00 0.00 174.94 175.12 2qa4 n GLY 273 N 4.65 7.19 3.59 6.18 0.00 -1.26 -4.98 105.19 120.57 2qa4 n GLY 273 Ca -0.05 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.84 2qa4 n GLY 273 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qa4 s GLU 274 N 1.24 0.90 0.00 1.61 2.12 -1.26 -2.10 118.70 121.20 2qa4 s GLU 274 Ca 0.00 0.74 0.00 0.00 0.36 0.00 0.00 54.97 56.07 2qa4 s GLU 274 Cb 0.00 0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.82 2qa4 s GLU 274 CO 0.00 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 2qa4 n GLY 275 N 2.09 -0.87 1.84 -1.50 0.00 -0.83 -4.69 105.19 101.23 2qa4 n GLY 275 Ca -0.16 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 43.59 2qa4 n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qa4 n ASP 276 N 0.00 3.74 -0.29 1.61 5.75 -1.26 -2.42 116.55 123.68 2qa4 n ASP 276 Ca 0.00 -3.52 0.05 0.00 -0.01 0.00 0.00 54.79 51.31 2qa4 n ASP 276 Cb 0.00 -0.75 0.19 0.00 -1.03 0.00 0.00 41.12 39.53 2qa4 n ASP 276 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2qa4 h GLU 277 N 1.49 0.67 0.02 0.11 3.07 -1.89 -3.15 114.58 114.90 2qa4 h GLU 277 Ca 0.40 -0.04 -0.19 0.00 -0.50 0.00 0.00 59.36 59.04 2qa4 h GLU 277 Cb 2.36 -0.15 0.02 0.00 -0.84 0.00 0.00 28.75 30.14 2qa4 h GLU 277 CO 0.79 0.44 -0.75 -1.00 -1.40 0.00 0.00 179.01 177.09 2qa4 h PRO 278 N 0.69 0.47 -5.16 2.33 0.13 -1.92 -3.47 132.00 125.08 2qa4 h PRO 278 Ca 0.42 -0.54 -0.57 0.00 -0.87 0.00 0.00 66.00 64.44 2qa4 h PRO 278 Cb 0.49 0.16 0.10 0.00 0.13 0.00 0.00 31.00 31.88 2qa4 h PRO 278 CO -0.30 1.18 -0.49 2.41 -0.23 0.00 0.00 178.00 180.57 2qa4 n THR 279 N -4.11 1.61 -3.43 1.56 -1.04 -1.19 -4.69 114.28 102.99 2qa4 n THR 279 Ca -0.11 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.05 61.25 2qa4 n THR 279 Cb 0.75 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.25 2qa4 n THR 279 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2qa4 s VAL 280 N -0.91 4.70 0.22 12.58 1.01 -1.26 -4.64 120.40 132.10 2qa4 s VAL 280 Ca 0.55 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 2qa4 s VAL 280 Cb -0.78 -3.69 -0.08 0.00 0.00 0.00 0.00 36.38 31.83 2qa4 s VAL 280 CO 0.49 -0.39 1.12 -1.81 0.00 0.00 0.00 175.10 174.51 2qa4 s ASP 281 N -4.09 7.22 0.00 3.32 1.11 0.89 -2.96 116.67 122.16 2qa4 s ASP 281 Ca 0.41 2.20 0.00 0.00 0.18 0.00 0.00 52.55 55.34 2qa4 s ASP 281 Cb -0.10 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.28 2qa4 s ASP 281 CO 0.34 -0.23 0.00 0.61 1.18 0.00 0.00 175.17 177.07 2qa4 n GLY 282 N 1.75 2.03 0.00 0.21 0.00 -1.26 -4.01 105.19 103.91 2qa4 n GLY 282 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2qa4 n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa4 n GLY 283 N 0.00 3.33 3.55 -0.02 0.00 -1.16 -4.96 105.19 105.94 2qa4 n GLY 283 Ca 0.00 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 43.97 2qa4 n GLY 283 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qa4 n PHE 284 N -0.39 1.48 -1.47 1.61 0.99 0.11 -4.76 117.46 115.02 2qa4 n PHE 284 Ca 0.00 0.09 -0.51 0.00 -0.00 0.00 0.00 57.45 57.04 2qa4 n PHE 284 Cb 0.00 -2.64 -0.04 0.00 -1.00 0.00 0.00 39.48 35.80 2qa4 n PHE 284 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2qa4 n VAL 285 N 7.90 1.28 -0.99 -4.37 0.31 -1.26 0.34 118.33 121.54 2qa4 n VAL 285 Ca 0.38 -0.32 -0.05 0.00 -0.01 0.00 0.00 64.34 64.34 2qa4 n VAL 285 Cb 0.49 -0.24 -0.02 0.00 -0.91 0.00 0.00 33.84 33.16 2qa4 n VAL 285 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2qa4 n ASN 286 N 1.81 -4.66 0.03 4.52 3.02 -1.26 -4.61 115.26 114.10 2qa4 n ASN 286 Ca 0.17 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 2qa4 n ASN 286 Cb 0.21 -3.19 0.00 0.00 -0.61 0.00 0.00 39.78 36.19 2qa4 n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qa4 n TYR 287 N -1.74 -0.33 0.00 3.10 9.36 0.50 -4.92 117.16 123.14 2qa4 n TYR 287 Ca -0.05 0.06 0.00 0.00 3.32 0.00 0.00 57.90 61.23 2qa4 n TYR 287 Cb 0.44 0.21 0.00 0.00 -0.63 0.00 0.00 39.34 39.36 2qa4 n TYR 287 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2qa4 n GLY 288 N 2.70 0.59 3.65 2.98 0.00 0.15 -4.70 105.19 110.56 2qa4 n GLY 288 Ca 0.00 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 2qa4 n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qa4 s GLU 289 N -1.65 2.77 -0.10 1.61 2.02 -1.26 0.03 118.70 122.12 2qa4 s GLU 289 Ca 0.00 -0.59 -0.01 0.00 0.02 0.00 0.00 54.97 54.39 2qa4 s GLU 289 Cb 0.00 -2.65 -0.03 0.00 0.10 0.00 0.00 34.13 31.55 2qa4 s GLU 289 CO 0.00 0.64 -0.04 0.08 0.02 0.00 0.00 175.26 175.96 2qa4 s VAL 290 N -0.99 3.95 -0.30 2.63 1.01 -1.26 -4.65 120.40 120.80 2qa4 s VAL 290 Ca 0.17 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 2qa4 s VAL 290 Cb -0.11 -2.66 0.19 0.00 0.00 0.00 0.00 36.38 33.79 2qa4 s VAL 290 CO 0.07 0.57 0.89 -0.62 0.00 0.00 0.00 175.10 176.01 2qa4 s ASP 291 N -0.51 -0.82 0.00 3.32 2.15 -1.26 -4.40 116.67 115.16 2qa4 s ASP 291 Ca 0.08 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.37 2qa4 s ASP 291 Cb -0.12 1.60 0.00 0.00 -0.30 0.00 0.00 42.92 44.10 2qa4 s ASP 291 CO 0.02 -0.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.48 2qa4 n GLY 292 N 5.36 0.77 3.69 2.66 0.00 -1.01 -4.77 105.19 111.88 2qa4 n GLY 292 Ca 0.01 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2qa4 n GLY 292 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qa4 n PRO 293 N 0.00 2.80 -0.86 1.61 -0.02 -1.26 -1.96 135.00 135.32 2qa4 n PRO 293 Ca 0.00 1.02 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 2qa4 n PRO 293 Cb 0.00 -2.92 0.00 0.00 -0.02 0.00 0.00 33.50 30.56 2qa4 n PRO 293 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2qa4 n TYR 294 N 5.74 -0.06 -3.64 6.00 0.18 -0.89 -1.55 117.16 122.94 2qa4 n TYR 294 Ca 0.18 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.86 2qa4 n TYR 294 Cb 0.37 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.27 2qa4 n TYR 294 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2qa4 s THR 295 N -1.65 0.00 -0.21 -3.48 2.01 -0.47 -4.05 115.64 107.79 2qa4 s THR 295 Ca 0.00 0.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.94 2qa4 s THR 295 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.48 2qa4 s THR 295 CO 0.00 0.00 0.03 -0.76 -0.69 0.00 0.00 174.62 173.20 2qa4 s LEU 296 N 0.45 3.40 -0.11 4.42 1.43 0.01 -2.03 118.68 126.24 2qa4 s LEU 296 Ca 0.01 -0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.95 2qa4 s LEU 296 Cb -0.05 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 2qa4 s LEU 296 CO -0.06 0.06 -0.09 -0.69 0.23 0.00 0.00 176.35 175.81 2qa4 s VAL 297 N 1.02 3.49 -0.00 -1.59 1.01 -0.48 -1.90 120.40 121.95 2qa4 s VAL 297 Ca 0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 2qa4 s VAL 297 Cb -0.14 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 2qa4 s VAL 297 CO 0.02 0.55 1.34 -0.75 0.00 0.00 0.00 175.10 176.26 2qa4 s LYS 298 N -0.13 4.31 1.55 2.72 2.20 -0.93 0.24 119.74 129.70 2qa4 s LYS 298 Ca 0.01 1.89 0.00 0.00 -0.36 0.00 0.00 55.97 57.51 2qa4 s LYS 298 Cb -0.13 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.65 2qa4 s LYS 298 CO 0.03 -0.52 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 2qa4 n GLY 299 N 3.55 -1.62 3.92 5.54 0.00 -0.72 -4.56 105.19 111.30 2qa4 n GLY 299 Ca 0.12 -1.45 -0.27 0.00 0.00 0.00 0.00 46.02 44.42 2qa4 n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qa4 s SER 300 N -4.00 5.83 -0.01 1.61 1.04 -1.26 -3.58 113.70 113.32 2qa4 s SER 300 Ca 0.00 0.76 -0.02 0.00 0.48 0.00 0.00 55.95 57.17 2qa4 s SER 300 Cb 0.00 -1.87 -0.00 0.00 0.10 0.00 0.00 66.02 64.25 2qa4 s SER 300 CO 0.00 -0.88 0.04 -0.69 0.98 0.00 0.00 173.24 172.68 2qa4 s VAL 301 N -2.88 0.03 0.79 5.02 1.01 -1.26 -5.04 120.40 118.07 2qa4 s VAL 301 Ca 0.51 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 62.14 2qa4 s VAL 301 Cb -0.10 -0.13 0.05 0.00 0.00 0.00 0.00 36.38 36.20 2qa4 s VAL 301 CO 0.45 -0.12 1.05 -0.81 0.00 0.00 0.00 175.10 175.67 2qa4 n PRO 302 N 2.68 0.24 -0.25 2.72 -0.04 -1.26 -4.86 135.00 134.23 2qa4 n PRO 302 Ca -0.15 0.15 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 2qa4 n PRO 302 Cb 0.59 -2.31 -0.02 0.00 -0.04 0.00 0.00 33.50 31.72 2qa4 n PRO 302 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qa4 n GLY 303 N 0.82 -2.72 3.08 0.55 0.00 -1.24 -4.76 105.19 100.91 2qa4 n GLY 303 Ca 0.13 -1.38 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 2qa4 n GLY 303 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qa4 n PRO 304 N -2.42 -0.35 -2.18 1.61 -0.04 -1.26 -4.69 135.00 125.67 2qa4 n PRO 304 Ca -0.02 -1.97 -0.41 0.00 -0.04 0.00 0.00 63.50 61.06 2qa4 n PRO 304 Cb 0.12 -0.73 -0.03 0.00 -0.04 0.00 0.00 33.50 32.82 2qa4 n PRO 304 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qa4 s ASP 305 N -4.46 6.85 0.00 3.54 1.01 -1.26 -2.93 116.67 119.42 2qa4 s ASP 305 Ca 0.55 2.54 0.00 0.00 0.71 0.00 0.00 52.55 56.35 2qa4 s ASP 305 Cb -0.02 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.28 2qa4 s ASP 305 CO 0.37 -0.51 0.00 0.29 0.21 0.00 0.00 175.17 175.53 2qa4 n LYS 306 N 1.71 0.00 -3.15 8.23 5.02 0.58 -4.98 118.16 125.58 2qa4 n LYS 306 Ca 0.03 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 2qa4 n LYS 306 Cb 0.42 -0.41 -0.06 0.00 -0.02 0.00 0.00 35.03 34.96 2qa4 n LYS 306 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2qa4 s ARG 307 N -0.79 4.22 0.02 1.97 3.52 -1.15 -4.73 118.95 122.02 2qa4 s ARG 307 Ca 0.00 0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 56.11 2qa4 s ARG 307 Cb 0.00 -2.94 -0.05 0.00 -1.56 0.00 0.00 34.95 30.40 2qa4 s ARG 307 CO 0.00 0.44 1.28 -1.17 -0.81 0.00 0.00 175.30 175.03 2qa4 s LEU 308 N -1.86 4.33 -0.09 -0.88 2.96 -1.26 -2.24 118.68 119.64 2qa4 s LEU 308 Ca 0.41 2.03 0.02 0.00 -0.22 0.00 0.00 54.13 56.37 2qa4 s LEU 308 Cb -0.17 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 42.96 2qa4 s LEU 308 CO 0.21 -0.59 -0.15 0.68 -1.32 0.00 0.00 176.35 175.18 2qa4 s VAL 309 N 1.70 1.40 0.09 1.68 -7.23 -0.53 -4.63 120.40 112.88 2qa4 s VAL 309 Ca 0.60 -0.61 -0.06 0.00 -1.81 0.00 0.00 61.98 60.10 2qa4 s VAL 309 Cb -0.30 -1.27 -0.05 0.00 0.56 0.00 0.00 36.38 35.32 2qa4 s VAL 309 CO 0.27 0.42 0.35 -0.13 -0.31 0.00 0.00 175.10 175.70 2qa4 s ARG 310 N 0.75 3.63 0.12 4.82 0.52 -0.92 -2.69 118.95 125.19 2qa4 s ARG 310 Ca -0.12 -0.04 0.06 0.00 -0.52 0.00 0.00 55.73 55.11 2qa4 s ARG 310 Cb -0.16 -2.94 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 2qa4 s ARG 310 CO 0.02 0.54 -0.02 -0.06 0.02 0.00 0.00 175.30 175.80 2qa4 s PHE 311 N -1.51 2.89 -0.26 -0.53 0.40 -0.82 -2.10 117.98 116.05 2qa4 s PHE 311 Ca 0.36 -0.09 -0.15 0.00 -0.60 0.00 0.00 56.93 56.45 2qa4 s PHE 311 Cb -0.13 -1.46 0.08 0.00 0.51 0.00 0.00 43.02 42.02 2qa4 s PHE 311 CO 0.21 0.48 0.64 0.50 0.70 0.00 0.00 175.22 177.75 2qa4 s ARG 312 N -2.51 0.66 -0.08 0.44 3.00 -1.02 -1.40 118.95 118.03 2qa4 s ARG 312 Ca 0.25 1.13 -0.34 0.00 -1.00 0.00 0.00 55.73 55.77 2qa4 s ARG 312 Cb -0.11 0.12 -0.12 0.00 0.00 0.00 0.00 34.95 34.85 2qa4 s ARG 312 CO 0.17 -0.15 1.86 -2.30 0.00 0.00 0.00 175.30 174.88 2qa4 n PRO 313 N 4.21 2.13 -1.51 5.12 -0.02 -1.26 0.13 135.00 143.79 2qa4 n PRO 313 Ca -0.20 0.78 -0.59 0.00 -2.02 0.00 0.00 63.50 61.47 2qa4 n PRO 313 Cb 0.58 -2.61 -0.08 0.00 -0.02 0.00 0.00 33.50 31.36 2qa4 n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qa4 n ALA 314 N 6.37 -2.05 0.19 3.55 0.00 -0.63 -4.69 120.51 123.25 2qa4 n ALA 314 Ca 0.22 0.49 0.12 0.00 0.00 0.00 0.00 53.44 54.27 2qa4 n ALA 314 Cb 0.29 -1.70 0.08 0.00 0.00 0.00 0.00 19.45 18.12 2qa4 n ALA 314 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2qa4 h VAL 315 N 3.88 0.00 -2.19 0.00 -1.51 -1.91 -3.38 116.25 111.14 2qa4 h VAL 315 Ca -0.43 -0.96 -0.58 0.00 -1.23 0.00 0.00 66.70 63.51 2qa4 h VAL 315 Cb 1.27 1.65 -0.39 0.00 -2.13 0.00 0.00 31.29 31.69 2qa4 h VAL 315 CO 0.78 0.00 -0.96 -2.11 -1.23 0.00 0.00 177.57 174.06 2qa4 n ARG 316 N -2.79 0.97 -2.90 5.19 1.85 -1.26 -4.97 116.66 112.75 2qa4 n ARG 316 Ca 0.02 -3.54 -0.34 0.00 -1.00 0.00 0.00 57.85 52.98 2qa4 n ARG 316 Cb 0.53 -1.57 -0.07 0.00 -1.05 0.00 0.00 32.46 30.31 2qa4 n ARG 316 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2qa4 s PRO 317 N -1.13 4.28 -0.21 2.89 0.05 -1.26 -4.84 135.00 134.77 2qa4 s PRO 317 Ca 0.35 1.06 0.06 0.00 0.05 0.00 0.00 61.00 62.52 2qa4 s PRO 317 Cb 0.12 -2.47 -0.17 0.00 0.05 0.00 0.00 34.50 32.03 2qa4 s PRO 317 CO -0.12 0.13 -0.13 0.09 0.05 0.00 0.00 177.00 177.03 2qa4 n ASN 318 N -0.12 1.76 -4.86 6.66 3.02 -1.26 -5.00 115.26 115.46 2qa4 n ASN 318 Ca 0.04 -0.09 -0.27 0.00 -0.03 0.00 0.00 54.58 54.23 2qa4 n ASN 318 Cb 0.52 0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.66 2qa4 n ASN 318 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2qa4 s ASP 319 N -5.92 5.88 0.23 6.41 1.01 -1.26 -5.09 116.67 117.93 2qa4 s ASP 319 Ca -0.25 0.02 -0.30 0.00 0.71 0.00 0.00 52.55 52.74 2qa4 s ASP 319 Cb 0.07 -1.65 -0.09 0.00 1.01 0.00 0.00 42.92 42.26 2qa4 s ASP 319 CO 0.59 0.08 1.05 -1.58 0.21 0.00 0.00 175.17 175.52 2qa4 s GLN 320 N -3.03 4.68 0.03 8.23 2.00 -1.26 -4.96 119.66 125.35 2qa4 s GLN 320 Ca 0.32 1.68 -0.30 0.00 -2.00 0.00 0.00 55.36 55.07 2qa4 s GLN 320 Cb -0.11 -3.25 -0.08 0.00 0.80 0.00 0.00 33.01 30.37 2qa4 s GLN 320 CO 0.25 0.25 1.81 -2.14 -0.50 0.00 0.00 175.29 174.96 2qa4 s PRO 321 N -1.00 4.16 -0.97 1.67 0.02 -1.26 -4.93 135.00 132.69 2qa4 s PRO 321 Ca 0.45 2.45 -0.10 0.00 0.02 0.00 0.00 61.00 63.82 2qa4 s PRO 321 Cb -0.29 -3.93 0.25 0.00 0.02 0.00 0.00 34.50 30.55 2qa4 s PRO 321 CO 0.36 -0.87 0.93 1.03 -0.33 0.00 0.00 177.00 178.13 2qa4 s ARG 322 N 3.75 3.85 0.89 5.54 0.52 -1.26 -4.96 118.95 127.28 2qa4 s ARG 322 Ca 0.81 -2.93 -0.16 0.00 -0.52 0.00 0.00 55.73 52.93 2qa4 s ARG 322 Cb -0.40 -4.43 -0.08 0.00 0.52 0.00 0.00 34.95 30.56 2qa4 s ARG 322 CO 0.36 -1.26 -0.22 1.28 0.02 0.00 0.00 175.30 175.48 2qa4 n LEU 323 N 3.15 -3.26 -1.73 2.53 4.77 -1.26 -4.31 117.00 116.88 2qa4 n LEU 323 Ca 0.19 0.33 -0.02 0.00 -0.03 0.00 0.00 56.01 56.48 2qa4 n LEU 323 Cb 0.42 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 2qa4 n LEU 323 CO 0.40 -4.85 -0.02 0.47 -1.33 0.00 0.00 177.39 172.06 2qa4 n ASP 324 N 1.56 -0.34 -4.76 -1.43 9.92 -0.76 -4.82 116.55 115.92 2qa4 n ASP 324 Ca 0.03 -0.03 -0.37 0.00 -0.53 0.00 0.00 54.79 53.89 2qa4 n ASP 324 Cb 0.53 -0.10 0.01 0.00 -0.64 0.00 0.00 41.12 40.92 2qa4 n ASP 324 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 2qa4 s PRO 325 N -0.97 3.48 0.13 -0.24 0.02 -1.26 -4.95 135.00 131.20 2qa4 s PRO 325 Ca 0.02 1.86 -0.31 0.00 0.02 0.00 0.00 61.00 62.58 2qa4 s PRO 325 Cb -0.00 -2.26 -0.08 0.00 0.02 0.00 0.00 34.50 32.17 2qa4 s PRO 325 CO 0.06 -0.81 1.39 -2.00 -0.33 0.00 0.00 177.00 175.31 2qa4 s GLU 326 N -2.90 4.32 -0.38 5.54 2.12 -1.26 -4.98 118.70 121.16 2qa4 s GLU 326 Ca 0.68 2.09 -0.06 0.00 0.36 0.00 0.00 54.97 58.04 2qa4 s GLU 326 Cb -0.31 -3.23 0.07 0.00 0.26 0.00 0.00 34.13 30.92 2qa4 s GLU 326 CO 0.36 -0.42 0.18 0.08 -0.54 0.00 0.00 175.26 174.92 2qa4 s VAL 327 N 0.96 3.81 -0.06 3.70 1.01 -1.26 -3.71 120.40 124.84 2qa4 s VAL 327 Ca 0.64 -1.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 2qa4 s VAL 327 Cb -0.37 -3.32 -0.28 0.00 0.00 0.00 0.00 36.38 32.42 2qa4 s VAL 327 CO 0.31 -0.41 0.59 0.03 0.00 0.00 0.00 175.10 175.63 2qa4 h ARG 328 N 8.25 0.27 -1.58 2.72 3.08 -1.68 -3.48 114.38 121.96 2qa4 h ARG 328 Ca -0.21 -0.47 0.02 0.00 0.07 0.00 0.00 59.98 59.40 2qa4 h ARG 328 Cb 1.07 0.17 -0.23 0.00 0.08 0.00 0.00 29.97 31.07 2qa4 h ARG 328 CO 0.68 1.15 -0.28 -0.47 -1.07 0.00 0.00 179.97 179.97 2qa4 s TYR 329 N -2.58 -1.31 -0.34 3.04 5.04 -1.14 -4.95 117.35 115.10 2qa4 s TYR 329 Ca -0.16 1.70 -0.14 0.00 -2.44 0.00 0.00 57.07 56.04 2qa4 s TYR 329 Cb 0.06 0.50 -0.02 0.00 0.35 0.00 0.00 41.96 42.86 2qa4 s TYR 329 CO 0.82 -0.75 0.28 0.08 -1.34 0.00 0.00 175.55 174.64 2qa4 s VAL 330 N 2.79 5.25 0.19 3.14 1.01 -1.26 0.44 120.40 131.95 2qa4 s VAL 330 Ca 0.10 -0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.68 2qa4 s VAL 330 Cb -0.14 -3.74 -0.09 0.00 0.00 0.00 0.00 36.38 32.41 2qa4 s VAL 330 CO -0.19 -0.02 1.40 -0.55 0.00 0.00 0.00 175.10 175.75 2qa4 s SER 331 N 1.73 6.77 0.00 3.32 0.15 -0.81 -4.92 113.70 119.94 2qa4 s SER 331 Ca 0.08 2.48 0.06 0.00 0.70 0.00 0.00 55.95 59.27 2qa4 s SER 331 Cb -0.17 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 2qa4 s SER 331 CO 0.11 -0.65 0.49 0.59 1.20 0.00 0.00 173.24 174.98 2qa4 n ASN 332 N 3.09 0.97 -4.58 5.45 3.02 -1.26 -4.72 115.26 117.22 2qa4 n ASN 332 Ca 0.09 -0.98 -0.47 0.00 -0.03 0.00 0.00 54.58 53.18 2qa4 n ASN 332 Cb 0.41 0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 39.98 2qa4 n ASN 332 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2qa4 n GLU 333 N -0.29 1.22 -1.27 3.52 2.13 -1.26 -0.08 120.64 124.62 2qa4 n GLU 333 Ca 0.02 0.43 -0.37 0.00 0.66 0.00 0.00 57.16 57.90 2qa4 n GLU 333 Cb 0.12 -1.88 0.04 0.00 0.27 0.00 0.00 31.44 29.99 2qa4 n GLU 333 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2qa4 n SER 334 N 1.77 -2.52 0.07 4.31 2.88 -1.26 -4.44 113.62 114.43 2qa4 n SER 334 Ca 0.13 0.60 0.12 0.00 -1.33 0.00 0.00 58.87 58.39 2qa4 n SER 334 Cb 0.27 -1.03 0.17 0.00 -0.75 0.00 0.00 64.21 62.87 2qa4 n SER 334 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2qa4 h ASN 335 N -0.19 0.00 -3.67 -3.46 2.35 -1.86 -3.45 115.58 105.31 2qa4 h ASN 335 Ca -0.44 -0.17 -0.63 0.00 -0.55 0.00 0.00 56.30 54.50 2qa4 h ASN 335 Cb 1.39 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 39.58 2qa4 h ASN 335 CO 0.41 0.09 -0.54 -1.10 -1.65 0.00 0.00 177.43 174.63 2qa4 s GLN 336 N -3.18 3.93 0.00 0.81 -0.21 -1.26 -5.08 119.66 114.67 2qa4 s GLN 336 Ca 0.06 -0.34 0.00 0.00 0.02 0.00 0.00 55.36 55.10 2qa4 s GLN 336 Cb 0.13 -3.49 0.00 0.00 1.00 0.00 0.00 33.01 30.65 2qa4 s GLN 336 CO 0.72 -0.05 0.00 0.41 -2.12 0.00 0.00 175.29 174.25