#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r59 s GLU 2 N 0.00 3.63 -0.32 -0.52 2.56 -1.26 -4.93 118.70 117.86 2r59 s GLU 2 Ca 0.00 -1.65 -0.07 0.00 0.00 0.00 0.00 54.97 53.26 2r59 s GLU 2 Cb 0.00 -5.44 0.03 0.00 2.00 0.00 0.00 34.13 30.71 2r59 s GLU 2 CO 0.00 -2.56 0.09 -1.50 -0.56 0.00 0.00 175.26 170.74 2r59 s ILE 3 N 5.62 3.85 0.18 -3.70 2.07 -1.26 -5.10 121.20 122.87 2r59 s ILE 3 Ca 0.55 -0.96 0.05 0.00 -1.41 0.00 0.00 60.65 58.88 2r59 s ILE 3 Cb 0.02 -3.10 -0.04 0.00 0.13 0.00 0.00 42.46 39.47 2r59 s ILE 3 CO 0.05 -0.07 0.20 0.68 -1.91 0.00 0.00 174.94 173.89 2r59 s VAL 4 N 1.44 4.77 -0.66 4.00 -7.23 -1.26 -5.07 120.40 116.39 2r59 s VAL 4 Ca 0.00 -1.03 -0.22 0.00 -1.81 0.00 0.00 61.98 58.93 2r59 s VAL 4 Cb -0.19 -3.48 0.08 0.00 0.56 0.00 0.00 36.38 33.36 2r59 s VAL 4 CO 0.03 -0.16 0.92 -0.62 -0.31 0.00 0.00 175.10 174.95 2r59 s ASP 5 N -3.34 6.19 0.00 4.85 -1.08 -1.26 -4.88 116.67 117.15 2r59 s ASP 5 Ca 0.32 -1.11 0.21 0.00 -0.52 0.00 0.00 52.55 51.46 2r59 s ASP 5 Cb -0.10 -2.40 1.02 0.00 -1.46 0.00 0.00 42.92 39.98 2r59 s ASP 5 CO 0.25 -1.37 1.67 0.35 0.52 0.00 0.00 175.17 176.59 2r59 n THR 6 N 5.84 0.41 1.20 1.71 -2.24 -1.26 -1.68 114.28 118.25 2r59 n THR 6 Ca -0.04 0.10 0.13 0.00 -2.27 0.00 0.00 64.05 61.97 2r59 n THR 6 Cb 0.45 -0.75 0.26 0.00 -2.10 0.00 0.00 70.33 68.19 2r59 n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2r59 s SER 8 N -2.33 3.84 0.00 0.00 0.15 -0.68 -4.91 113.70 109.78 2r59 s SER 8 Ca 0.26 -0.26 0.21 0.00 0.70 0.00 0.00 55.95 56.86 2r59 s SER 8 Cb 0.19 -0.74 0.31 0.00 -1.71 0.00 0.00 66.02 64.07 2r59 s SER 8 CO 0.47 0.33 1.28 0.18 1.20 0.00 0.00 173.24 176.70 2r59 n LEU 9 N 2.26 3.11 -4.81 3.45 4.77 -1.26 -4.90 117.00 119.60 2r59 n LEU 9 Ca -0.17 -1.35 -0.30 0.00 -0.03 0.00 0.00 56.01 54.16 2r59 n LEU 9 Cb 0.52 -0.15 0.07 0.00 -2.33 0.00 0.00 43.42 41.53 2r59 n LEU 9 CO 0.25 0.63 0.71 0.00 -1.33 0.00 0.00 177.39 177.66 2r59 s ALA 10 N -1.50 2.48 0.21 -1.18 0.00 -1.26 -4.71 121.76 115.81 2r59 s ALA 10 Ca 0.31 -0.07 -0.32 0.00 0.00 0.00 0.00 51.96 51.88 2r59 s ALA 10 Cb 0.19 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 20.04 2r59 s ALA 10 CO 0.28 -1.46 1.38 0.43 0.00 0.00 0.00 175.76 176.38 2r59 n SER 11 N -3.27 2.50 -4.80 0.00 7.64 0.41 -4.94 113.62 111.16 2r59 n SER 11 Ca 0.07 1.14 -0.30 0.00 1.01 0.00 0.00 58.87 60.79 2r59 n SER 11 Cb 0.55 -1.38 0.10 0.00 -1.01 0.00 0.00 64.21 62.47 2r59 n SER 11 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2r59 s PRO 12 N -0.25 1.78 0.57 1.43 0.04 -1.26 -4.82 135.00 132.50 2r59 s PRO 12 Ca 0.71 0.51 0.38 0.00 0.04 0.00 0.00 61.00 62.64 2r59 s PRO 12 Cb -0.70 -1.89 2.03 0.00 0.04 0.00 0.00 34.50 33.97 2r59 s PRO 12 CO 0.49 -1.80 2.17 0.00 0.04 0.00 0.00 177.00 177.89 2r59 h ALA 13 N -1.22 1.00 0.00 8.56 0.00 -1.92 0.11 119.26 125.79 2r59 h ALA 13 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2r59 h ALA 13 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2r59 h ALA 13 CO 0.60 0.00 -0.08 -1.13 0.00 0.00 0.00 179.25 178.65 2r59 n SER 14 N -2.88 0.84 -0.12 0.00 3.41 -1.26 -3.82 113.62 109.79 2r59 n SER 14 Ca -0.02 0.52 -0.25 0.00 -0.26 0.00 0.00 58.87 58.86 2r59 n SER 14 Cb 0.09 -0.69 -0.11 0.00 -0.26 0.00 0.00 64.21 63.24 2r59 n SER 14 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2r59 n VAL 15 N -2.28 1.55 -3.54 -3.33 0.31 -0.01 -4.54 118.33 106.48 2r59 n VAL 15 Ca 0.05 -0.32 -0.13 0.00 -0.01 0.00 0.00 64.34 63.93 2r59 n VAL 15 Cb 0.44 -1.87 -0.05 0.00 -0.91 0.00 0.00 33.84 31.45 2r59 n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2r59 s ARG 17 N -1.47 0.93 0.13 0.00 0.52 -0.09 -4.01 118.95 114.95 2r59 s ARG 17 Ca -0.05 -0.12 -0.31 0.00 -0.52 0.00 0.00 55.73 54.73 2r59 s ARG 17 Cb -0.00 -0.94 -0.08 0.00 0.52 0.00 0.00 34.95 34.44 2r59 s ARG 17 CO 0.03 -0.10 1.42 0.99 0.02 0.00 0.00 175.30 177.66 2r59 s THR 18 N 1.03 3.18 -0.19 0.02 2.01 -1.26 -0.88 115.64 119.55 2r59 s THR 18 Ca -0.09 0.85 0.14 0.00 0.31 0.00 0.00 61.69 62.90 2r59 s THR 18 Cb -0.14 -3.55 -0.22 0.00 0.01 0.00 0.00 72.50 68.60 2r59 s THR 18 CO -0.00 0.07 0.02 0.29 -0.69 0.00 0.00 174.62 174.30 2r59 n LYS 19 N 3.92 0.88 -3.59 4.92 4.76 0.12 -4.39 118.16 124.77 2r59 n LYS 19 Ca 0.12 0.02 -0.17 0.00 -2.87 0.00 0.00 58.31 55.41 2r59 n LYS 19 Cb 0.42 -1.48 -0.07 0.00 -1.84 0.00 0.00 35.03 32.06 2r59 n LYS 19 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2r59 s HIS 20 N -2.46 -0.54 -0.07 2.13 2.46 -1.16 -1.85 115.29 113.80 2r59 s HIS 20 Ca -0.13 0.95 0.03 0.00 0.47 0.00 0.00 55.06 56.38 2r59 s HIS 20 Cb 0.06 0.32 0.01 0.00 -0.13 0.00 0.00 32.58 32.84 2r59 s HIS 20 CO 0.73 -0.54 -0.16 -1.17 -2.47 0.00 0.00 174.74 171.14 2r59 s LEU 21 N -1.12 1.80 -0.27 8.88 2.96 -0.65 -0.36 118.68 129.91 2r59 s LEU 21 Ca -0.11 -0.37 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 2r59 s LEU 21 Cb -0.02 -0.99 0.03 0.00 0.50 0.00 0.00 46.19 45.72 2r59 s LEU 21 CO 0.08 0.08 -0.03 -2.28 -1.32 0.00 0.00 176.35 172.88 2r59 s HIS 22 N 0.48 3.13 -0.23 5.38 5.65 0.04 -0.94 115.29 128.81 2r59 s HIS 22 Ca -0.14 -1.62 -0.07 0.00 0.25 0.00 0.00 55.06 53.48 2r59 s HIS 22 Cb -0.16 -2.09 -0.03 0.00 -1.18 0.00 0.00 32.58 29.13 2r59 s HIS 22 CO 0.05 -0.74 0.07 -1.17 -0.65 0.00 0.00 174.74 172.29 2r59 s LEU 23 N 1.31 3.56 -0.22 8.88 2.96 -0.39 -0.83 118.68 133.96 2r59 s LEU 23 Ca -0.01 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2r59 s LEU 23 Cb -0.18 -1.94 0.05 0.00 0.50 0.00 0.00 46.19 44.62 2r59 s LEU 23 CO -0.03 0.03 -0.11 -0.13 -1.32 0.00 0.00 176.35 174.79 2r59 s ARG 24 N 1.21 2.17 0.14 1.98 0.52 0.07 -1.19 118.95 123.84 2r59 s ARG 24 Ca 0.05 -0.99 -0.05 0.00 -0.52 0.00 0.00 55.73 54.21 2r59 s ARG 24 Cb -0.14 -2.58 -0.02 0.00 0.52 0.00 0.00 34.95 32.72 2r59 s ARG 24 CO 0.03 -0.46 0.16 0.00 0.02 0.00 0.00 175.30 175.06 2r59 s SER 26 N -2.99 1.57 -0.28 0.00 0.15 0.34 -0.93 113.70 111.55 2r59 s SER 26 Ca 0.19 -0.25 -0.14 0.00 0.70 0.00 0.00 55.95 56.44 2r59 s SER 26 Cb 0.05 -0.41 -0.03 0.00 -1.71 0.00 0.00 66.02 63.92 2r59 s SER 26 CO -0.00 0.10 0.35 -0.69 1.20 0.00 0.00 173.24 174.20 2r59 s VAL 27 N 0.11 5.19 -0.43 4.45 1.01 -0.20 -1.35 120.40 129.18 2r59 s VAL 27 Ca -0.03 0.43 -0.06 0.00 0.00 0.00 0.00 61.98 62.32 2r59 s VAL 27 Cb -0.09 -3.70 0.11 0.00 0.00 0.00 0.00 36.38 32.70 2r59 s VAL 27 CO 0.01 0.12 0.25 -0.62 0.00 0.00 0.00 175.10 174.87 2r59 s ASP 28 N 1.67 5.45 0.30 3.32 -1.08 0.33 -4.69 116.67 121.97 2r59 s ASP 28 Ca 0.13 -1.91 0.15 0.00 -0.52 0.00 0.00 52.55 50.40 2r59 s ASP 28 Cb -0.16 -1.91 0.40 0.00 -1.46 0.00 0.00 42.92 39.79 2r59 s ASP 28 CO 0.10 -0.59 1.60 -0.26 0.52 0.00 0.00 175.17 176.55 2r59 h PHE 29 N 8.23 0.00 -0.37 -5.34 0.04 -1.97 0.14 116.94 117.68 2r59 h PHE 29 Ca -0.17 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.47 2r59 h PHE 29 Cb 1.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.20 2r59 h PHE 29 CO 0.59 0.53 -0.27 1.79 -0.60 0.00 0.00 178.31 180.36 2r59 h THR 30 N 0.00 1.28 0.00 -1.55 1.35 -1.96 -3.19 112.91 108.84 2r59 h THR 30 Ca -0.01 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 2r59 h THR 30 Cb 1.13 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2r59 h THR 30 CO 0.07 0.47 -1.12 0.54 -0.25 0.00 0.00 175.52 175.23 2r59 n ARG 31 N -4.09 0.38 -3.10 4.72 1.74 -1.15 -4.97 116.66 110.19 2r59 n ARG 31 Ca -0.00 -0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 2r59 n ARG 31 Cb 0.46 -1.63 0.06 0.00 -1.02 0.00 0.00 32.46 30.34 2r59 n ARG 31 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2r59 n ARG 32 N -2.12 -5.00 -4.15 5.56 1.74 0.47 -4.70 116.66 108.47 2r59 n ARG 32 Ca 0.01 0.59 -0.15 0.00 -0.77 0.00 0.00 57.85 57.53 2r59 n ARG 32 Cb 0.47 -4.88 -0.12 0.00 -1.02 0.00 0.00 32.46 26.90 2r59 n ARG 32 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2r59 s THR 33 N -3.24 0.69 -0.18 0.55 -4.23 -0.97 -3.38 115.64 104.88 2r59 s THR 33 Ca 0.14 -0.93 -0.08 0.00 -1.18 0.00 0.00 61.69 59.63 2r59 s THR 33 Cb -0.06 -0.69 -0.04 0.00 1.34 0.00 0.00 72.50 73.05 2r59 s THR 33 CO 0.51 -0.20 0.08 -0.76 -0.54 0.00 0.00 174.62 173.72 2r59 s LEU 34 N -1.25 3.95 -0.07 4.79 1.02 -1.26 -0.51 118.68 125.35 2r59 s LEU 34 Ca -0.05 0.14 0.03 0.00 0.02 0.00 0.00 54.13 54.28 2r59 s LEU 34 Cb -0.08 -2.00 0.00 0.00 0.02 0.00 0.00 46.19 44.13 2r59 s LEU 34 CO 0.01 0.19 -0.18 -0.89 0.02 0.00 0.00 176.35 175.50 2r59 s THR 35 N 0.29 1.52 -0.33 5.49 2.01 -0.46 -1.11 115.64 123.06 2r59 s THR 35 Ca 0.05 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2r59 s THR 35 Cb -0.12 -1.34 0.00 0.00 0.01 0.00 0.00 72.50 71.05 2r59 s THR 35 CO -0.00 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.98 2r59 n GLY 36 N 3.51 -0.66 3.14 4.40 0.00 -0.52 -0.50 105.19 114.57 2r59 n GLY 36 Ca -0.20 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.28 2r59 n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2r59 s THR 37 N -4.00 1.26 -0.24 2.61 -4.23 0.22 -0.74 115.64 110.52 2r59 s THR 37 Ca 0.00 -0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 59.76 2r59 s THR 37 Cb 0.00 -1.06 0.03 0.00 1.34 0.00 0.00 72.50 72.81 2r59 s THR 37 CO 0.00 0.31 -0.08 0.00 -0.54 0.00 0.00 174.62 174.31 2r59 s ALA 38 N -0.44 2.65 -0.35 3.99 0.00 -0.64 -0.75 121.76 126.21 2r59 s ALA 38 Ca 0.06 -1.44 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 2r59 s ALA 38 Cb -0.06 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.45 2r59 s ALA 38 CO -0.00 -0.76 0.21 0.00 0.00 0.00 0.00 175.76 175.21 2r59 s ALA 39 N 1.31 3.34 -0.22 0.00 0.00 -0.01 -1.07 121.76 125.11 2r59 s ALA 39 Ca 0.00 -1.56 -0.14 0.00 0.00 0.00 0.00 51.96 50.26 2r59 s ALA 39 Cb -0.16 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2r59 s ALA 39 CO -0.06 -1.18 0.33 -0.51 0.00 0.00 0.00 175.76 174.35 2r59 s LEU 40 N 1.62 4.12 -0.29 0.00 1.43 0.37 -0.78 118.68 125.16 2r59 s LEU 40 Ca 0.04 0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 53.26 2r59 s LEU 40 Cb -0.18 -2.39 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2r59 s LEU 40 CO 0.08 -0.06 0.84 -0.89 0.23 0.00 0.00 176.35 176.55 2r59 s THR 41 N 1.39 4.76 -0.07 5.49 2.01 0.51 -1.14 115.64 128.60 2r59 s THR 41 Ca 0.15 1.38 0.05 0.00 0.31 0.00 0.00 61.69 63.58 2r59 s THR 41 Cb -0.15 -4.18 -0.00 0.00 0.01 0.00 0.00 72.50 68.18 2r59 s THR 41 CO 0.07 -0.23 -0.22 -0.69 -0.69 0.00 0.00 174.62 172.86 2r59 s VAL 42 N 3.02 1.87 -0.23 3.82 1.01 -0.32 0.10 120.40 129.68 2r59 s VAL 42 Ca 0.35 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 2r59 s VAL 42 Cb -0.14 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2r59 s VAL 42 CO 0.11 0.52 0.07 -1.58 0.00 0.00 0.00 175.10 174.22 2r59 s GLN 43 N 0.10 3.75 0.39 2.72 0.74 -0.06 -1.36 119.66 125.94 2r59 s GLN 43 Ca -0.10 -0.44 -0.27 0.00 0.05 0.00 0.00 55.36 54.61 2r59 s GLN 43 Cb -0.15 -3.30 -0.09 0.00 1.10 0.00 0.00 33.01 30.57 2r59 s GLN 43 CO 0.05 -0.06 1.31 0.45 -0.55 0.00 0.00 175.29 176.50 2r59 s SER 44 N 1.26 6.41 0.00 6.67 0.15 -0.24 -0.92 113.70 127.03 2r59 s SER 44 Ca 0.05 2.69 0.10 0.00 0.70 0.00 0.00 55.95 59.48 2r59 s SER 44 Cb -0.15 -2.64 0.22 0.00 -1.71 0.00 0.00 66.02 61.74 2r59 s SER 44 CO 0.04 -0.79 1.10 0.00 1.20 0.00 0.00 173.24 174.79 2r59 n GLN 45 N 0.29 2.09 -4.19 5.44 1.13 0.61 -0.48 117.38 122.27 2r59 n GLN 45 Ca 0.03 -1.72 -0.19 0.00 -1.94 0.00 0.00 57.00 53.17 2r59 n GLN 45 Cb 0.43 -1.23 -0.12 0.00 0.11 0.00 0.00 30.24 29.43 2r59 n GLN 45 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2r59 s GLU 46 N -0.95 0.86 0.43 -1.09 2.02 -1.23 -4.84 118.70 113.90 2r59 s GLU 46 Ca 0.18 -0.97 -0.25 0.00 0.02 0.00 0.00 54.97 53.95 2r59 s GLU 46 Cb 0.10 -0.91 -0.08 0.00 0.10 0.00 0.00 34.13 33.35 2r59 s GLU 46 CO 0.14 0.20 1.33 0.34 0.02 0.00 0.00 175.26 177.29 2r59 s ASP 47 N -1.74 6.11 -1.38 -0.19 -1.08 -1.26 -3.12 116.67 114.01 2r59 s ASP 47 Ca -0.01 2.70 -0.05 0.00 -0.52 0.00 0.00 52.55 54.67 2r59 s ASP 47 Cb -0.10 -2.64 0.03 0.00 -1.46 0.00 0.00 42.92 38.75 2r59 s ASP 47 CO 0.02 -0.99 0.85 -3.20 0.52 0.00 0.00 175.17 172.37 2r59 n ASN 48 N -0.09 -2.83 -4.69 -0.34 5.15 -0.51 -4.93 115.26 107.02 2r59 n ASN 48 Ca 0.05 -0.77 -0.42 0.00 -0.60 0.00 0.00 54.58 52.83 2r59 n ASN 48 Cb 0.44 -4.14 -0.03 0.00 -0.53 0.00 0.00 39.78 35.52 2r59 n ASN 48 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2r59 s LEU 49 N -6.91 4.27 0.00 1.20 2.96 -0.62 -4.73 118.68 114.85 2r59 s LEU 49 Ca 0.27 1.58 0.00 0.00 -0.22 0.00 0.00 54.13 55.76 2r59 s LEU 49 Cb -0.13 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.00 2r59 s LEU 49 CO 0.81 -0.44 0.15 0.54 -1.32 0.00 0.00 176.35 176.09 2r59 n ARG 50 N 4.89 2.47 -3.62 1.98 1.74 -1.26 -1.26 116.66 121.60 2r59 n ARG 50 Ca 0.09 -0.15 -0.11 0.00 -0.77 0.00 0.00 57.85 56.91 2r59 n ARG 50 Cb 0.49 -0.57 -0.05 0.00 -1.02 0.00 0.00 32.46 31.31 2r59 n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2r59 s SER 51 N -0.40 -0.26 0.13 0.55 1.04 -1.26 -1.32 113.70 112.19 2r59 s SER 51 Ca 0.00 -0.27 -0.09 0.00 0.48 0.00 0.00 55.95 56.08 2r59 s SER 51 Cb 0.00 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 2r59 s SER 51 CO 0.00 -0.84 0.24 -1.48 0.98 0.00 0.00 173.24 172.15 2r59 s LEU 52 N -2.72 1.15 -0.06 2.42 0.05 -0.53 -4.97 118.68 114.03 2r59 s LEU 52 Ca 0.02 -0.77 0.05 0.00 0.05 0.00 0.00 54.13 53.48 2r59 s LEU 52 Cb 0.01 1.13 -0.01 0.00 -2.05 0.00 0.00 46.19 45.28 2r59 s LEU 52 CO -0.11 -0.82 -0.22 -0.69 -0.55 0.00 0.00 176.35 173.96 2r59 s VAL 53 N -3.92 1.81 0.17 1.48 1.01 -1.26 0.38 120.40 120.06 2r59 s VAL 53 Ca 0.12 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.28 2r59 s VAL 53 Cb 0.04 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2r59 s VAL 53 CO -0.05 0.51 -0.17 -0.76 0.00 0.00 0.00 175.10 174.63 2r59 s LEU 54 N -0.00 2.71 0.14 3.92 1.43 -0.18 -0.44 118.68 126.25 2r59 s LEU 54 Ca -0.06 -0.67 -0.27 0.00 -1.03 0.00 0.00 54.13 52.10 2r59 s LEU 54 Cb -0.14 -1.46 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 2r59 s LEU 54 CO 0.04 0.13 0.85 -1.81 0.23 0.00 0.00 176.35 175.79 2r59 s ASP 55 N -2.58 7.42 0.04 2.29 1.01 0.37 -0.58 116.67 124.64 2r59 s ASP 55 Ca 0.21 1.69 -0.01 0.00 0.71 0.00 0.00 52.55 55.15 2r59 s ASP 55 Cb -0.09 -2.53 -0.03 0.00 1.01 0.00 0.00 42.92 41.28 2r59 s ASP 55 CO 0.12 0.08 -0.01 0.42 0.21 0.00 0.00 175.17 175.99 2r59 s THR 56 N -0.59 0.17 -0.20 -1.27 -4.23 -1.00 -2.41 115.64 106.10 2r59 s THR 56 Ca 0.40 -1.42 -0.04 0.00 -1.18 0.00 0.00 61.69 59.45 2r59 s THR 56 Cb -0.23 -1.03 0.10 0.00 1.34 0.00 0.00 72.50 72.68 2r59 s THR 56 CO 0.27 -0.78 0.28 -0.75 -0.54 0.00 0.00 174.62 173.10 2r59 s LYS 57 N -2.95 0.23 -1.54 3.99 2.20 0.54 -1.35 119.74 120.86 2r59 s LYS 57 Ca -0.02 0.41 -0.05 0.00 -0.36 0.00 0.00 55.97 55.95 2r59 s LYS 57 Cb 0.01 -0.76 0.01 0.00 -1.51 0.00 0.00 37.83 35.58 2r59 s LYS 57 CO -0.06 -0.58 0.66 -0.25 -0.36 0.00 0.00 175.35 174.76 2r59 n ASP 58 N 5.34 -6.13 -4.84 1.43 8.00 -1.26 -4.23 116.55 114.85 2r59 n ASP 58 Ca -0.05 -0.32 -0.34 0.00 0.71 0.00 0.00 54.79 54.79 2r59 n ASP 58 Cb 0.50 -4.94 -0.06 0.00 -0.02 0.00 0.00 41.12 36.59 2r59 n ASP 58 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2r59 s LEU 59 N -6.76 4.17 -0.30 0.64 1.43 -1.26 -2.51 118.68 114.09 2r59 s LEU 59 Ca 0.33 0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 53.59 2r59 s LEU 59 Cb -0.15 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2r59 s LEU 59 CO 0.41 0.32 0.36 -0.89 0.23 0.00 0.00 176.35 176.78 2r59 s THR 60 N -1.16 5.18 -0.32 5.49 2.01 -0.05 -4.96 115.64 121.83 2r59 s THR 60 Ca 0.21 0.33 -0.15 0.00 0.31 0.00 0.00 61.69 62.40 2r59 s THR 60 Cb -0.12 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 2r59 s THR 60 CO 0.12 0.06 0.36 -0.63 -0.69 0.00 0.00 174.62 173.83 2r59 s ILE 61 N 2.04 5.17 -0.03 1.82 -1.09 -1.26 -1.11 121.20 126.75 2r59 s ILE 61 Ca 0.13 0.22 -0.21 0.00 -2.23 0.00 0.00 60.65 58.56 2r59 s ILE 61 Cb -0.16 -3.77 -0.27 0.00 -1.58 0.00 0.00 42.46 36.68 2r59 s ILE 61 CO 0.11 0.00 0.99 -0.08 -1.23 0.00 0.00 174.94 174.73 2r59 h GLU 62 N 8.37 0.33 -1.78 2.79 4.81 -1.28 -3.49 114.58 124.33 2r59 h GLU 62 Ca -0.31 -0.45 0.21 0.00 -0.13 0.00 0.00 59.36 58.68 2r59 h GLU 62 Cb 1.15 0.15 -0.16 0.00 0.63 0.00 0.00 28.75 30.52 2r59 h GLU 62 CO 0.67 1.16 0.69 -1.59 -0.73 0.00 0.00 179.01 179.21 2r59 s LYS 63 N -2.79 0.54 -0.07 1.92 -2.85 -1.19 -5.00 119.74 110.29 2r59 s LYS 63 Ca -0.14 -0.22 -0.00 0.00 -1.00 0.00 0.00 55.97 54.61 2r59 s LYS 63 Cb 0.02 0.23 0.02 0.00 -2.06 0.00 0.00 37.83 36.05 2r59 s LYS 63 CO 0.82 -0.24 -0.04 0.08 0.10 0.00 0.00 175.35 176.07 2r59 s VAL 64 N -2.70 0.64 -0.10 1.79 1.01 -1.26 -0.13 120.40 119.65 2r59 s VAL 64 Ca 0.09 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.02 2r59 s VAL 64 Cb -0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 36.38 35.66 2r59 s VAL 64 CO -0.06 0.29 -0.23 -0.69 0.00 0.00 0.00 175.10 174.41 2r59 s VAL 65 N 1.54 2.14 -0.04 2.92 1.01 0.53 -1.39 120.40 127.11 2r59 s VAL 65 Ca -0.01 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.00 2r59 s VAL 65 Cb -0.13 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2r59 s VAL 65 CO -0.04 0.56 -0.08 -0.63 0.00 0.00 0.00 175.10 174.91 2r59 s ILE 66 N 0.26 0.73 -1.55 2.22 1.01 -0.71 -0.83 121.20 122.34 2r59 s ILE 66 Ca -0.16 -0.29 -0.14 0.00 0.00 0.00 0.00 60.65 60.06 2r59 s ILE 66 Cb -0.17 -0.68 0.09 0.00 0.01 0.00 0.00 42.46 41.71 2r59 s ILE 66 CO 0.08 0.25 0.94 0.59 0.00 0.00 0.00 174.94 176.80 2r59 n ASN 67 N 3.57 -4.43 0.00 3.58 3.02 -1.26 -1.73 115.26 118.01 2r59 n ASN 67 Ca -0.21 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 2r59 n ASN 67 Cb 0.53 -3.74 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 2r59 n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2r59 n GLY 68 N -1.66 0.43 3.28 7.41 0.00 -1.26 -5.01 105.19 108.39 2r59 n GLY 68 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 2r59 n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r59 s GLN 69 N -0.58 1.13 0.30 1.61 -1.52 -0.70 -5.09 119.66 114.80 2r59 s GLN 69 Ca 0.00 -1.23 -0.28 0.00 -1.95 0.00 0.00 55.36 51.90 2r59 s GLN 69 Cb 0.00 -1.26 -0.09 0.00 -0.22 0.00 0.00 33.01 31.44 2r59 s GLN 69 CO 0.00 0.28 1.02 -1.21 -0.25 0.00 0.00 175.29 175.13 2r59 s GLU 70 N -2.25 4.60 0.22 2.91 2.02 -1.26 -1.73 118.70 123.21 2r59 s GLU 70 Ca 0.09 1.58 0.10 0.00 0.02 0.00 0.00 54.97 56.76 2r59 s GLU 70 Cb -0.08 -3.02 -0.05 0.00 0.10 0.00 0.00 34.13 31.08 2r59 s GLU 70 CO 0.05 0.24 -0.19 0.14 0.02 0.00 0.00 175.26 175.52 2r59 s VAL 71 N -1.34 2.13 0.33 2.63 -7.23 -0.49 -4.93 120.40 111.50 2r59 s VAL 71 Ca 0.47 -2.21 -0.28 0.00 -1.81 0.00 0.00 61.98 58.15 2r59 s VAL 71 Cb -0.26 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.46 2r59 s VAL 71 CO 0.33 -0.40 1.24 -0.54 -0.31 0.00 0.00 175.10 175.42 2r59 s LYS 72 N -3.29 4.38 0.07 4.82 3.01 -1.26 -4.62 119.74 122.85 2r59 s LYS 72 Ca 0.24 2.07 -0.06 0.00 -1.01 0.00 0.00 55.97 57.20 2r59 s LYS 72 Cb -0.04 -3.04 -0.01 0.00 -1.01 0.00 0.00 37.83 33.72 2r59 s LYS 72 CO 0.10 -0.12 0.12 1.52 0.51 0.00 0.00 175.35 177.48 2r59 s TYR 73 N -1.18 0.27 -0.02 3.18 -0.85 -1.26 -1.40 117.35 116.09 2r59 s TYR 73 Ca 0.49 -0.74 -0.01 0.00 -0.52 0.00 0.00 57.07 56.29 2r59 s TYR 73 Cb -0.37 -0.17 0.01 0.00 0.38 0.00 0.00 41.96 41.81 2r59 s TYR 73 CO 0.48 -0.48 0.04 0.00 -1.52 0.00 0.00 175.55 174.07 2r59 s ALA 74 N -3.83 -0.10 -0.17 9.51 0.00 -0.28 -4.98 121.76 121.90 2r59 s ALA 74 Ca 0.05 0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.02 2r59 s ALA 74 Cb 0.06 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.04 2r59 s ALA 74 CO -0.10 -0.03 0.27 -0.51 0.00 0.00 0.00 175.76 175.39 2r59 s LEU 75 N 0.11 4.23 0.94 0.00 1.43 -1.26 -1.02 118.68 123.11 2r59 s LEU 75 Ca -0.01 0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 53.38 2r59 s LEU 75 Cb -0.01 -2.33 0.18 0.00 0.03 0.00 0.00 46.19 44.06 2r59 s LEU 75 CO -0.00 0.10 1.30 -0.83 0.23 0.00 0.00 176.35 177.14 2r59 s GLY 76 N 0.53 1.75 0.33 -3.19 0.00 0.06 -5.01 107.32 101.79 2r59 s GLY 76 Ca 0.15 -1.12 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 2r59 s GLY 76 CO 0.03 -0.39 1.29 -1.83 0.00 0.00 0.00 173.10 172.21 2r59 s GLU 77 N -5.84 4.37 0.20 2.90 -1.05 -1.26 -4.52 118.70 113.50 2r59 s GLU 77 Ca 0.72 2.19 -0.33 0.00 -0.15 0.00 0.00 54.97 57.41 2r59 s GLU 77 Cb -0.05 -3.08 -0.14 0.00 -0.44 0.00 0.00 34.13 30.43 2r59 s GLU 77 CO 0.52 -0.16 1.50 -2.13 0.95 0.00 0.00 175.26 175.95 2r59 n ARG 78 N 0.82 2.12 -3.50 -4.83 0.63 -1.26 -4.56 116.66 106.08 2r59 n ARG 78 Ca -0.00 0.76 -0.35 0.00 -0.92 0.00 0.00 57.85 57.34 2r59 n ARG 78 Cb 0.42 -2.48 -0.06 0.00 0.45 0.00 0.00 32.46 30.79 2r59 n ARG 78 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2r59 n GLN 79 N 2.77 2.90 0.00 -0.14 6.02 0.84 -4.96 117.38 124.81 2r59 n GLN 79 Ca 0.14 -4.53 0.00 0.00 -0.01 0.00 0.00 57.00 52.60 2r59 n GLN 79 Cb 0.30 -2.40 0.00 0.00 1.02 0.00 0.00 30.24 29.17 2r59 n GLN 79 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2r59 n SER 80 N 1.85 0.00 0.03 1.08 3.41 -1.26 -1.45 113.62 117.27 2r59 n SER 80 Ca 0.24 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.94 2r59 n SER 80 Cb 0.37 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.69 2r59 n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r59 n TYR 81 N 1.80 0.19 0.63 7.33 4.11 -1.26 -2.26 117.16 127.70 2r59 n TYR 81 Ca 0.00 0.07 0.13 0.00 -0.00 0.00 0.00 57.90 58.10 2r59 n TYR 81 Cb 0.00 -0.62 0.40 0.00 -0.00 0.00 0.00 39.34 39.12 2r59 n TYR 81 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 2r59 n LYS 82 N -1.67 0.26 0.00 -3.48 5.02 -0.53 -5.04 118.16 112.71 2r59 n LYS 82 Ca 0.03 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 2r59 n LYS 82 Cb 0.20 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 2r59 n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r59 n GLY 83 N 1.31 -1.31 3.30 0.72 0.00 -0.96 -4.73 105.19 103.53 2r59 n GLY 83 Ca 0.06 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 2r59 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r59 s SER 84 N -4.00 3.38 0.35 1.61 0.01 -0.46 -0.11 113.70 114.48 2r59 s SER 84 Ca 0.00 -0.45 -0.27 0.00 1.31 0.00 0.00 55.95 56.55 2r59 s SER 84 Cb 0.00 -1.12 -0.09 0.00 0.21 0.00 0.00 66.02 65.01 2r59 s SER 84 CO 0.00 0.22 1.12 -2.16 0.41 0.00 0.00 173.24 172.83 2r59 s PRO 85 N -0.02 4.34 -0.35 12.44 0.04 -1.26 -2.38 135.00 147.81 2r59 s PRO 85 Ca -0.07 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 62.73 2r59 s PRO 85 Cb -0.15 -2.88 0.08 0.00 0.04 0.00 0.00 34.50 31.60 2r59 s PRO 85 CO 0.05 -0.05 0.09 1.41 0.04 0.00 0.00 177.00 178.54 2r59 s MET 86 N -1.97 2.05 -0.13 4.56 1.75 0.25 -0.76 119.30 125.06 2r59 s MET 86 Ca 0.52 -1.62 -0.22 0.00 -1.25 0.00 0.00 55.69 53.11 2r59 s MET 86 Cb -0.30 -3.33 -0.03 0.00 2.84 0.00 0.00 34.83 34.01 2r59 s MET 86 CO 0.38 -0.86 0.66 -2.00 -0.65 0.00 0.00 175.02 172.55 2r59 s GLU 87 N 1.13 4.34 -0.17 4.11 2.12 -0.19 -1.01 118.70 129.03 2r59 s GLU 87 Ca 0.03 0.76 -0.01 0.00 0.36 0.00 0.00 54.97 56.11 2r59 s GLU 87 Cb -0.21 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.68 2r59 s GLU 87 CO -0.04 -0.06 -0.11 0.42 -0.54 0.00 0.00 175.26 174.93 2r59 s ILE 88 N 1.27 2.98 -0.43 -3.70 1.01 0.16 -1.13 121.20 121.37 2r59 s ILE 88 Ca 0.33 -0.65 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 2r59 s ILE 88 Cb -0.17 -2.30 0.02 0.00 0.01 0.00 0.00 42.46 40.03 2r59 s ILE 88 CO 0.14 0.49 0.94 -0.44 0.00 0.00 0.00 174.94 176.07 2r59 s SER 89 N 0.97 6.58 0.38 3.58 0.01 -0.50 -1.45 113.70 123.27 2r59 s SER 89 Ca -0.02 0.32 -0.25 0.00 1.31 0.00 0.00 55.95 57.31 2r59 s SER 89 Cb -0.15 -2.46 -0.09 0.00 0.21 0.00 0.00 66.02 63.53 2r59 s SER 89 CO -0.01 -1.00 1.05 -0.76 0.41 0.00 0.00 173.24 172.94 2r59 s LEU 90 N 3.71 4.22 0.32 2.44 1.43 -0.43 -4.42 118.68 125.94 2r59 s LEU 90 Ca 0.38 2.07 0.17 0.00 -1.03 0.00 0.00 54.13 55.72 2r59 s LEU 90 Cb -0.10 -4.08 0.36 0.00 0.03 0.00 0.00 46.19 42.39 2r59 s LEU 90 CO 0.24 -0.42 1.58 1.55 0.23 0.00 0.00 176.35 179.53 2r59 h PRO 91 N 2.75 0.00 -3.94 1.29 0.13 -1.96 -3.43 132.00 126.84 2r59 h PRO 91 Ca -0.48 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.30 2r59 h PRO 91 Cb 1.21 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.02 2r59 h PRO 91 CO 0.63 0.47 -0.75 0.42 -0.23 0.00 0.00 178.00 178.53 2r59 s ILE 92 N -3.26 0.32 0.38 -3.56 1.01 -1.26 -5.14 121.20 109.69 2r59 s ILE 92 Ca 0.02 -0.05 -0.26 0.00 0.00 0.00 0.00 60.65 60.35 2r59 s ILE 92 Cb 0.09 -0.35 -0.11 0.00 0.01 0.00 0.00 42.46 42.10 2r59 s ILE 92 CO 0.72 0.15 1.25 0.00 0.00 0.00 0.00 174.94 177.06 2r59 n ALA 93 N 3.77 1.16 -2.64 9.38 0.00 -1.26 -4.93 120.51 125.99 2r59 n ALA 93 Ca -0.23 0.31 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 2r59 n ALA 93 Cb 0.53 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.64 2r59 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r59 s LEU 94 N -1.24 3.34 0.58 0.00 1.43 -0.39 -4.85 118.68 117.55 2r59 s LEU 94 Ca 0.59 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 2r59 s LEU 94 Cb -0.54 -1.89 0.04 0.00 0.03 0.00 0.00 46.19 43.82 2r59 s LEU 94 CO 0.60 0.29 0.82 -0.94 0.23 0.00 0.00 176.35 177.35 2r59 s SER 95 N -1.41 5.18 0.23 2.29 1.04 -1.26 -1.42 113.70 118.35 2r59 s SER 95 Ca 0.18 0.05 -0.31 0.00 0.48 0.00 0.00 55.95 56.34 2r59 s SER 95 Cb -0.11 -0.88 -0.11 0.00 0.10 0.00 0.00 66.02 65.01 2r59 s SER 95 CO 0.08 -1.23 1.62 -0.75 0.98 0.00 0.00 173.24 173.94 2r59 s LYS 96 N -4.84 4.16 0.00 4.02 2.20 -1.18 -1.89 119.74 122.20 2r59 s LYS 96 Ca 0.58 2.52 0.00 0.00 -0.36 0.00 0.00 55.97 58.70 2r59 s LYS 96 Cb -0.10 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 2r59 s LYS 96 CO 0.39 -0.65 0.00 0.09 -0.36 0.00 0.00 175.35 174.82 2r59 n ASN 97 N 3.28 -1.27 -4.75 1.43 3.02 0.37 -4.99 115.26 112.36 2r59 n ASN 97 Ca 0.12 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.26 2r59 n ASN 97 Cb 0.37 -0.95 -0.03 0.00 -0.61 0.00 0.00 39.78 38.56 2r59 n ASN 97 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2r59 s GLN 98 N -0.39 4.45 -0.10 3.52 0.74 -0.79 -4.72 119.66 122.37 2r59 s GLN 98 Ca 0.00 2.01 -0.01 0.00 0.05 0.00 0.00 55.36 57.42 2r59 s GLN 98 Cb 0.00 -3.17 -0.03 0.00 1.10 0.00 0.00 33.01 30.92 2r59 s GLN 98 CO 0.00 -0.10 -0.08 -1.21 -0.55 0.00 0.00 175.29 173.35 2r59 s GLU 99 N -0.89 3.14 0.22 1.67 2.02 -1.26 -1.08 118.70 122.52 2r59 s GLU 99 Ca 0.51 -0.57 0.04 0.00 0.02 0.00 0.00 54.97 54.96 2r59 s GLU 99 Cb -0.36 -2.68 -0.05 0.00 0.10 0.00 0.00 34.13 31.14 2r59 s GLU 99 CO 0.43 0.45 -0.02 0.96 0.02 0.00 0.00 175.26 177.10 2r59 s ILE 100 N -0.23 1.07 -0.16 -1.63 -4.36 -0.47 -4.97 121.20 110.44 2r59 s ILE 100 Ca 0.03 -2.04 -0.03 0.00 -0.26 0.00 0.00 60.65 58.35 2r59 s ILE 100 Cb -0.13 -2.29 -0.02 0.00 1.25 0.00 0.00 42.46 41.27 2r59 s ILE 100 CO 0.03 -0.37 -0.07 -0.69 0.24 0.00 0.00 174.94 174.08 2r59 s VAL 101 N -3.40 3.50 -0.21 8.37 1.01 -1.26 -1.17 120.40 127.25 2r59 s VAL 101 Ca 0.27 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2r59 s VAL 101 Cb 0.05 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2r59 s VAL 101 CO 0.08 0.49 -0.04 -0.63 0.00 0.00 0.00 175.10 174.99 2r59 s ILE 102 N 0.63 3.41 -0.27 2.22 1.01 -0.29 -4.50 121.20 123.41 2r59 s ILE 102 Ca -0.04 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 2r59 s ILE 102 Cb -0.15 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 2r59 s ILE 102 CO 0.03 0.43 0.10 -0.70 0.00 0.00 0.00 174.94 174.80 2r59 s GLU 103 N 1.34 3.64 -0.20 2.79 2.12 -0.01 -0.47 118.70 127.90 2r59 s GLU 103 Ca 0.04 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 54.85 2r59 s GLU 103 Cb -0.14 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.83 2r59 s GLU 103 CO -0.02 -0.23 -0.11 0.42 -0.54 0.00 0.00 175.26 174.77 2r59 s ILE 104 N 1.64 2.82 -0.14 -3.70 1.01 -0.23 -0.35 121.20 122.25 2r59 s ILE 104 Ca 0.06 -0.68 -0.22 0.00 0.00 0.00 0.00 60.65 59.81 2r59 s ILE 104 Cb -0.16 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 2r59 s ILE 104 CO 0.05 0.48 0.65 -0.44 0.00 0.00 0.00 174.94 175.68 2r59 s SER 105 N 1.32 6.82 0.22 3.58 0.01 0.81 -1.62 113.70 124.84 2r59 s SER 105 Ca 0.04 0.99 -0.14 0.00 1.31 0.00 0.00 55.95 58.15 2r59 s SER 105 Cb -0.14 -2.37 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2r59 s SER 105 CO -0.06 -0.19 0.47 0.72 0.41 0.00 0.00 173.24 174.59 2r59 s PHE 106 N 1.36 0.21 -0.07 2.43 -0.71 0.08 -0.71 117.98 120.57 2r59 s PHE 106 Ca 0.32 -0.57 -0.09 0.00 -1.04 0.00 0.00 56.93 55.55 2r59 s PHE 106 Cb -0.16 0.23 0.02 0.00 -1.21 0.00 0.00 43.02 41.90 2r59 s PHE 106 CO 0.13 -0.95 0.23 -2.00 -1.34 0.00 0.00 175.22 171.30 2r59 s GLU 107 N -3.97 0.33 0.57 1.99 2.12 -0.26 -1.43 118.70 118.05 2r59 s GLU 107 Ca 0.17 0.20 -0.06 0.00 0.36 0.00 0.00 54.97 55.65 2r59 s GLU 107 Cb -0.00 0.15 0.00 0.00 0.26 0.00 0.00 34.13 34.54 2r59 s GLU 107 CO 0.04 -0.05 0.88 0.95 -0.54 0.00 0.00 175.26 176.54 2r59 s THR 108 N -0.16 3.82 0.32 -1.70 -4.23 -0.26 -0.87 115.64 112.55 2r59 s THR 108 Ca -0.03 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.32 2r59 s THR 108 Cb -0.03 -3.50 -0.09 0.00 1.34 0.00 0.00 72.50 70.22 2r59 s THR 108 CO 0.01 -0.51 0.78 -0.55 -0.54 0.00 0.00 174.62 173.81 2r59 s SER 109 N -4.28 6.88 0.60 3.99 0.15 -1.04 -4.57 113.70 115.43 2r59 s SER 109 Ca 0.53 1.40 0.30 0.00 0.70 0.00 0.00 55.95 58.88 2r59 s SER 109 Cb -0.10 -2.42 1.73 0.00 -1.71 0.00 0.00 66.02 63.52 2r59 s SER 109 CO 0.45 -0.18 2.14 -0.65 1.20 0.00 0.00 173.24 176.20 2r59 h PRO 110 N 2.47 0.00 -0.67 5.44 0.11 -1.83 -1.98 132.00 135.54 2r59 h PRO 110 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2r59 h PRO 110 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2r59 h PRO 110 CO 0.65 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 178.80 2r59 n LYS 111 N -3.74 3.72 -1.66 1.05 2.85 -1.26 -4.95 118.16 114.17 2r59 n LYS 111 Ca 0.00 -2.31 -0.55 0.00 -1.05 0.00 0.00 58.31 54.41 2r59 n LYS 111 Cb 0.26 -2.00 -0.07 0.00 -0.65 0.00 0.00 35.03 32.58 2r59 n LYS 111 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2r59 n SER 112 N 0.55 2.16 0.11 -5.58 2.88 -0.75 -4.83 113.62 108.16 2r59 n SER 112 Ca 0.20 1.09 0.10 0.00 -1.33 0.00 0.00 58.87 58.93 2r59 n SER 112 Cb 0.90 -1.18 0.45 0.00 -0.75 0.00 0.00 64.21 63.63 2r59 n SER 112 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2r59 n SER 113 N 4.24 0.49 0.14 -3.46 3.41 -1.26 -2.50 113.62 114.69 2r59 n SER 113 Ca 0.23 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.62 2r59 n SER 113 Cb 0.17 -0.75 0.21 0.00 -0.26 0.00 0.00 64.21 63.58 2r59 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r59 h ALA 114 N 2.19 0.85 -4.33 7.33 0.00 -1.82 -3.43 119.26 120.06 2r59 h ALA 114 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 2r59 h ALA 114 Cb 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 17.79 17.72 2r59 h ALA 114 CO 0.00 0.00 -0.86 -0.51 0.00 0.00 0.00 179.25 177.88 2r59 s LEU 115 N -5.26 2.10 -0.15 0.00 1.43 -1.04 0.54 118.68 116.30 2r59 s LEU 115 Ca 0.07 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 2r59 s LEU 115 Cb 0.09 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 45.21 2r59 s LEU 115 CO 0.68 0.24 -0.15 -1.58 0.23 0.00 0.00 176.35 175.76 2r59 s GLN 116 N -0.84 2.40 -0.23 1.70 0.74 -0.52 -4.64 119.66 118.27 2r59 s GLN 116 Ca 0.09 -0.60 -0.13 0.00 0.05 0.00 0.00 55.36 54.77 2r59 s GLN 116 Cb -0.09 -2.17 -0.04 0.00 1.10 0.00 0.00 33.01 31.81 2r59 s GLN 116 CO 0.00 -0.22 0.27 -1.58 -0.55 0.00 0.00 175.29 173.22 2r59 s TRP 117 N 1.43 3.33 -0.11 1.67 0.52 -1.26 -2.06 118.94 122.46 2r59 s TRP 117 Ca 0.04 0.39 0.02 0.00 0.02 0.00 0.00 56.10 56.57 2r59 s TRP 117 Cb -0.13 -2.40 -0.01 0.00 -1.15 0.00 0.00 33.47 29.77 2r59 s TRP 117 CO -0.11 -0.00 -0.17 -0.51 0.02 0.00 0.00 176.95 176.19 2r59 s LEU 118 N 1.28 2.53 0.84 2.99 1.43 0.00 -5.00 118.68 122.76 2r59 s LEU 118 Ca 0.13 -0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 2r59 s LEU 118 Cb -0.14 -1.54 0.09 0.00 0.03 0.00 0.00 46.19 44.63 2r59 s LEU 118 CO 0.07 0.20 1.09 0.42 0.23 0.00 0.00 176.35 178.36 2r59 s THR 119 N 0.14 2.97 0.45 5.49 -4.23 -1.26 -2.26 115.64 116.94 2r59 s THR 119 Ca -0.09 0.31 0.20 0.00 -1.18 0.00 0.00 61.69 60.94 2r59 s THR 119 Cb -0.15 -2.79 0.40 0.00 1.34 0.00 0.00 72.50 71.29 2r59 s THR 119 CO 0.05 -0.41 1.88 -0.65 -0.54 0.00 0.00 174.62 174.95 2r59 h PRO 120 N -1.35 0.29 0.00 3.99 0.11 -1.88 -0.86 132.00 132.30 2r59 h PRO 120 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2r59 h PRO 120 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2r59 h PRO 120 CO 0.53 0.19 0.00 1.05 -0.21 0.00 0.00 178.00 179.56 2r59 h GLU 121 N 0.30 0.00 -0.01 1.05 9.09 -1.88 -2.32 114.58 120.82 2r59 h GLU 121 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 2r59 h GLU 121 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 2r59 h GLU 121 CO -0.12 0.00 -0.01 1.04 0.05 0.00 0.00 179.01 179.96 2r59 n GLN 122 N -3.07 1.22 -3.38 1.06 6.02 -0.33 -4.89 117.38 114.01 2r59 n GLN 122 Ca 0.01 -0.40 -0.19 0.00 -0.01 0.00 0.00 57.00 56.41 2r59 n GLN 122 Cb 0.32 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.08 2r59 n GLN 122 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2r59 s THR 123 N -2.06 3.31 0.21 5.09 -4.23 -0.87 -4.83 115.64 112.26 2r59 s THR 123 Ca 0.42 -1.13 -0.04 0.00 -1.18 0.00 0.00 61.69 59.76 2r59 s THR 123 Cb 0.21 -3.14 0.01 0.00 1.34 0.00 0.00 72.50 70.92 2r59 s THR 123 CO 0.37 -0.07 1.60 0.28 -0.54 0.00 0.00 174.62 176.25 2r59 h SER 124 N 0.89 0.76 0.88 3.99 0.02 -1.90 -3.35 113.55 114.83 2r59 h SER 124 Ca -0.43 -0.30 -0.23 0.00 -0.84 0.00 0.00 61.79 59.99 2r59 h SER 124 Cb 1.27 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.57 2r59 h SER 124 CO 0.52 1.01 -1.12 1.23 -1.14 0.00 0.00 176.83 177.33 2r59 h GLY 125 N 0.96 0.05 0.00 -3.77 0.00 -1.93 -3.48 103.07 94.90 2r59 h GLY 125 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2r59 h GLY 125 CO 0.07 0.12 0.00 0.28 0.00 0.00 0.00 176.54 177.01 2r59 n LYS 126 N -3.35 -0.04 -0.11 4.80 4.76 -1.23 -4.83 118.16 118.16 2r59 n LYS 126 Ca -0.03 0.01 -0.24 0.00 -2.87 0.00 0.00 58.31 55.18 2r59 n LYS 126 Cb 0.97 -3.01 -0.11 0.00 -1.84 0.00 0.00 35.03 31.03 2r59 n LYS 126 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2r59 n GLU 127 N -2.01 0.63 -4.34 1.97 -0.58 -1.26 -4.57 120.64 110.47 2r59 n GLU 127 Ca 0.00 0.28 -0.26 0.00 -0.42 0.00 0.00 57.16 56.76 2r59 n GLU 127 Cb 0.01 -1.57 -0.10 0.00 -0.57 0.00 0.00 31.44 29.21 2r59 n GLU 127 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2r59 s HIS 128 N -2.49 2.51 0.06 -0.32 3.76 -1.26 -4.83 115.29 112.72 2r59 s HIS 128 Ca -0.34 -0.27 -0.01 0.00 -0.15 0.00 0.00 55.06 54.29 2r59 s HIS 128 Cb 0.11 -1.22 0.01 0.00 1.11 0.00 0.00 32.58 32.59 2r59 s HIS 128 CO 0.58 0.52 0.08 -0.35 -0.85 0.00 0.00 174.74 174.72 2r59 n PRO 129 N 0.04 0.10 -3.58 8.40 -0.04 -1.26 -3.93 135.00 134.73 2r59 n PRO 129 Ca -0.11 -0.15 -0.14 0.00 -0.04 0.00 0.00 63.50 63.06 2r59 n PRO 129 Cb 0.56 -0.08 -0.06 0.00 -0.04 0.00 0.00 33.50 33.88 2r59 n PRO 129 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2r59 s TYR 130 N -0.84 -0.66 -0.01 0.54 6.14 -0.96 -4.45 117.35 117.12 2r59 s TYR 130 Ca 0.05 1.40 0.01 0.00 0.64 0.00 0.00 57.07 59.17 2r59 s TYR 130 Cb -0.00 0.35 0.00 0.00 0.42 0.00 0.00 41.96 42.74 2r59 s TYR 130 CO 0.03 -0.44 -0.03 -1.17 0.64 0.00 0.00 175.55 174.58 2r59 s LEU 131 N -0.38 1.81 0.02 6.97 2.96 0.87 -0.82 118.68 130.11 2r59 s LEU 131 Ca -0.04 -0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 53.80 2r59 s LEU 131 Cb -0.03 -0.22 -0.02 0.00 0.50 0.00 0.00 46.19 46.42 2r59 s LEU 131 CO 0.03 0.02 -0.02 0.72 -1.32 0.00 0.00 176.35 175.78 2r59 s PHE 132 N 0.17 0.22 0.26 5.38 -0.12 -0.88 -0.87 117.98 122.15 2r59 s PHE 132 Ca -0.01 -0.45 0.05 0.00 -0.05 0.00 0.00 56.93 56.47 2r59 s PHE 132 Cb -0.05 -0.16 -0.03 0.00 -0.63 0.00 0.00 43.02 42.16 2r59 s PHE 132 CO -0.00 -0.16 0.39 -1.54 -0.05 0.00 0.00 175.22 173.85 2r59 s SER 133 N -1.25 6.24 -0.35 1.98 1.04 -0.39 -1.43 113.70 119.53 2r59 s SER 133 Ca -0.14 0.02 0.02 0.00 0.48 0.00 0.00 55.95 56.34 2r59 s SER 133 Cb -0.09 -1.72 0.15 0.00 0.10 0.00 0.00 66.02 64.47 2r59 s SER 133 CO -0.01 -0.16 0.36 -1.58 0.98 0.00 0.00 173.24 172.83 2r59 s GLN 134 N -4.03 0.58 0.14 4.02 2.00 0.19 -4.76 119.66 117.79 2r59 s GLN 134 Ca 0.37 -0.73 0.07 0.00 -2.00 0.00 0.00 55.36 53.07 2r59 s GLN 134 Cb -0.09 -0.72 -0.12 0.00 0.80 0.00 0.00 33.01 32.87 2r59 s GLN 134 CO 0.30 -1.16 1.32 0.00 -0.50 0.00 0.00 175.29 175.25 2r59 s GLN 136 N -2.86 4.47 -0.17 0.00 0.74 -1.23 -0.16 119.66 120.44 2r59 s GLN 136 Ca 0.00 1.99 -0.22 0.00 0.05 0.00 0.00 55.36 57.18 2r59 s GLN 136 Cb 0.10 -3.18 -0.19 0.00 1.10 0.00 0.00 33.01 30.85 2r59 s GLN 136 CO 0.82 -0.09 0.38 0.00 -0.55 0.00 0.00 175.29 175.85 2r59 h ALA 137 N 4.52 0.11 -0.87 1.58 0.00 -1.94 -3.43 119.26 119.23 2r59 h ALA 137 Ca -0.46 -0.77 -0.49 0.00 0.00 0.00 0.00 54.91 53.19 2r59 h ALA 137 Cb 1.22 0.36 -0.42 0.00 0.00 0.00 0.00 17.79 18.95 2r59 h ALA 137 CO 0.71 0.35 -0.88 0.44 0.00 0.00 0.00 179.25 179.87 2r59 n ILE 138 N -4.55 2.16 0.81 0.00 -5.35 -1.14 -4.71 119.36 106.59 2r59 n ILE 138 Ca -0.18 -4.05 0.08 0.00 -0.27 0.00 0.00 62.75 58.33 2r59 n ILE 138 Cb 0.51 -0.60 -0.05 0.00 -1.74 0.00 0.00 39.64 37.75 2r59 n ILE 138 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2r59 n HIS 139 N -0.60 0.00 -0.17 4.28 8.25 0.77 -4.37 115.22 123.39 2r59 n HIS 139 Ca 0.34 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.92 2r59 n HIS 139 Cb 0.86 0.00 0.45 0.00 1.12 0.00 0.00 29.99 32.42 2r59 n HIS 139 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2r59 n ARG 141 N -4.49 0.16 0.00 0.00 1.85 -1.26 -0.44 116.66 112.48 2r59 n ARG 141 Ca 0.13 0.53 0.14 0.00 -1.00 0.00 0.00 57.85 57.65 2r59 n ARG 141 Cb 0.42 -1.91 0.54 0.00 -1.05 0.00 0.00 32.46 30.46 2r59 n ARG 141 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2r59 n ALA 142 N -1.77 2.77 -0.04 2.89 0.00 -0.45 -0.34 120.51 123.57 2r59 n ALA 142 Ca 0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 53.44 53.02 2r59 n ALA 142 Cb 0.13 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.32 2r59 n ALA 142 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2r59 n ILE 143 N -0.37 0.46 -3.60 0.00 5.41 0.42 -4.73 119.36 116.95 2r59 n ILE 143 Ca 0.17 -0.22 -0.16 0.00 1.00 0.00 0.00 62.75 63.54 2r59 n ILE 143 Cb 0.32 -0.81 -0.07 0.00 -0.71 0.00 0.00 39.64 38.37 2r59 n ILE 143 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 2r59 s LEU 144 N -5.08 -0.08 0.14 1.39 0.05 -0.61 -4.80 118.68 109.70 2r59 s LEU 144 Ca -0.08 0.39 -0.31 0.00 0.05 0.00 0.00 54.13 54.18 2r59 s LEU 144 Cb 0.02 2.07 -0.08 0.00 -2.05 0.00 0.00 46.19 46.15 2r59 s LEU 144 CO 0.22 -0.60 1.38 -2.84 -0.55 0.00 0.00 176.35 173.96 2r59 s PRO 145 N -1.59 4.33 0.28 1.48 0.02 -1.26 -4.13 135.00 134.12 2r59 s PRO 145 Ca -0.10 2.09 -0.21 0.00 0.02 0.00 0.00 61.00 62.80 2r59 s PRO 145 Cb -0.02 -3.23 0.02 0.00 0.02 0.00 0.00 34.50 31.30 2r59 s PRO 145 CO 0.05 -0.40 0.72 0.00 -0.33 0.00 0.00 177.00 177.05 2r59 s GLN 147 N -3.91 3.37 -1.22 0.00 -0.21 -1.26 -0.48 119.66 115.95 2r59 s GLN 147 Ca 0.11 -1.01 -0.09 0.00 0.02 0.00 0.00 55.36 54.39 2r59 s GLN 147 Cb -0.06 -4.68 0.21 0.00 1.00 0.00 0.00 33.01 29.48 2r59 s GLN 147 CO 0.07 -1.98 1.68 -3.47 -2.12 0.00 0.00 175.29 169.47 2r59 n ASP 148 N 8.09 5.44 -3.76 5.90 -0.08 -1.26 -4.81 116.55 126.06 2r59 n ASP 148 Ca 0.14 -3.16 -0.13 0.00 -1.51 0.00 0.00 54.79 50.14 2r59 n ASP 148 Cb 0.49 -1.44 -0.12 0.00 2.34 0.00 0.00 41.12 42.39 2r59 n ASP 148 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2r59 s THR 149 N -0.25 -0.01 -1.89 5.18 -1.32 -1.26 -4.69 115.64 111.40 2r59 s THR 149 Ca 0.38 0.03 0.25 0.00 -1.21 0.00 0.00 61.69 61.14 2r59 s THR 149 Cb 0.06 -0.40 0.67 0.00 -1.51 0.00 0.00 72.50 71.32 2r59 s THR 149 CO 0.02 0.01 1.88 -0.81 -2.21 0.00 0.00 174.62 173.51 2r59 n PRO 150 N 3.22 0.71 0.02 7.08 -0.04 -1.26 -2.65 135.00 142.08 2r59 n PRO 150 Ca -0.15 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.41 2r59 n PRO 150 Cb 0.57 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.93 2r59 n PRO 150 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2r59 n SER 151 N -1.06 0.12 -4.34 3.54 3.41 -1.08 -4.71 113.62 109.50 2r59 n SER 151 Ca 0.18 0.52 -0.33 0.00 -0.26 0.00 0.00 58.87 58.98 2r59 n SER 151 Cb 0.11 -0.55 -0.15 0.00 -0.26 0.00 0.00 64.21 63.36 2r59 n SER 151 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2r59 s VAL 152 N -3.04 2.81 -0.04 -3.33 1.01 -1.09 -4.87 120.40 111.84 2r59 s VAL 152 Ca 0.08 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.36 2r59 s VAL 152 Cb 0.12 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 2r59 s VAL 152 CO 0.35 0.54 -0.20 -0.54 0.00 0.00 0.00 175.10 175.25 2r59 s LYS 153 N 0.27 2.03 0.08 2.72 1.02 -1.26 -4.12 119.74 120.47 2r59 s LYS 153 Ca -0.11 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.16 2r59 s LYS 153 Cb -0.16 -1.77 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 2r59 s LYS 153 CO 0.06 0.32 -0.06 -0.48 -0.92 0.00 0.00 175.35 174.27 2r59 s LEU 154 N -0.10 2.46 0.51 3.17 2.34 -0.15 -4.68 118.68 122.23 2r59 s LEU 154 Ca -0.02 -0.93 0.01 0.00 0.06 0.00 0.00 54.13 53.25 2r59 s LEU 154 Cb -0.12 -0.00 0.02 0.00 -0.56 0.00 0.00 46.19 45.53 2r59 s LEU 154 CO 0.02 -0.46 0.73 0.42 -1.06 0.00 0.00 176.35 176.00 2r59 s THR 155 N -3.34 3.10 0.04 5.48 -4.23 -0.77 -0.34 115.64 115.57 2r59 s THR 155 Ca 0.07 -0.63 -0.16 0.00 -1.18 0.00 0.00 61.69 59.78 2r59 s THR 155 Cb 0.04 -3.15 0.03 0.00 1.34 0.00 0.00 72.50 70.76 2r59 s THR 155 CO -0.05 -0.10 0.36 -0.72 -0.54 0.00 0.00 174.62 173.57 2r59 s TYR 156 N -2.68 -0.19 0.13 3.99 -0.85 -0.76 -1.64 117.35 115.35 2r59 s TYR 156 Ca 0.54 0.13 0.06 0.00 -0.52 0.00 0.00 57.07 57.28 2r59 s TYR 156 Cb -0.10 0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.36 2r59 s TYR 156 CO 0.38 -0.53 -0.13 0.95 -1.52 0.00 0.00 175.55 174.70 2r59 s THR 157 N -2.42 1.30 -0.03 -3.49 -4.23 -0.11 -0.22 115.64 106.44 2r59 s THR 157 Ca -0.06 -1.79 -0.22 0.00 -1.18 0.00 0.00 61.69 58.44 2r59 s THR 157 Cb -0.01 -1.59 0.04 0.00 1.34 0.00 0.00 72.50 72.28 2r59 s THR 157 CO -0.02 -0.48 0.48 0.00 -0.54 0.00 0.00 174.62 174.05 2r59 s ALA 158 N -2.38 -1.23 -0.09 3.99 0.00 -0.82 -1.26 121.76 119.97 2r59 s ALA 158 Ca 0.10 0.78 -0.00 0.00 0.00 0.00 0.00 51.96 52.84 2r59 s ALA 158 Cb -0.03 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.15 2r59 s ALA 158 CO 0.03 -0.31 -0.07 -1.21 0.00 0.00 0.00 175.76 174.20 2r59 s GLU 159 N -1.26 1.37 -0.16 0.00 2.02 -0.33 -1.36 118.70 118.98 2r59 s GLU 159 Ca -0.12 -0.22 0.01 0.00 0.02 0.00 0.00 54.97 54.65 2r59 s GLU 159 Cb -0.03 -1.42 0.03 0.00 0.10 0.00 0.00 34.13 32.81 2r59 s GLU 159 CO 0.07 -0.21 -0.14 0.08 0.02 0.00 0.00 175.26 175.07 2r59 s VAL 160 N 1.52 1.66 -0.17 2.63 1.01 -0.15 -1.57 120.40 125.32 2r59 s VAL 160 Ca 0.01 -0.75 -0.16 0.00 0.00 0.00 0.00 61.98 61.07 2r59 s VAL 160 Cb -0.13 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2r59 s VAL 160 CO -0.05 0.42 0.42 -0.55 0.00 0.00 0.00 175.10 175.33 2r59 s SER 161 N 1.44 6.51 0.05 3.32 0.15 -0.11 -1.09 113.70 123.98 2r59 s SER 161 Ca 0.04 0.61 0.01 0.00 0.70 0.00 0.00 55.95 57.30 2r59 s SER 161 Cb -0.13 -2.24 -0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2r59 s SER 161 CO -0.11 -0.04 -0.05 0.68 1.20 0.00 0.00 173.24 174.93 2r59 s VAL 162 N 1.04 0.35 0.19 4.45 -7.23 -0.11 -1.04 120.40 118.05 2r59 s VAL 162 Ca 0.21 -1.40 -0.32 0.00 -1.81 0.00 0.00 61.98 58.66 2r59 s VAL 162 Cb -0.15 -0.97 -0.16 0.00 0.56 0.00 0.00 36.38 35.67 2r59 s VAL 162 CO 0.08 -0.69 1.08 -2.65 -0.31 0.00 0.00 175.10 172.61 2r59 n PRO 163 N 0.83 1.07 0.29 4.82 -0.02 -1.26 -1.26 135.00 139.47 2r59 n PRO 163 Ca -0.19 0.38 0.19 0.00 -2.02 0.00 0.00 63.50 61.87 2r59 n PRO 163 Cb 0.58 -1.81 0.99 0.00 -0.02 0.00 0.00 33.50 33.23 2r59 n PRO 163 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2r59 h LYS 164 N 2.88 0.00 0.00 -0.52 2.10 -1.51 -0.45 116.57 119.08 2r59 h LYS 164 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 2r59 h LYS 164 Cb 1.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 2r59 h LYS 164 CO 0.67 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.51 2r59 n GLU 165 N -2.91 0.30 -4.36 0.07 4.71 -1.26 -4.86 120.64 112.33 2r59 n GLU 165 Ca -0.02 0.06 -0.24 0.00 -0.01 0.00 0.00 57.16 56.95 2r59 n GLU 165 Cb 0.12 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.96 2r59 n GLU 165 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2r59 s LEU 166 N -2.63 2.95 -0.06 -4.62 1.43 -0.18 -4.79 118.68 110.78 2r59 s LEU 166 Ca 0.22 -0.96 0.06 0.00 -1.03 0.00 0.00 54.13 52.41 2r59 s LEU 166 Cb 0.16 -1.35 -0.01 0.00 0.03 0.00 0.00 46.19 45.02 2r59 s LEU 166 CO 0.38 -0.17 -0.24 -0.69 0.23 0.00 0.00 176.35 175.87 2r59 s VAL 167 N -2.50 2.17 -0.11 -1.59 1.01 -0.14 -4.89 120.40 114.35 2r59 s VAL 167 Ca 0.34 -1.03 -0.06 0.00 0.00 0.00 0.00 61.98 61.22 2r59 s VAL 167 Cb -0.01 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 2r59 s VAL 167 CO 0.19 0.57 0.14 0.00 0.00 0.00 0.00 175.10 176.00 2r59 s ALA 168 N -0.24 3.87 0.08 5.51 0.00 -1.26 -1.48 121.76 128.23 2r59 s ALA 168 Ca -0.01 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2r59 s ALA 168 Cb -0.13 -1.95 -0.03 0.00 0.00 0.00 0.00 23.12 21.01 2r59 s ALA 168 CO 0.03 0.63 -0.07 -0.51 0.00 0.00 0.00 175.76 175.83 2r59 s LEU 169 N -1.10 2.40 0.23 0.00 1.43 -0.08 -5.00 118.68 116.55 2r59 s LEU 169 Ca 0.16 -0.81 -0.03 0.00 -1.03 0.00 0.00 54.13 52.42 2r59 s LEU 169 Cb -0.12 -0.13 -0.03 0.00 0.03 0.00 0.00 46.19 45.94 2r59 s LEU 169 CO 0.05 -0.34 0.24 -0.04 0.23 0.00 0.00 176.35 176.49 2r59 s MET 170 N -2.84 1.35 -1.25 1.70 -1.94 -1.26 -1.65 119.30 113.40 2r59 s MET 170 Ca 0.03 -1.57 -0.15 0.00 -1.71 0.00 0.00 55.69 52.28 2r59 s MET 170 Cb -0.02 0.33 -0.03 0.00 2.01 0.00 0.00 34.83 37.12 2r59 s MET 170 CO -0.02 -0.49 2.21 -1.13 -0.01 0.00 0.00 175.02 175.59 2r59 n SER 171 N -0.44 4.05 -3.69 3.03 3.41 -1.11 -4.70 113.62 114.17 2r59 n SER 171 Ca 0.02 -2.74 -0.03 0.00 -0.26 0.00 0.00 58.87 55.85 2r59 n SER 171 Cb 0.65 -1.46 -0.01 0.00 -0.26 0.00 0.00 64.21 63.12 2r59 n SER 171 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r59 s ALA 172 N 3.61 -1.79 0.10 7.33 0.00 -1.18 -4.65 121.76 125.17 2r59 s ALA 172 Ca 0.52 0.39 -0.27 0.00 0.00 0.00 0.00 51.96 52.59 2r59 s ALA 172 Cb 0.14 0.54 -0.06 0.00 0.00 0.00 0.00 23.12 23.74 2r59 s ALA 172 CO -0.03 -0.98 0.86 0.42 0.00 0.00 0.00 175.76 176.03 2r59 s ILE 173 N -3.08 4.54 0.21 0.00 -1.09 -0.13 -4.85 121.20 116.80 2r59 s ILE 173 Ca 0.12 1.86 -0.30 0.00 -2.23 0.00 0.00 60.65 60.09 2r59 s ILE 173 Cb -0.00 -4.22 -0.09 0.00 -1.58 0.00 0.00 42.46 36.56 2r59 s ILE 173 CO -0.01 0.37 1.39 -0.13 -1.23 0.00 0.00 174.94 175.33 2r59 s ARG 174 N -0.25 4.32 -0.28 2.79 0.52 -1.26 -1.62 118.95 123.17 2r59 s ARG 174 Ca 0.42 2.17 0.12 0.00 -0.52 0.00 0.00 55.73 57.93 2r59 s ARG 174 Cb -0.22 -3.16 0.48 0.00 0.52 0.00 0.00 34.95 32.56 2r59 s ARG 174 CO 0.27 -0.36 1.16 -3.47 0.02 0.00 0.00 175.30 172.92 2r59 n ASP 175 N 2.74 3.78 0.00 0.23 4.64 0.63 -4.88 116.55 123.70 2r59 n ASP 175 Ca 0.07 -3.16 0.00 0.00 -1.38 0.00 0.00 54.79 50.32 2r59 n ASP 175 Cb 0.41 -0.39 0.00 0.00 -1.04 0.00 0.00 41.12 40.10 2r59 n ASP 175 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2r59 n GLY 176 N -0.67 1.59 3.14 0.27 0.00 -1.26 -4.57 105.19 103.71 2r59 n GLY 176 Ca 0.31 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.21 2r59 n GLY 176 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2r59 s GLU 177 N -2.16 0.35 0.05 1.61 -1.05 -1.26 -1.63 118.70 114.60 2r59 s GLU 177 Ca 0.00 0.23 -0.01 0.00 -0.15 0.00 0.00 54.97 55.05 2r59 s GLU 177 Cb 0.00 0.16 -0.04 0.00 -0.44 0.00 0.00 34.13 33.82 2r59 s GLU 177 CO 0.00 -0.06 -0.03 0.95 0.95 0.00 0.00 175.26 177.07 2r59 s THR 178 N -0.14 0.22 0.62 1.83 -4.23 -0.39 -4.98 115.64 108.58 2r59 s THR 178 Ca -0.03 -1.71 -0.19 0.00 -1.18 0.00 0.00 61.69 58.59 2r59 s THR 178 Cb -0.03 -1.38 -0.03 0.00 1.34 0.00 0.00 72.50 72.41 2r59 s THR 178 CO 0.01 -0.94 1.23 -2.65 -0.54 0.00 0.00 174.62 171.73 2r59 n PRO 179 N 0.28 1.17 -2.38 3.99 -0.02 -1.26 -0.25 135.00 136.53 2r59 n PRO 179 Ca -0.15 0.45 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 2r59 n PRO 179 Cb 0.60 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 2r59 n PRO 179 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2r59 s ASP 180 N -1.26 6.38 0.66 2.55 -1.08 -0.09 -4.59 116.67 119.24 2r59 s ASP 180 Ca 0.79 0.79 0.15 0.00 -0.52 0.00 0.00 52.55 53.77 2r59 s ASP 180 Cb -0.40 -2.54 0.83 0.00 -1.46 0.00 0.00 42.92 39.35 2r59 s ASP 180 CO 0.43 -1.40 1.47 -0.65 0.52 0.00 0.00 175.17 175.53 2r59 h PRO 181 N 10.49 0.00 -0.17 4.34 0.11 -1.90 0.13 132.00 145.01 2r59 h PRO 181 Ca -0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 2r59 h PRO 181 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2r59 h PRO 181 CO 1.09 0.00 -0.01 -0.85 -0.21 0.00 0.00 178.00 178.02 2r59 n GLU 182 N -2.71 2.27 0.00 1.05 0.28 -1.26 -4.92 120.64 115.35 2r59 n GLU 182 Ca -0.01 -2.77 0.00 0.00 -0.16 0.00 0.00 57.16 54.22 2r59 n GLU 182 Cb 0.69 -1.72 0.00 0.00 1.43 0.00 0.00 31.44 31.85 2r59 n GLU 182 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2r59 n ASP 183 N -0.88 0.00 0.00 -1.84 4.64 0.46 -5.05 116.55 113.88 2r59 n ASP 183 Ca 0.20 0.00 0.07 0.00 -1.38 0.00 0.00 54.79 53.68 2r59 n ASP 183 Cb 0.80 0.00 0.35 0.00 -1.04 0.00 0.00 41.12 41.24 2r59 n ASP 183 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2r59 n PRO 184 N 0.00 0.22 -0.15 -0.67 -0.04 -1.25 -1.57 135.00 131.54 2r59 n PRO 184 Ca 0.00 0.14 0.08 0.00 -0.04 0.00 0.00 63.50 63.68 2r59 n PRO 184 Cb 0.00 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.22 2r59 n PRO 184 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2r59 n SER 185 N -1.25 2.01 -4.23 3.54 3.41 -1.26 -4.89 113.62 110.95 2r59 n SER 185 Ca 0.07 -1.87 -0.19 0.00 -0.26 0.00 0.00 58.87 56.62 2r59 n SER 185 Cb 0.10 -0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 63.74 2r59 n SER 185 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2r59 s ARG 186 N -1.61 0.99 0.16 4.33 0.52 -0.61 -1.38 118.95 121.35 2r59 s ARG 186 Ca 0.30 -1.16 0.10 0.00 -0.52 0.00 0.00 55.73 54.45 2r59 s ARG 186 Cb 0.16 -0.94 -0.04 0.00 0.52 0.00 0.00 34.95 34.64 2r59 s ARG 186 CO 0.22 0.19 -0.21 0.15 0.02 0.00 0.00 175.30 175.67 2r59 s LYS 187 N -2.36 1.63 -0.19 3.54 1.02 -0.39 -0.91 119.74 122.08 2r59 s LYS 187 Ca 0.06 -1.36 -0.04 0.00 0.02 0.00 0.00 55.97 54.66 2r59 s LYS 187 Cb -0.07 -1.97 -0.02 0.00 -0.52 0.00 0.00 37.83 35.26 2r59 s LYS 187 CO 0.03 0.44 -0.04 0.42 -0.92 0.00 0.00 175.35 175.27 2r59 s ILE 188 N -1.39 3.60 -0.02 2.17 1.01 0.65 -0.93 121.20 126.29 2r59 s ILE 188 Ca 0.19 -0.44 0.00 0.00 0.00 0.00 0.00 60.65 60.40 2r59 s ILE 188 Cb -0.09 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 2r59 s ILE 188 CO 0.10 0.46 0.02 -0.31 0.00 0.00 0.00 174.94 175.20 2r59 s TYR 189 N 0.91 3.13 0.21 3.97 2.02 -0.25 -1.26 117.35 126.09 2r59 s TYR 189 Ca -0.00 0.13 0.10 0.00 -0.37 0.00 0.00 57.07 56.93 2r59 s TYR 189 Cb -0.15 -1.71 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 2r59 s TYR 189 CO 0.01 0.48 -0.16 0.15 -1.57 0.00 0.00 175.55 174.46 2r59 s LYS 190 N -1.43 1.81 -0.05 -0.62 1.02 -0.65 -0.98 119.74 118.85 2r59 s LYS 190 Ca 0.19 -1.46 -0.15 0.00 0.02 0.00 0.00 55.97 54.57 2r59 s LYS 190 Cb -0.12 -1.98 0.03 0.00 -0.52 0.00 0.00 37.83 35.24 2r59 s LYS 190 CO 0.09 0.40 0.34 -0.06 -0.92 0.00 0.00 175.35 175.20 2r59 s PHE 191 N -1.86 -0.27 -0.04 3.18 0.08 -0.46 -0.27 117.98 118.35 2r59 s PHE 191 Ca 0.25 0.52 -0.01 0.00 0.12 0.00 0.00 56.93 57.80 2r59 s PHE 191 Cb -0.08 0.12 0.03 0.00 -0.57 0.00 0.00 43.02 42.52 2r59 s PHE 191 CO 0.13 -0.34 0.04 -1.50 -0.10 0.00 0.00 175.22 173.46 2r59 s ILE 192 N -0.84 -0.04 -0.36 0.64 1.10 -0.64 -1.95 121.20 119.10 2r59 s ILE 192 Ca -0.09 0.33 -0.02 0.00 -0.51 0.00 0.00 60.65 60.36 2r59 s ILE 192 Cb -0.04 -0.16 0.08 0.00 0.15 0.00 0.00 42.46 42.49 2r59 s ILE 192 CO 0.03 0.16 0.11 -1.58 -2.11 0.00 0.00 174.94 171.54 2r59 s GLN 193 N 1.76 2.12 0.00 3.50 2.00 0.69 -0.96 119.66 128.77 2r59 s GLN 193 Ca -0.00 -1.60 0.25 0.00 -2.00 0.00 0.00 55.36 52.01 2r59 s GLN 193 Cb -0.12 -3.38 0.51 0.00 0.80 0.00 0.00 33.01 30.82 2r59 s GLN 193 CO -0.03 -0.87 1.42 1.63 -0.50 0.00 0.00 175.29 176.93 2r59 n LYS 194 N 4.57 0.13 -3.64 1.67 5.02 -1.26 -1.82 118.16 122.83 2r59 n LYS 194 Ca -0.06 -0.08 -0.36 0.00 -2.02 0.00 0.00 58.31 55.79 2r59 n LYS 194 Cb 0.42 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.86 2r59 n LYS 194 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2r59 s VAL 195 N -2.92 5.35 0.23 -0.18 1.01 -1.26 -4.92 120.40 117.71 2r59 s VAL 195 Ca 0.13 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 2r59 s VAL 195 Cb 0.18 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.90 2r59 s VAL 195 CO 0.68 0.44 1.38 -2.84 0.00 0.00 0.00 175.10 174.76 2r59 s PRO 196 N 0.17 4.32 0.09 2.72 0.02 -1.26 -4.63 135.00 136.44 2r59 s PRO 196 Ca 0.14 2.20 0.02 0.00 0.02 0.00 0.00 61.00 63.38 2r59 s PRO 196 Cb -0.12 -3.14 -0.04 0.00 0.02 0.00 0.00 34.50 31.22 2r59 s PRO 196 CO 0.02 -0.34 -0.07 0.96 -0.33 0.00 0.00 177.00 177.25 2r59 s ILE 197 N -0.03 0.68 0.62 2.83 -4.36 0.54 -4.70 121.20 116.78 2r59 s ILE 197 Ca 0.58 -1.75 -0.16 0.00 -0.26 0.00 0.00 60.65 59.05 2r59 s ILE 197 Cb -0.40 -1.46 -0.02 0.00 1.25 0.00 0.00 42.46 41.84 2r59 s ILE 197 CO 0.42 -0.76 1.11 -2.16 0.24 0.00 0.00 174.94 173.79 2r59 s PRO 198 N -3.33 3.04 0.59 0.37 0.04 -1.26 -0.98 135.00 133.48 2r59 s PRO 198 Ca 0.07 1.42 0.37 0.00 0.04 0.00 0.00 61.00 62.91 2r59 s PRO 198 Cb 0.02 -1.98 1.82 0.00 0.04 0.00 0.00 34.50 34.40 2r59 s PRO 198 CO -0.03 -1.07 2.16 0.00 0.04 0.00 0.00 177.00 178.10 2r59 n TYR 200 N -3.17 0.39 0.88 0.00 0.18 -1.26 -2.05 117.16 112.13 2r59 n TYR 200 Ca -0.01 0.19 0.12 0.00 1.88 0.00 0.00 57.90 60.08 2r59 n TYR 200 Cb 0.20 -0.81 0.25 0.00 -0.38 0.00 0.00 39.34 38.59 2r59 n TYR 200 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2r59 n LEU 201 N -1.90 2.72 -4.71 -3.48 4.77 -0.86 -3.58 117.00 109.97 2r59 n LEU 201 Ca -0.00 -1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 54.52 2r59 n LEU 201 Cb 0.05 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2r59 n LEU 201 CO 0.07 0.52 0.99 -0.63 -1.33 0.00 0.00 177.39 177.01 2r59 s ILE 202 N -1.80 3.77 0.03 -0.08 1.01 -0.87 -4.40 121.20 118.87 2r59 s ILE 202 Ca 0.34 1.25 -0.02 0.00 0.00 0.00 0.00 60.65 62.22 2r59 s ILE 202 Cb 0.21 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.85 2r59 s ILE 202 CO 0.31 0.07 -0.00 0.00 0.00 0.00 0.00 174.94 175.32 2r59 s ALA 203 N 1.40 0.18 -0.11 9.38 0.00 -1.26 -4.51 121.76 126.83 2r59 s ALA 203 Ca 0.61 -0.73 -0.07 0.00 0.00 0.00 0.00 51.96 51.77 2r59 s ALA 203 Cb -0.32 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2r59 s ALA 203 CO 0.28 -0.25 0.27 -1.17 0.00 0.00 0.00 175.76 174.90 2r59 s LEU 204 N -1.97 0.59 -0.00 0.00 2.96 -1.26 -2.75 118.68 116.23 2r59 s LEU 204 Ca -0.08 0.57 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 2r59 s LEU 204 Cb -0.03 0.87 -0.01 0.00 0.50 0.00 0.00 46.19 47.51 2r59 s LEU 204 CO -0.04 -0.14 -0.14 0.54 -1.32 0.00 0.00 176.35 175.25 2r59 s VAL 205 N 0.83 1.11 -0.08 1.68 0.11 -0.66 -1.27 120.40 122.11 2r59 s VAL 205 Ca -0.06 -0.65 -0.00 0.00 -2.93 0.00 0.00 61.98 58.33 2r59 s VAL 205 Cb -0.07 -0.93 0.03 0.00 -1.53 0.00 0.00 36.38 33.87 2r59 s VAL 205 CO -0.05 0.27 -0.04 -0.69 -3.33 0.00 0.00 175.10 171.25 2r59 s VAL 206 N -0.40 0.69 0.02 2.04 1.01 -0.05 -0.90 120.40 122.81 2r59 s VAL 206 Ca 0.05 -0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 2r59 s VAL 206 Cb -0.06 -0.76 0.06 0.00 0.00 0.00 0.00 36.38 35.62 2r59 s VAL 206 CO -0.00 0.30 0.78 0.61 0.00 0.00 0.00 175.10 176.79 2r59 n GLY 207 N 4.86 0.50 3.51 4.51 0.00 -0.55 -0.09 105.19 117.92 2r59 n GLY 207 Ca -0.12 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 2r59 n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r59 n ALA 208 N -1.66 3.74 -2.79 4.61 0.00 -1.26 -0.97 120.51 122.18 2r59 n ALA 208 Ca -0.08 -3.94 -0.36 0.00 0.00 0.00 0.00 53.44 49.07 2r59 n ALA 208 Cb 0.37 -3.48 -0.07 0.00 0.00 0.00 0.00 19.45 16.27 2r59 n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r59 s LEU 209 N 3.50 4.00 0.29 0.00 1.43 -1.26 -4.33 118.68 122.31 2r59 s LEU 209 Ca 0.51 0.30 0.10 0.00 -1.03 0.00 0.00 54.13 54.00 2r59 s LEU 209 Cb 0.03 -2.00 -0.06 0.00 0.03 0.00 0.00 46.19 44.19 2r59 s LEU 209 CO 0.05 0.38 -0.13 -1.61 0.23 0.00 0.00 176.35 175.27 2r59 s GLU 210 N -1.07 1.64 0.10 1.70 2.02 -0.15 -4.87 118.70 118.07 2r59 s GLU 210 Ca 0.16 -1.80 0.04 0.00 0.02 0.00 0.00 54.97 53.39 2r59 s GLU 210 Cb -0.12 -1.53 -0.04 0.00 0.10 0.00 0.00 34.13 32.54 2r59 s GLU 210 CO 0.05 0.19 -0.11 -1.54 0.02 0.00 0.00 175.26 173.87 2r59 s SER 211 N -3.50 1.62 -0.01 -0.19 1.04 -1.26 -2.05 113.70 109.36 2r59 s SER 211 Ca 0.29 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.93 2r59 s SER 211 Cb -0.00 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.10 2r59 s SER 211 CO 0.14 -0.22 -0.03 -0.60 0.98 0.00 0.00 173.24 173.51 2r59 s ARG 212 N -2.71 0.27 0.17 4.02 3.52 -0.03 -4.96 118.95 119.23 2r59 s ARG 212 Ca 0.06 -0.09 -0.30 0.00 -0.13 0.00 0.00 55.73 55.27 2r59 s ARG 212 Cb -0.04 -0.28 -0.07 0.00 -1.56 0.00 0.00 34.95 33.00 2r59 s ARG 212 CO 0.01 0.04 0.96 -1.14 -0.81 0.00 0.00 175.30 174.36 2r59 s GLN 213 N 0.07 4.76 0.00 5.12 0.74 -1.26 -0.60 119.66 128.48 2r59 s GLN 213 Ca -0.00 1.48 0.00 0.00 0.05 0.00 0.00 55.36 56.89 2r59 s GLN 213 Cb -0.03 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.75 2r59 s GLN 213 CO -0.00 0.33 0.14 0.44 -0.55 0.00 0.00 175.29 175.64 2r59 n ILE 214 N 2.23 0.00 -3.82 -2.34 -5.35 0.02 -4.93 119.36 105.18 2r59 n ILE 214 Ca 0.01 -0.25 -0.06 0.00 -0.27 0.00 0.00 62.75 62.18 2r59 n ILE 214 Cb 0.48 1.26 -0.01 0.00 -1.74 0.00 0.00 39.64 39.64 2r59 n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2r59 s GLY 215 N -0.24 -0.04 0.54 3.28 0.00 -1.04 -4.85 107.32 104.97 2r59 s GLY 215 Ca 0.00 -0.23 0.25 0.00 0.00 0.00 0.00 44.72 44.74 2r59 s GLY 215 CO 0.00 0.18 2.16 -0.56 0.00 0.00 0.00 173.10 174.88 2r59 h PRO 216 N 2.00 0.00 0.00 2.90 0.13 -2.00 -2.92 132.00 132.10 2r59 h PRO 216 Ca -0.24 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 2r59 h PRO 216 Cb 1.24 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 2r59 h PRO 216 CO 0.28 0.05 -0.64 2.89 -0.23 0.00 0.00 178.00 180.36 2r59 n ARG 217 N -3.99 0.97 -3.71 0.86 1.85 -1.26 -5.05 116.66 106.33 2r59 n ARG 217 Ca -0.03 -2.72 -0.18 0.00 -1.00 0.00 0.00 57.85 53.93 2r59 n ARG 217 Cb 0.14 -1.03 -0.17 0.00 -1.05 0.00 0.00 32.46 30.36 2r59 n ARG 217 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2r59 s THR 218 N -2.00 -0.09 0.04 8.89 2.01 -1.11 -0.57 115.64 122.82 2r59 s THR 218 Ca 0.34 0.33 0.04 0.00 0.31 0.00 0.00 61.69 62.72 2r59 s THR 218 Cb 0.35 -0.12 -0.04 0.00 0.01 0.00 0.00 72.50 72.70 2r59 s THR 218 CO -0.09 0.14 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.18 2r59 s LEU 219 N 1.69 3.32 -0.14 4.42 1.02 -1.26 -0.80 118.68 126.93 2r59 s LEU 219 Ca -0.01 -0.15 -0.06 0.00 0.02 0.00 0.00 54.13 53.93 2r59 s LEU 219 Cb -0.12 -1.98 -0.04 0.00 0.02 0.00 0.00 46.19 44.07 2r59 s LEU 219 CO -0.03 0.24 0.08 0.54 0.02 0.00 0.00 176.35 177.19 2r59 s VAL 220 N -1.14 4.95 -0.06 -1.59 0.11 0.23 -0.96 120.40 121.94 2r59 s VAL 220 Ca 0.21 0.01 0.06 0.00 -2.93 0.00 0.00 61.98 59.32 2r59 s VAL 220 Cb -0.11 -3.17 -0.01 0.00 -1.53 0.00 0.00 36.38 31.56 2r59 s VAL 220 CO 0.12 0.55 -0.24 0.26 -3.33 0.00 0.00 175.10 172.46 2r59 s TRP 221 N -0.44 2.46 0.28 1.54 0.52 0.19 -0.85 118.94 122.65 2r59 s TRP 221 Ca 0.10 -0.75 -0.18 0.00 0.02 0.00 0.00 56.10 55.29 2r59 s TRP 221 Cb -0.12 -1.62 0.07 0.00 -1.15 0.00 0.00 33.47 30.65 2r59 s TRP 221 CO 0.02 -0.23 0.91 -1.13 0.02 0.00 0.00 176.95 176.54 2r59 n SER 222 N 3.01 -1.98 -4.73 2.95 3.41 -0.87 -0.78 113.62 114.63 2r59 n SER 222 Ca -0.18 -2.21 -0.33 0.00 -0.26 0.00 0.00 58.87 55.89 2r59 n SER 222 Cb 0.52 3.26 0.09 0.00 -0.26 0.00 0.00 64.21 67.83 2r59 n SER 222 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2r59 s GLU 223 N -2.07 2.14 0.25 4.33 2.02 -1.26 -0.98 118.70 123.13 2r59 s GLU 223 Ca 0.19 1.62 -0.03 0.00 0.02 0.00 0.00 54.97 56.77 2r59 s GLU 223 Cb -0.04 -1.85 0.48 0.00 0.10 0.00 0.00 34.13 32.82 2r59 s GLU 223 CO 0.08 -1.81 1.74 -0.22 0.02 0.00 0.00 175.26 175.08 2r59 h LYS 224 N -0.48 0.48 -0.05 1.61 3.64 -1.92 -1.61 116.57 118.24 2r59 h LYS 224 Ca -0.47 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.90 2r59 h LYS 224 Cb 1.28 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2r59 h LYS 224 CO 0.50 0.31 0.05 0.93 -2.27 0.00 0.00 179.45 178.97 2r59 h GLU 225 N 0.49 0.00 -0.01 1.90 3.07 -1.95 -2.59 114.58 115.50 2r59 h GLU 225 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 2r59 h GLU 225 Cb 0.64 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 2r59 h GLU 225 CO -0.39 0.00 -0.76 1.04 -1.40 0.00 0.00 179.01 177.50 2r59 n GLN 226 N -3.89 0.40 -0.09 2.33 3.00 -0.62 -4.67 117.38 113.85 2r59 n GLN 226 Ca -0.02 -0.33 -0.10 0.00 -0.01 0.00 0.00 57.00 56.55 2r59 n GLN 226 Cb 0.14 -1.49 -0.03 0.00 0.00 0.00 0.00 30.24 28.86 2r59 n GLN 226 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2r59 h VAL 227 N 0.79 1.17 -0.34 5.09 2.07 -1.31 -1.29 116.25 122.44 2r59 h VAL 227 Ca 0.00 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2r59 h VAL 227 Cb 0.58 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2r59 h VAL 227 CO 0.00 0.18 0.07 -0.08 0.02 0.00 0.00 177.57 177.76 2r59 h GLU 228 N 0.31 0.54 -0.78 1.57 4.81 -1.83 -0.91 114.58 118.29 2r59 h GLU 228 Ca 0.09 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 2r59 h GLU 228 Cb 0.17 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 2r59 h GLU 228 CO -0.01 0.61 0.41 -0.22 -0.73 0.00 0.00 179.01 179.07 2r59 h LYS 229 N 0.39 1.10 -0.52 1.92 3.64 -1.83 -2.85 116.57 118.41 2r59 h LYS 229 Ca 0.10 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 2r59 h LYS 229 Cb 0.32 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2r59 h LYS 229 CO 0.00 0.82 -0.06 0.77 -2.27 0.00 0.00 179.45 178.71 2r59 h SER 230 N 1.10 0.91 -0.71 4.20 0.02 -0.89 -0.65 113.55 117.53 2r59 h SER 230 Ca 0.27 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2r59 h SER 230 Cb 0.06 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 2r59 h SER 230 CO -0.04 1.00 0.33 0.00 -1.14 0.00 0.00 176.83 176.98 2r59 h ALA 231 N 1.08 1.20 -0.01 3.77 0.00 -0.95 -1.33 119.26 123.01 2r59 h ALA 231 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2r59 h ALA 231 Cb 0.58 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2r59 h ALA 231 CO 0.04 0.60 -0.07 -0.92 0.00 0.00 0.00 179.25 178.89 2r59 h TYR 232 N 1.05 0.10 -0.98 0.00 3.20 -1.42 -2.98 116.97 115.93 2r59 h TYR 232 Ca 0.25 -0.04 0.16 0.00 3.14 0.00 0.00 58.73 62.24 2r59 h TYR 232 Cb 0.14 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 38.31 2r59 h TYR 232 CO 0.01 0.73 0.61 1.49 -1.64 0.00 0.00 178.16 179.37 2r59 h GLU 233 N -0.56 0.78 -0.46 1.82 4.57 -0.79 -2.57 114.58 117.37 2r59 h GLU 233 Ca -0.00 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.01 2r59 h GLU 233 Cb 0.74 -0.18 -0.07 0.00 -0.16 0.00 0.00 28.75 29.09 2r59 h GLU 233 CO 0.01 0.51 0.08 1.19 -1.18 0.00 0.00 179.01 179.63 2r59 n PHE 234 N -4.67 1.54 0.38 0.92 3.72 -0.53 -4.61 117.46 114.21 2r59 n PHE 234 Ca 0.21 -1.16 0.12 0.00 -0.05 0.00 0.00 57.45 56.57 2r59 n PHE 234 Cb 0.50 -0.49 0.51 0.00 -0.94 0.00 0.00 39.48 39.06 2r59 n PHE 234 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2r59 h SER 235 N 1.95 0.00 -0.05 4.37 4.64 -1.29 -2.20 113.55 120.97 2r59 h SER 235 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2r59 h SER 235 Cb 1.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 2r59 h SER 235 CO 0.45 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.79 2r59 n GLU 236 N -2.31 1.38 -0.17 4.77 1.02 -1.26 -4.43 120.64 119.64 2r59 n GLU 236 Ca 0.02 -0.56 -0.03 0.00 -0.02 0.00 0.00 57.16 56.56 2r59 n GLU 236 Cb 0.23 -1.41 0.06 0.00 -0.02 0.00 0.00 31.44 30.30 2r59 n GLU 236 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2r59 h THR 237 N 1.23 0.89 -0.62 2.62 2.02 -1.77 -2.32 112.91 114.96 2r59 h THR 237 Ca 0.00 -0.15 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 2r59 h THR 237 Cb 0.27 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2r59 h THR 237 CO 0.00 0.08 0.14 -0.08 0.37 0.00 0.00 175.52 176.03 2r59 h GLU 238 N 0.44 0.98 -0.64 6.66 4.57 -1.85 0.23 114.58 124.97 2r59 h GLU 238 Ca 0.24 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 58.21 2r59 h GLU 238 Cb 0.21 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 2r59 h GLU 238 CO -0.20 0.88 0.42 0.77 -1.18 0.00 0.00 179.01 179.69 2r59 h SER 239 N 0.93 0.72 -0.32 1.04 0.02 -1.78 -1.07 113.55 113.09 2r59 h SER 239 Ca 0.20 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 2r59 h SER 239 Cb 0.35 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2r59 h SER 239 CO 0.00 0.52 0.02 0.24 -1.14 0.00 0.00 176.83 176.47 2r59 h MET 240 N 0.85 0.55 -0.58 3.45 2.86 -1.03 -2.32 114.93 118.71 2r59 h MET 240 Ca 0.24 -0.17 0.07 0.00 -2.06 0.00 0.00 59.70 57.78 2r59 h MET 240 Cb -0.08 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.46 2r59 h MET 240 CO -0.06 0.67 0.27 -0.07 1.06 0.00 0.00 176.91 178.77 2r59 h LEU 241 N 0.36 0.34 -0.49 1.22 3.38 -0.76 0.11 115.31 119.47 2r59 h LEU 241 Ca 0.09 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.16 2r59 h LEU 241 Cb 0.41 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 2r59 h LEU 241 CO 0.01 0.22 0.24 0.11 0.09 0.00 0.00 178.44 179.11 2r59 h LYS 242 N 0.49 0.45 -0.66 1.13 1.79 -1.12 -0.32 116.57 118.34 2r59 h LYS 242 Ca 0.28 -0.03 -0.08 0.00 -2.18 0.00 0.00 60.65 58.64 2r59 h LYS 242 Cb 0.26 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.78 2r59 h LYS 242 CO -0.23 0.30 0.10 0.82 -1.08 0.00 0.00 179.45 179.36 2r59 h ILE 243 N 0.47 1.26 -0.87 1.86 2.04 -1.13 -1.59 117.51 119.54 2r59 h ILE 243 Ca 0.22 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 2r59 h ILE 243 Cb 0.14 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 2r59 h ILE 243 CO -0.16 0.39 0.50 0.00 0.00 0.00 0.00 178.15 178.88 2r59 h ALA 244 N 1.04 1.12 -0.26 1.87 0.00 -0.40 -1.51 119.26 121.12 2r59 h ALA 244 Ca 0.20 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2r59 h ALA 244 Cb 0.45 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2r59 h ALA 244 CO 0.01 0.60 -0.28 0.93 0.00 0.00 0.00 179.25 180.51 2r59 h GLU 245 N 1.21 0.51 -0.86 0.00 5.08 -0.67 0.78 114.58 120.63 2r59 h GLU 245 Ca 0.31 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2r59 h GLU 245 Cb -0.01 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 2r59 h GLU 245 CO -0.05 0.75 0.50 0.22 -1.00 0.00 0.00 179.01 179.43 2r59 h ASP 246 N 0.45 1.04 0.22 1.42 3.58 -0.34 -0.95 116.42 121.83 2r59 h ASP 246 Ca 0.06 -0.07 -0.27 0.00 0.42 0.00 0.00 57.03 57.17 2r59 h ASP 246 Cb 0.72 -0.26 0.02 0.00 1.72 0.00 0.00 39.33 41.53 2r59 h ASP 246 CO 0.06 0.80 -1.12 -0.07 -2.88 0.00 0.00 179.24 176.03 2r59 h LEU 247 N 1.18 0.74 0.00 2.28 4.07 -0.56 -3.40 115.31 119.63 2r59 h LEU 247 Ca 0.31 -0.65 0.00 0.00 0.08 0.00 0.00 57.88 57.62 2r59 h LEU 247 Cb -0.03 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.48 2r59 h LEU 247 CO -0.06 1.46 -0.91 0.61 -1.08 0.00 0.00 178.44 178.46 2r59 n GLY 248 N 1.21 -0.02 0.00 0.83 0.00 0.20 -4.25 105.19 103.16 2r59 n GLY 248 Ca -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2r59 n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r59 n GLY 249 N 1.76 0.58 3.58 -0.02 0.00 -0.37 -4.80 105.19 105.91 2r59 n GLY 249 Ca -0.00 -2.19 -0.46 0.00 0.00 0.00 0.00 46.02 43.37 2r59 n GLY 249 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2r59 n PRO 250 N -0.31 1.22 -2.36 1.61 -0.02 -1.26 -4.42 135.00 129.46 2r59 n PRO 250 Ca 0.00 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 2r59 n PRO 250 Cb 0.00 -1.82 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 2r59 n PRO 250 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2r59 s TYR 251 N -0.77 2.62 -2.51 6.00 5.04 -1.26 -4.93 117.35 121.54 2r59 s TYR 251 Ca 0.64 0.84 0.25 0.00 -2.44 0.00 0.00 57.07 56.35 2r59 s TYR 251 Cb -0.76 -3.82 0.34 0.00 0.35 0.00 0.00 41.96 38.08 2r59 s TYR 251 CO 0.57 -1.95 1.33 1.33 -1.34 0.00 0.00 175.55 175.49 2r59 n VAL 252 N 6.01 0.00 1.25 3.14 0.24 -1.26 -4.47 118.33 123.23 2r59 n VAL 252 Ca 0.15 -0.35 0.13 0.00 -2.04 0.00 0.00 64.34 62.23 2r59 n VAL 252 Cb 0.46 1.14 0.31 0.00 -1.47 0.00 0.00 33.84 34.28 2r59 n VAL 252 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2r59 n TRP 253 N 0.54 0.00 0.00 6.34 7.02 -1.26 -5.00 117.44 125.09 2r59 n TRP 253 Ca 0.13 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.61 2r59 n TRP 253 Cb 0.49 -0.02 0.00 0.00 -2.42 0.00 0.00 31.31 29.36 2r59 n TRP 253 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2r59 n GLY 254 N 1.29 2.06 3.88 6.99 0.00 -1.26 -4.78 105.19 113.37 2r59 n GLY 254 Ca 0.15 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2r59 n GLY 254 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2r59 s GLN 255 N 0.00 3.68 -0.48 1.61 2.00 -1.26 -4.96 119.66 120.24 2r59 s GLN 255 Ca 0.00 0.06 0.03 0.00 -2.00 0.00 0.00 55.36 53.45 2r59 s GLN 255 Cb 0.00 -3.03 0.13 0.00 0.80 0.00 0.00 33.01 30.91 2r59 s GLN 255 CO 0.00 0.59 0.25 -0.47 -0.50 0.00 0.00 175.29 175.16 2r59 s TYR 256 N -1.37 2.71 0.29 1.67 5.04 0.27 -4.26 117.35 121.70 2r59 s TYR 256 Ca 0.31 -2.87 0.06 0.00 -2.44 0.00 0.00 57.07 52.13 2r59 s TYR 256 Cb -0.14 -2.45 -0.02 0.00 0.35 0.00 0.00 41.96 39.70 2r59 s TYR 256 CO 0.18 -0.76 0.38 -0.51 -1.34 0.00 0.00 175.55 173.50 2r59 s ASP 257 N -0.02 5.96 -0.02 4.32 -0.00 -0.87 -4.08 116.67 121.96 2r59 s ASP 257 Ca 0.17 -0.15 0.06 0.00 -0.00 0.00 0.00 52.55 52.63 2r59 s ASP 257 Cb -0.25 -1.43 -0.01 0.00 -0.00 0.00 0.00 42.92 41.22 2r59 s ASP 257 CO -0.00 -0.26 -0.19 -0.76 -0.00 0.00 0.00 175.17 173.96 2r59 s LEU 258 N -4.05 2.03 -0.16 1.23 1.43 -0.13 -1.28 118.68 117.74 2r59 s LEU 258 Ca 0.39 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 2r59 s LEU 258 Cb -0.09 -1.01 0.02 0.00 0.03 0.00 0.00 46.19 45.14 2r59 s LEU 258 CO 0.29 0.23 -0.17 -0.22 0.23 0.00 0.00 176.35 176.71 2r59 s LEU 259 N -0.42 1.91 -0.36 1.79 2.96 -0.23 -0.64 118.68 123.69 2r59 s LEU 259 Ca 0.06 -0.57 -0.20 0.00 -0.22 0.00 0.00 54.13 53.21 2r59 s LEU 259 Cb -0.08 -1.33 0.00 0.00 0.50 0.00 0.00 46.19 45.29 2r59 s LEU 259 CO -0.00 -0.02 0.62 -0.69 -1.32 0.00 0.00 176.35 174.93 2r59 s VAL 260 N 1.37 4.90 0.81 1.68 1.01 0.04 -0.58 120.40 129.63 2r59 s VAL 260 Ca 0.05 0.52 -0.10 0.00 0.00 0.00 0.00 61.98 62.44 2r59 s VAL 260 Cb -0.13 -4.07 0.11 0.00 0.00 0.00 0.00 36.38 32.29 2r59 s VAL 260 CO -0.11 -0.33 1.15 -0.76 0.00 0.00 0.00 175.10 175.04 2r59 s LEU 261 N 2.68 2.72 0.96 3.92 1.02 -0.35 -4.60 118.68 125.04 2r59 s LEU 261 Ca 0.24 0.41 -0.12 0.00 0.02 0.00 0.00 54.13 54.67 2r59 s LEU 261 Cb -0.15 -2.81 0.17 0.00 0.02 0.00 0.00 46.19 43.42 2r59 s LEU 261 CO 0.15 -2.03 1.09 -2.84 0.02 0.00 0.00 176.35 172.74 2r59 s PRO 262 N -5.51 0.72 0.62 1.29 0.02 -1.26 -4.01 135.00 126.87 2r59 s PRO 262 Ca 0.65 0.66 0.36 0.00 0.02 0.00 0.00 61.00 62.68 2r59 s PRO 262 Cb -0.08 -1.76 2.06 0.00 0.02 0.00 0.00 34.50 34.73 2r59 s PRO 262 CO 0.48 -2.57 2.29 -1.35 -0.33 0.00 0.00 177.00 175.52 2r59 h PRO 263 N -1.78 0.00 0.00 5.54 0.11 -1.88 -2.40 132.00 131.58 2r59 h PRO 263 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2r59 h PRO 263 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2r59 h PRO 263 CO 0.56 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 2r59 n SER 264 N -3.52 0.00 -4.67 -2.05 3.41 -1.26 0.28 113.62 105.80 2r59 n SER 264 Ca -0.03 -0.11 -0.51 0.00 -0.26 0.00 0.00 58.87 57.96 2r59 n SER 264 Cb 0.10 -0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 63.72 2r59 n SER 264 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2r59 n PHE 265 N -1.27 2.13 0.41 7.33 7.35 -0.90 -4.57 117.46 127.93 2r59 n PHE 265 Ca 0.12 0.28 0.13 0.00 -0.76 0.00 0.00 57.45 57.23 2r59 n PHE 265 Cb 0.20 -2.54 0.45 0.00 0.35 0.00 0.00 39.48 37.94 2r59 n PHE 265 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 2r59 h PRO 266 N 7.39 0.00 -6.04 -7.13 0.13 -1.89 -3.24 132.00 121.22 2r59 h PRO 266 Ca -0.47 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.07 2r59 h PRO 266 Cb 1.29 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.31 2r59 h PRO 266 CO 0.92 0.00 -0.63 0.71 -0.23 0.00 0.00 178.00 178.77 2r59 s TYR 267 N -3.31 2.54 0.15 1.56 1.51 -1.26 -0.76 117.35 117.78 2r59 s TYR 267 Ca 0.06 -0.42 -0.12 0.00 -1.01 0.00 0.00 57.07 55.58 2r59 s TYR 267 Cb 0.09 -1.44 0.01 0.00 -0.11 0.00 0.00 41.96 40.51 2r59 s TYR 267 CO 0.53 0.50 1.58 0.78 -1.11 0.00 0.00 175.55 177.83 2r59 h GLY 268 N 1.84 0.95 -2.53 0.71 0.00 -1.94 -3.35 103.07 98.76 2r59 h GLY 268 Ca -0.43 -0.74 -0.05 0.00 0.00 0.00 0.00 47.33 46.11 2r59 h GLY 268 CO 0.66 0.68 -0.11 -0.32 0.00 0.00 0.00 176.54 177.44 2r59 s GLY 269 N -3.49 0.27 -0.10 4.60 0.00 -1.26 -1.40 107.32 105.95 2r59 s GLY 269 Ca -0.12 -0.62 -0.04 0.00 0.00 0.00 0.00 44.72 43.93 2r59 s GLY 269 CO 0.83 -0.54 0.21 -0.29 0.00 0.00 0.00 173.10 173.31 2r59 s MET 270 N -3.95 0.15 -0.09 2.90 1.75 0.10 -4.97 119.30 115.19 2r59 s MET 270 Ca 0.16 0.52 -0.01 0.00 -1.25 0.00 0.00 55.69 55.10 2r59 s MET 270 Cb 0.00 -0.14 0.03 0.00 2.84 0.00 0.00 34.83 37.56 2r59 s MET 270 CO 0.02 -0.19 2.19 -0.85 -0.65 0.00 0.00 175.02 175.53 2r59 n GLU 271 N 4.45 1.33 -1.70 4.11 0.00 -1.26 -1.05 120.64 126.52 2r59 n GLU 271 Ca -0.22 -0.53 -0.43 0.00 0.00 0.00 0.00 57.16 55.98 2r59 n GLU 271 Cb 0.52 -1.27 -0.03 0.00 0.00 0.00 0.00 31.44 30.65 2r59 n GLU 271 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2r59 n ASN 272 N 1.31 3.83 -4.75 -1.84 5.03 -1.26 -4.84 115.26 112.75 2r59 n ASN 272 Ca 0.13 1.04 -0.42 0.00 0.87 0.00 0.00 54.58 56.20 2r59 n ASN 272 Cb 0.56 -1.53 -0.01 0.00 -1.02 0.00 0.00 39.78 37.77 2r59 n ASN 272 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 2r59 n PRO 273 N 4.49 2.74 0.00 3.52 -0.04 -1.26 -1.90 135.00 142.55 2r59 n PRO 273 Ca 0.17 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.60 2r59 n PRO 273 Cb 0.34 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 2r59 n PRO 273 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r59 n LEU 275 N 0.00 -2.16 -4.75 0.00 7.94 -0.80 -2.05 117.00 115.18 2r59 n LEU 275 Ca 0.00 -3.56 -0.41 0.00 -1.11 0.00 0.00 56.01 50.92 2r59 n LEU 275 Cb 0.00 0.67 -0.02 0.00 0.53 0.00 0.00 43.42 44.60 2r59 n LEU 275 CO 0.00 1.91 1.19 -0.89 -1.11 0.00 0.00 177.39 178.49 2r59 s THR 276 N 0.51 2.32 -0.03 1.96 2.01 -0.41 -4.12 115.64 117.89 2r59 s THR 276 Ca 0.31 0.27 -0.15 0.00 0.31 0.00 0.00 61.69 62.43 2r59 s THR 276 Cb 0.02 -3.17 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 2r59 s THR 276 CO -0.12 0.04 0.41 -0.36 -0.69 0.00 0.00 174.62 173.90 2r59 s PHE 277 N 0.08 3.69 0.06 4.92 0.40 -0.21 -1.07 117.98 125.84 2r59 s PHE 277 Ca 0.62 0.95 0.04 0.00 -0.60 0.00 0.00 56.93 57.94 2r59 s PHE 277 Cb -0.45 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 40.73 2r59 s PHE 277 CO 0.45 0.56 -0.11 0.14 0.70 0.00 0.00 175.22 176.96 2r59 s VAL 278 N -0.78 0.85 0.32 -0.44 -7.23 0.26 -0.73 120.40 112.65 2r59 s VAL 278 Ca 0.23 -1.28 -0.27 0.00 -1.81 0.00 0.00 61.98 58.85 2r59 s VAL 278 Cb -0.16 -0.94 -0.09 0.00 0.56 0.00 0.00 36.38 35.74 2r59 s VAL 278 CO 0.12 -0.35 1.04 0.28 -0.31 0.00 0.00 175.10 175.88 2r59 s THR 279 N -1.54 3.73 -1.68 5.32 -1.32 -0.49 -1.21 115.64 118.44 2r59 s THR 279 Ca -0.04 1.56 0.22 0.00 -1.21 0.00 0.00 61.69 62.22 2r59 s THR 279 Cb -0.09 -3.93 0.49 0.00 -1.51 0.00 0.00 72.50 67.46 2r59 s THR 279 CO 0.01 0.24 1.69 -0.81 -2.21 0.00 0.00 174.62 173.54 2r59 n PRO 280 N 0.75 0.48 0.00 7.08 -0.04 -1.26 -2.57 135.00 139.45 2r59 n PRO 280 Ca 0.01 0.05 0.07 0.00 -0.04 0.00 0.00 63.50 63.58 2r59 n PRO 280 Cb 0.47 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.80 2r59 n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2r59 n THR 281 N -1.16 0.31 0.81 0.52 -2.24 -1.26 -1.87 114.28 109.39 2r59 n THR 281 Ca 0.13 0.08 0.13 0.00 -2.27 0.00 0.00 64.05 62.12 2r59 n THR 281 Cb 0.13 -0.86 0.50 0.00 -2.10 0.00 0.00 70.33 68.00 2r59 n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2r59 n LEU 282 N -1.13 0.41 -3.65 3.22 4.77 -1.06 -4.48 117.00 115.08 2r59 n LEU 282 Ca 0.08 0.53 -0.41 0.00 -0.03 0.00 0.00 56.01 56.18 2r59 n LEU 282 Cb 0.07 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 40.75 2r59 n LEU 282 CO 0.09 -0.09 2.56 0.18 -1.33 0.00 0.00 177.39 178.80 2r59 n LEU 283 N -1.88 7.37 0.25 2.23 4.77 -0.78 -4.63 117.00 124.33 2r59 n LEU 283 Ca 0.06 -4.47 0.16 0.00 -0.03 0.00 0.00 56.01 51.73 2r59 n LEU 283 Cb 0.39 -1.53 0.57 0.00 -2.33 0.00 0.00 43.42 40.51 2r59 n LEU 283 CO 0.29 1.54 0.95 0.00 -1.33 0.00 0.00 177.39 178.83 2r59 h ALA 284 N 5.50 1.00 0.00 -1.18 0.00 -1.87 -3.47 119.26 119.23 2r59 h ALA 284 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.51 2r59 h ALA 284 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2r59 h ALA 284 CO 1.72 0.00 0.00 0.41 0.00 0.00 0.00 179.25 181.38 2r59 n GLY 285 N 0.25 1.66 0.17 0.00 0.00 -1.26 -4.78 105.19 101.24 2r59 n GLY 285 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 2r59 n GLY 285 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2r59 n ASP 286 N 0.00 0.45 -0.63 1.61 5.75 -1.26 -5.01 116.55 117.46 2r59 n ASP 286 Ca 0.00 -1.64 -0.08 0.00 -0.01 0.00 0.00 54.79 53.06 2r59 n ASP 286 Cb 0.00 -0.11 -0.04 0.00 -1.03 0.00 0.00 41.12 39.95 2r59 n ASP 286 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2r59 n LYS 287 N -0.19 -1.55 0.20 0.11 5.02 -1.26 -4.88 118.16 115.61 2r59 n LYS 287 Ca 0.01 0.76 0.15 0.00 -2.02 0.00 0.00 58.31 57.21 2r59 n LYS 287 Cb 0.55 -5.07 0.64 0.00 -0.02 0.00 0.00 35.03 31.13 2r59 n LYS 287 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2r59 h SER 288 N 0.00 0.00 -0.55 4.39 4.64 -1.93 -2.85 113.55 117.26 2r59 h SER 288 Ca -0.17 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.03 2r59 h SER 288 Cb 1.03 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.04 2r59 h SER 288 CO 0.25 0.00 0.12 0.18 -0.87 0.00 0.00 176.83 176.51 2r59 n LEU 289 N -2.59 5.27 0.00 5.97 4.77 -1.26 -4.64 117.00 124.52 2r59 n LEU 289 Ca 0.01 -3.19 0.05 0.00 -0.03 0.00 0.00 56.01 52.84 2r59 n LEU 289 Cb 0.21 -0.67 0.22 0.00 -2.33 0.00 0.00 43.42 40.84 2r59 n LEU 289 CO 0.21 0.80 0.64 -1.54 -1.33 0.00 0.00 177.39 176.17 2r59 n SER 290 N -0.25 0.00 0.23 -1.43 3.41 -1.08 -2.50 113.62 112.01 2r59 n SER 290 Ca 0.33 0.42 0.08 0.00 -0.26 0.00 0.00 58.87 59.45 2r59 n SER 290 Cb 1.20 -0.45 0.58 0.00 -0.26 0.00 0.00 64.21 65.27 2r59 n SER 290 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2r59 h ASN 291 N 0.00 0.00 -0.80 4.04 -1.07 -1.88 -0.73 115.58 115.13 2r59 h ASN 291 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 56.30 56.40 2r59 h ASN 291 Cb 0.15 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 36.35 2r59 h ASN 291 CO 0.00 0.19 0.51 0.58 0.07 0.00 0.00 177.43 178.78 2r59 h VAL 292 N 0.00 1.11 -0.37 6.14 2.07 -1.89 0.24 116.25 123.55 2r59 h VAL 292 Ca -0.00 -0.34 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 2r59 h VAL 292 Cb 0.40 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2r59 h VAL 292 CO 0.02 0.18 -0.41 0.40 0.02 0.00 0.00 177.57 177.78 2r59 h ILE 293 N 0.99 1.27 -0.96 4.57 1.08 -1.38 0.31 117.51 123.38 2r59 h ILE 293 Ca 0.32 -1.59 0.09 0.00 -0.39 0.00 0.00 64.86 63.30 2r59 h ILE 293 Cb 0.03 1.43 -0.07 0.00 -3.07 0.00 0.00 36.82 35.13 2r59 h ILE 293 CO -0.12 0.53 0.61 0.00 -0.69 0.00 0.00 178.15 178.48 2r59 h ALA 294 N 0.75 1.38 0.06 1.87 0.00 -1.06 0.18 119.26 122.45 2r59 h ALA 294 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2r59 h ALA 294 Cb 1.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2r59 h ALA 294 CO 0.10 0.31 -0.03 1.25 0.00 0.00 0.00 179.25 180.88 2r59 h HIS 295 N 1.04 -0.08 -0.76 0.00 -0.00 -0.51 -1.65 115.15 113.19 2r59 h HIS 295 Ca 0.44 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.81 2r59 h HIS 295 Cb 0.30 0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 27.70 2r59 h HIS 295 CO -0.01 0.25 0.46 0.93 -0.00 0.00 0.00 177.93 179.56 2r59 h GLU 296 N -0.42 1.03 -0.52 5.26 4.39 -0.38 -2.28 114.58 121.67 2r59 h GLU 296 Ca -0.01 -0.09 0.04 0.00 0.34 0.00 0.00 59.36 59.64 2r59 h GLU 296 Cb 0.37 -0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 2r59 h GLU 296 CO 0.01 0.72 0.29 0.82 -1.16 0.00 0.00 179.01 179.69 2r59 h ILE 297 N 1.04 1.00 -0.09 3.13 2.04 -0.66 -2.58 117.51 121.40 2r59 h ILE 297 Ca 0.27 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2r59 h ILE 297 Cb -0.05 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 2r59 h ILE 297 CO -0.05 0.10 -0.03 0.28 0.00 0.00 0.00 178.15 178.45 2r59 h SER 298 N 0.56 0.11 0.11 1.72 0.02 -0.77 -0.96 113.55 114.34 2r59 h SER 298 Ca 0.22 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2r59 h SER 298 Cb 0.08 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2r59 h SER 298 CO -0.13 0.16 0.00 0.45 -1.14 0.00 0.00 176.83 176.18 2r59 h HIS 299 N 0.12 0.00 0.00 3.45 3.86 -1.00 -1.48 115.15 120.10 2r59 h HIS 299 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2r59 h HIS 299 Cb 0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 2r59 h HIS 299 CO 0.00 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.56 2r59 h SER 300 N 0.00 0.00 0.00 2.45 0.02 -1.24 -1.54 113.55 113.24 2r59 h SER 300 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2r59 h SER 300 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2r59 h SER 300 CO 0.00 0.00 -0.54 0.79 -1.14 0.00 0.00 176.83 175.94 2r59 n TRP 301 N -2.46 0.00 -2.94 3.45 8.01 -0.59 -4.04 117.44 118.87 2r59 n TRP 301 Ca 0.00 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.76 2r59 n TRP 301 Cb 0.16 -0.27 -0.04 0.00 -2.01 0.00 0.00 31.31 29.15 2r59 n TRP 301 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 2r59 s THR 302 N -2.38 4.50 0.00 -0.99 -4.23 -1.00 -2.07 115.64 109.46 2r59 s THR 302 Ca -0.16 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.95 2r59 s THR 302 Cb 0.02 -4.58 0.00 0.00 1.34 0.00 0.00 72.50 69.28 2r59 s THR 302 CO 0.23 -1.26 0.00 0.61 -0.54 0.00 0.00 174.62 173.66 2r59 n GLY 303 N 5.27 2.96 0.10 3.99 0.00 0.14 -4.21 105.19 113.43 2r59 n GLY 303 Ca -0.04 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.30 2r59 n GLY 303 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2r59 h ASN 304 N 0.00 0.00 0.00 1.61 2.35 -1.38 -3.32 115.58 114.84 2r59 h ASN 304 Ca 0.00 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.42 2r59 h ASN 304 Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 2r59 h ASN 304 CO 0.00 0.71 -2.07 0.18 -1.65 0.00 0.00 177.43 174.60 2r59 n LEU 305 N -3.06 1.79 -4.52 1.61 4.77 -0.88 -4.81 117.00 111.89 2r59 n LEU 305 Ca -0.07 0.31 -0.40 0.00 -0.03 0.00 0.00 56.01 55.82 2r59 n LEU 305 Cb 0.88 -0.73 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 2r59 n LEU 305 CO 0.43 0.34 -0.13 -0.69 -1.33 0.00 0.00 177.39 176.01 2r59 s VAL 306 N -2.54 5.23 0.07 4.08 1.01 -0.93 -0.39 120.40 126.92 2r59 s VAL 306 Ca -0.33 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.52 2r59 s VAL 306 Cb 0.11 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 2r59 s VAL 306 CO 0.43 0.01 -0.20 -0.89 0.00 0.00 0.00 175.10 174.45 2r59 s THR 307 N 1.71 2.64 0.24 3.92 2.01 -0.84 0.23 115.64 125.56 2r59 s THR 307 Ca 0.06 -1.34 -0.31 0.00 0.31 0.00 0.00 61.69 60.41 2r59 s THR 307 Cb -0.17 -2.12 -0.11 0.00 0.01 0.00 0.00 72.50 70.10 2r59 s THR 307 CO 0.10 0.27 1.57 0.54 -0.69 0.00 0.00 174.62 176.41 2r59 s ASN 308 N -1.61 6.49 0.20 3.53 2.20 -1.26 -0.57 114.94 123.91 2r59 s ASN 308 Ca 0.15 2.80 -0.07 0.00 -0.94 0.00 0.00 52.86 54.80 2r59 s ASN 308 Cb -0.10 -2.62 0.13 0.00 -2.00 0.00 0.00 41.25 36.65 2r59 s ASN 308 CO 0.06 -0.85 1.63 0.50 -2.94 0.00 0.00 177.10 175.49 2r59 h LYS 309 N 5.55 0.91 -4.57 3.55 3.64 -0.91 -3.40 116.57 121.34 2r59 h LYS 309 Ca -0.45 -0.34 -0.23 0.00 -1.27 0.00 0.00 60.65 58.35 2r59 h LYS 309 Cb 1.21 -0.06 -0.15 0.00 -0.41 0.00 0.00 32.23 32.83 2r59 h LYS 309 CO 0.84 0.99 -0.63 0.95 -2.27 0.00 0.00 179.45 179.33 2r59 s THR 310 N -4.77 0.10 -0.19 1.00 -4.23 -1.26 -2.64 115.64 103.66 2r59 s THR 310 Ca -0.10 -1.97 0.27 0.00 -1.18 0.00 0.00 61.69 58.70 2r59 s THR 310 Cb 0.13 -2.36 0.28 0.00 1.34 0.00 0.00 72.50 71.90 2r59 s THR 310 CO 0.85 -0.16 1.81 -0.50 -0.54 0.00 0.00 174.62 176.08 2r59 h TRP 311 N 2.68 0.00 0.00 3.99 4.06 -1.97 -1.72 115.95 122.99 2r59 h TRP 311 Ca -0.36 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.57 2r59 h TRP 311 Cb 1.23 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2r59 h TRP 311 CO 0.39 0.00 -0.08 -0.44 -3.56 0.00 0.00 178.44 174.75 2r59 h ASP 312 N 0.00 0.00 -0.43 -3.49 3.32 -1.96 -2.49 116.42 111.36 2r59 h ASP 312 Ca 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2r59 h ASP 312 Cb 0.25 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 2r59 h ASP 312 CO 0.00 0.08 0.05 1.41 -1.72 0.00 0.00 179.24 179.06 2r59 n HIS 313 N -3.63 1.51 -0.31 4.55 8.25 -0.64 -2.80 115.22 122.14 2r59 n HIS 313 Ca -0.02 -0.99 0.25 0.00 -0.26 0.00 0.00 57.72 56.70 2r59 n HIS 313 Cb 0.20 -0.45 0.57 0.00 1.12 0.00 0.00 29.99 31.42 2r59 n HIS 313 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2r59 h PHE 314 N 2.35 0.48 -0.04 4.41 3.57 -1.55 -1.15 116.94 125.02 2r59 h PHE 314 Ca 0.08 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 2r59 h PHE 314 Cb 1.77 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 40.37 2r59 h PHE 314 CO 0.84 0.05 0.02 0.11 -2.23 0.00 0.00 178.31 177.10 2r59 h TRP 315 N 0.29 0.05 -0.78 0.41 5.08 -1.83 -0.75 115.95 118.42 2r59 h TRP 315 Ca 0.57 0.00 0.05 0.00 1.08 0.00 0.00 58.89 60.59 2r59 h TRP 315 Cb 1.66 -0.02 -0.05 0.00 -3.00 0.00 0.00 29.16 27.75 2r59 h TRP 315 CO -0.00 0.04 0.48 -0.07 -1.28 0.00 0.00 178.44 177.60 2r59 h LEU 316 N 0.05 0.77 0.14 0.11 3.38 -1.55 0.33 115.31 118.54 2r59 h LEU 316 Ca 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2r59 h LEU 316 Cb 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2r59 h LEU 316 CO -0.00 0.51 -0.07 0.78 0.09 0.00 0.00 178.44 179.75 2r59 h ASN 317 N 0.91 -0.16 0.15 -0.43 4.21 -1.31 -3.28 115.58 115.67 2r59 h ASN 317 Ca 0.33 -0.03 -0.29 0.00 1.21 0.00 0.00 56.30 57.52 2r59 h ASN 317 Cb 0.10 0.04 0.01 0.00 -1.12 0.00 0.00 38.32 37.35 2r59 h ASN 317 CO -0.15 -0.08 -1.45 -0.33 -1.29 0.00 0.00 177.43 174.14 2r59 h GLU 318 N -0.23 0.32 -0.24 0.81 4.39 -1.07 -3.11 114.58 115.45 2r59 h GLU 318 Ca -0.02 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.14 2r59 h GLU 318 Cb 0.18 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2r59 h GLU 318 CO 0.03 1.26 0.15 0.78 -1.16 0.00 0.00 179.01 180.08 2r59 h GLY 319 N 0.19 0.34 1.68 -3.84 0.00 -0.39 -0.17 103.07 100.88 2r59 h GLY 319 Ca -0.29 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 46.82 2r59 h GLY 319 CO 0.12 0.11 -0.32 0.45 0.00 0.00 0.00 176.54 176.91 2r59 h HIS 320 N 0.31 0.42 -0.55 5.60 3.86 -1.70 -1.67 115.15 121.42 2r59 h HIS 320 Ca 0.09 -0.10 -0.11 0.00 -1.16 0.00 0.00 60.37 59.09 2r59 h HIS 320 Cb -0.03 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 2r59 h HIS 320 CO -0.07 0.65 -0.10 1.15 0.86 0.00 0.00 177.93 180.43 2r59 h THR 321 N 0.32 1.27 -0.77 2.45 2.02 -1.38 -0.99 112.91 115.83 2r59 h THR 321 Ca 0.04 -1.26 -0.03 0.00 0.77 0.00 0.00 66.41 65.94 2r59 h THR 321 Cb 0.73 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 2r59 h THR 321 CO 0.06 0.45 0.37 0.58 0.37 0.00 0.00 175.52 177.34 2r59 h VAL 322 N 0.92 1.24 -0.21 3.16 2.07 -0.91 0.12 116.25 122.64 2r59 h VAL 322 Ca 0.14 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2r59 h VAL 322 Cb 0.67 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2r59 h VAL 322 CO 0.05 0.29 0.07 0.22 0.02 0.00 0.00 177.57 178.21 2r59 h TYR 323 N 1.09 0.33 -0.04 1.57 3.20 -0.95 0.39 116.97 122.55 2r59 h TYR 323 Ca 0.26 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2r59 h TYR 323 Cb 0.11 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 2r59 h TYR 323 CO 0.01 0.40 0.02 -0.07 -1.64 0.00 0.00 178.16 176.89 2r59 h LEU 324 N 0.16 0.04 -0.54 2.82 3.38 -1.09 -2.36 115.31 117.72 2r59 h LEU 324 Ca 0.07 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.13 2r59 h LEU 324 Cb 0.23 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.86 2r59 h LEU 324 CO -0.00 0.05 -0.22 -0.08 0.09 0.00 0.00 178.44 178.27 2r59 h GLU 325 N 0.04 -0.09 -0.07 1.13 4.81 -0.56 -1.32 114.58 118.51 2r59 h GLU 325 Ca 0.01 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2r59 h GLU 325 Cb 0.01 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2r59 h GLU 325 CO -0.00 -0.06 -0.30 0.00 -0.73 0.00 0.00 179.01 177.91 2r59 h ARG 326 N -0.09 0.12 -0.65 1.92 3.08 -0.81 -2.25 114.38 115.70 2r59 h ARG 326 Ca 0.25 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.18 2r59 h ARG 326 Cb 0.48 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 2r59 h ARG 326 CO -0.61 0.42 0.10 0.45 -1.07 0.00 0.00 179.97 179.26 2r59 h HIS 327 N 0.11 1.14 -0.04 3.04 3.86 -0.82 -0.77 115.15 121.67 2r59 h HIS 327 Ca 0.02 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 2r59 h HIS 327 Cb 0.60 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.75 2r59 h HIS 327 CO 0.01 0.96 0.03 0.82 0.86 0.00 0.00 177.93 180.60 2r59 h ILE 328 N 1.01 1.03 -0.82 2.45 2.04 -0.86 -0.25 117.51 122.11 2r59 h ILE 328 Ca 0.20 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 66.00 2r59 h ILE 328 Cb 0.44 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.49 2r59 h ILE 328 CO 0.01 0.03 0.54 0.00 0.00 0.00 0.00 178.15 178.73 2r59 h GLY 330 N 1.05 0.77 0.98 0.00 0.00 -0.82 0.25 103.07 105.30 2r59 h GLY 330 Ca 0.32 -0.62 -0.12 0.00 0.00 0.00 0.00 47.33 46.90 2r59 h GLY 330 CO -0.08 0.57 -0.29 3.21 0.00 0.00 0.00 176.54 179.95 2r59 h ARG 331 N 0.63 0.72 -0.07 4.80 2.47 -0.48 0.99 114.38 123.45 2r59 h ARG 331 Ca 0.10 -0.38 -0.22 0.00 -1.26 0.00 0.00 59.98 58.22 2r59 h ARG 331 Cb 0.66 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.00 2r59 h ARG 331 CO 0.05 1.00 -0.84 -0.07 0.56 0.00 0.00 179.97 180.67 2r59 h LEU 332 N 0.48 0.69 -0.89 3.04 3.38 -0.97 -3.39 115.31 117.66 2r59 h LEU 332 Ca 0.05 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2r59 h LEU 332 Cb 0.86 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2r59 h LEU 332 CO 0.07 1.27 0.00 0.49 0.09 0.00 0.00 178.44 180.36 2r59 n PHE 333 N -3.85 0.00 0.00 1.13 3.72 0.85 -5.09 117.46 114.22 2r59 n PHE 333 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2r59 n PHE 333 Cb 0.77 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 2r59 n PHE 333 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2r59 n GLY 334 N 0.04 2.63 0.22 1.37 0.00 0.34 -4.53 105.19 105.25 2r59 n GLY 334 Ca 0.00 -1.88 0.03 0.00 0.00 0.00 0.00 46.02 44.17 2r59 n GLY 334 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2r59 h GLU 335 N 0.00 0.14 -0.37 1.61 4.57 -1.93 -2.06 114.58 116.54 2r59 h GLU 335 Ca 0.00 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 2r59 h GLU 335 Cb 0.00 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2r59 h GLU 335 CO 0.00 0.36 -0.02 0.87 -1.18 0.00 0.00 179.01 179.04 2r59 h LYS 336 N 0.13 0.60 -0.54 1.92 1.57 -1.93 -2.11 116.57 116.21 2r59 h LYS 336 Ca 0.02 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.57 2r59 h LYS 336 Cb 0.47 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2r59 h LYS 336 CO 0.03 0.64 -0.01 0.35 -0.57 0.00 0.00 179.45 179.89 2r59 h PHE 337 N 0.57 1.01 -0.52 -1.35 3.57 -1.61 -1.27 116.94 117.34 2r59 h PHE 337 Ca 0.12 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 2r59 h PHE 337 Cb 0.39 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 2r59 h PHE 337 CO 0.02 0.91 0.21 -0.09 -2.23 0.00 0.00 178.31 177.13 2r59 h ARG 338 N 0.86 0.78 -0.69 1.11 2.43 -1.18 -1.88 114.38 115.80 2r59 h ARG 338 Ca 0.16 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2r59 h ARG 338 Cb 0.52 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 2r59 h ARG 338 CO 0.03 0.68 0.28 0.45 -1.51 0.00 0.00 179.97 179.90 2r59 h HIS 339 N 0.70 1.03 -0.38 2.20 3.86 -1.29 -0.56 115.15 120.71 2r59 h HIS 339 Ca 0.17 -0.06 0.05 0.00 -1.16 0.00 0.00 60.37 59.37 2r59 h HIS 339 Cb 0.20 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.31 2r59 h HIS 339 CO 0.01 0.78 0.12 0.35 0.86 0.00 0.00 177.93 180.05 2r59 h PHE 340 N 1.00 0.21 -0.15 2.45 3.57 -0.95 0.12 116.94 123.19 2r59 h PHE 340 Ca 0.23 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.63 2r59 h PHE 340 Cb 0.18 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 2r59 h PHE 340 CO 0.02 0.08 -0.44 -0.91 -2.23 0.00 0.00 178.31 174.82 2r59 h ASN 341 N 0.27 0.40 -0.31 0.41 -0.26 -1.07 -0.47 115.58 114.55 2r59 h ASN 341 Ca 0.18 -0.18 -0.13 0.00 -0.56 0.00 0.00 56.30 55.61 2r59 h ASN 341 Cb 0.17 -0.11 -0.00 0.00 -1.06 0.00 0.00 38.32 37.31 2r59 h ASN 341 CO -0.19 0.79 -0.32 0.00 -1.06 0.00 0.00 177.43 176.64 2r59 h ALA 342 N 1.23 0.45 -0.45 -0.83 0.00 -0.80 -0.62 119.26 118.24 2r59 h ALA 342 Ca 0.02 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2r59 h ALA 342 Cb 0.90 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2r59 h ALA 342 CO 0.08 0.50 0.20 1.25 0.00 0.00 0.00 179.25 181.27 2r59 h LEU 343 N 0.52 0.60 -1.07 0.00 5.85 -0.48 -1.71 115.31 119.02 2r59 h LEU 343 Ca 0.05 -0.15 0.13 0.00 0.84 0.00 0.00 57.88 58.75 2r59 h LEU 343 Cb 0.90 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.69 2r59 h LEU 343 CO 0.08 0.59 0.62 1.23 -0.34 0.00 0.00 178.44 180.61 2r59 h GLY 344 N 0.58 1.56 1.78 3.75 0.00 -0.91 -2.23 103.07 107.61 2r59 h GLY 344 Ca 0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.99 2r59 h GLY 344 CO -0.02 0.13 -0.34 -1.33 0.00 0.00 0.00 176.54 174.99 2r59 h GLY 345 N 0.92 0.27 0.94 4.60 0.00 -0.25 -1.32 103.07 108.22 2r59 h GLY 345 Ca 0.49 -0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.54 2r59 h GLY 345 CO -0.26 0.21 0.06 -0.25 0.00 0.00 0.00 176.54 176.30 2r59 h TRP 346 N 0.22 0.71 -0.94 5.60 2.91 -0.77 -0.78 115.95 122.90 2r59 h TRP 346 Ca 0.03 -0.10 0.05 0.00 1.13 0.00 0.00 58.89 60.00 2r59 h TRP 346 Cb 0.70 -0.19 -0.06 0.00 -0.51 0.00 0.00 29.16 29.10 2r59 h TRP 346 CO 0.01 0.70 0.61 0.78 -1.03 0.00 0.00 178.44 179.52 2r59 h GLY 347 N 0.52 1.37 1.50 2.65 0.00 -1.15 -0.18 103.07 107.79 2r59 h GLY 347 Ca 0.12 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 2r59 h GLY 347 CO 0.01 0.35 -0.05 -2.09 0.00 0.00 0.00 176.54 174.76 2r59 h GLU 348 N 1.12 0.61 -0.39 4.80 4.57 -1.09 -1.04 114.58 123.17 2r59 h GLU 348 Ca 0.39 -0.16 -0.12 0.00 -1.18 0.00 0.00 59.36 58.29 2r59 h GLU 348 Cb 0.11 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 2r59 h GLU 348 CO -0.14 0.67 -0.24 1.25 -1.18 0.00 0.00 179.01 179.37 2r59 h LEU 349 N 0.57 0.79 -0.33 1.64 5.85 -0.04 -1.40 115.31 122.40 2r59 h LEU 349 Ca 0.11 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2r59 h LEU 349 Cb 0.43 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2r59 h LEU 349 CO 0.02 1.00 0.16 1.56 -0.34 0.00 0.00 178.44 180.84 2r59 h GLN 350 N 0.67 0.47 -0.38 1.25 4.20 -0.88 -1.68 115.11 118.76 2r59 h GLN 350 Ca 0.09 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.77 2r59 h GLN 350 Cb 0.75 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 2r59 h GLN 350 CO 0.06 0.43 0.16 -0.91 -0.67 0.00 0.00 178.83 177.90 2r59 h ASN 351 N 0.40 0.20 -0.41 1.46 2.35 -0.97 0.09 115.58 118.70 2r59 h ASN 351 Ca 0.11 0.03 -0.15 0.00 -0.55 0.00 0.00 56.30 55.74 2r59 h ASN 351 Cb 0.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2r59 h ASN 351 CO -0.02 0.15 -0.35 0.28 -1.65 0.00 0.00 177.43 175.85 2r59 h SER 352 N 0.33 1.01 -0.45 5.81 0.02 -1.11 -0.99 113.55 118.18 2r59 h SER 352 Ca 0.17 -0.45 -0.08 0.00 -0.84 0.00 0.00 61.79 60.60 2r59 h SER 352 Cb 0.12 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2r59 h SER 352 CO -0.15 1.25 0.01 0.58 -1.14 0.00 0.00 176.83 177.37 2r59 h VAL 353 N 0.79 1.25 -0.25 2.27 2.07 -1.25 -0.66 116.25 120.47 2r59 h VAL 353 Ca 0.07 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.53 2r59 h VAL 353 Cb 0.94 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2r59 h VAL 353 CO 0.09 0.37 0.05 0.50 0.02 0.00 0.00 177.57 178.60 2r59 h LYS 354 N 0.79 0.41 -0.72 1.57 3.64 -0.72 0.21 116.57 121.76 2r59 h LYS 354 Ca 0.15 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2r59 h LYS 354 Cb 0.47 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 2r59 h LYS 354 CO 0.02 0.52 0.23 1.15 -2.27 0.00 0.00 179.45 179.10 2r59 h THR 355 N 0.23 1.26 0.02 1.00 2.02 -1.08 -3.08 112.91 113.27 2r59 h THR 355 Ca 0.08 -0.88 -0.25 0.00 0.77 0.00 0.00 66.41 66.13 2r59 h THR 355 Cb 0.31 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 2r59 h THR 355 CO 0.00 0.34 -1.30 -0.26 0.37 0.00 0.00 175.52 174.68 2r59 h PHE 356 N 1.06 0.08 0.00 3.16 0.04 -1.05 -3.51 116.94 116.73 2r59 h PHE 356 Ca 0.23 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.94 2r59 h PHE 356 Cb 0.29 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.44 2r59 h PHE 356 CO 0.02 1.07 0.00 0.41 -0.60 0.00 0.00 178.31 179.21 2r59 n GLY 357 N 1.47 2.03 0.00 -1.45 0.00 0.72 -4.59 105.19 103.37 2r59 n GLY 357 Ca -0.08 -1.61 0.08 0.00 0.00 0.00 0.00 46.02 44.41 2r59 n GLY 357 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2r59 n GLU 358 N 1.93 0.39 0.00 1.61 0.28 -1.24 -1.94 120.64 121.68 2r59 n GLU 358 Ca 0.00 0.07 0.01 0.00 -0.16 0.00 0.00 57.16 57.07 2r59 n GLU 358 Cb 0.00 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.37 2r59 n GLU 358 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2r59 n THR 359 N -1.14 0.00 -1.81 3.84 -2.24 -1.26 -2.42 114.28 109.24 2r59 n THR 359 Ca 0.10 -0.50 -0.41 0.00 -2.27 0.00 0.00 64.05 60.98 2r59 n THR 359 Cb 0.10 1.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.35 2r59 n THR 359 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2r59 s HIS 360 N -0.26 2.66 0.46 4.78 2.46 -0.82 -4.86 115.29 119.72 2r59 s HIS 360 Ca 0.02 1.06 0.34 0.00 0.47 0.00 0.00 55.06 56.94 2r59 s HIS 360 Cb 0.01 -4.02 1.77 0.00 -0.13 0.00 0.00 32.58 30.21 2r59 s HIS 360 CO 0.02 -3.12 2.17 -1.35 -2.47 0.00 0.00 174.74 169.99 2r59 h PRO 361 N 3.59 0.00 0.00 2.88 0.11 -1.95 -2.33 132.00 134.30 2r59 h PRO 361 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2r59 h PRO 361 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2r59 h PRO 361 CO 0.69 0.05 0.00 1.19 -0.21 0.00 0.00 178.00 179.72 2r59 n PHE 362 N -3.43 0.00 1.03 0.65 3.72 -1.26 -2.60 117.46 115.58 2r59 n PHE 362 Ca -0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 2r59 n PHE 362 Cb 0.18 -0.37 0.32 0.00 -0.94 0.00 0.00 39.48 38.68 2r59 n PHE 362 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2r59 n THR 363 N -1.37 0.20 -2.71 4.37 -2.24 -0.87 -4.86 114.28 106.80 2r59 n THR 363 Ca 0.08 -0.44 -0.34 0.00 -2.27 0.00 0.00 64.05 61.08 2r59 n THR 363 Cb 0.20 0.72 -0.06 0.00 -2.10 0.00 0.00 70.33 69.10 2r59 n THR 363 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2r59 s LYS 364 N -1.80 4.10 -0.02 -0.78 1.02 -1.07 -3.87 119.74 117.32 2r59 s LYS 364 Ca 0.34 1.24 -0.22 0.00 0.02 0.00 0.00 55.97 57.35 2r59 s LYS 364 Cb 0.20 -2.21 -0.14 0.00 -0.52 0.00 0.00 37.83 35.16 2r59 s LYS 364 CO 0.30 -0.15 0.96 1.25 -0.92 0.00 0.00 175.35 176.79 2r59 h LEU 365 N 1.91 -0.40 -8.95 3.17 5.85 -1.75 -3.41 115.31 111.73 2r59 h LEU 365 Ca -0.49 -0.15 -0.61 0.00 0.84 0.00 0.00 57.88 57.47 2r59 h LEU 365 Cb 1.20 0.10 -0.12 0.00 0.37 0.00 0.00 40.66 42.21 2r59 h LEU 365 CO 0.61 0.03 0.11 -0.69 -0.34 0.00 0.00 178.44 178.16 2r59 s VAL 366 N -3.99 4.99 0.32 1.05 1.01 -0.25 -4.57 120.40 118.96 2r59 s VAL 366 Ca -0.12 0.97 0.08 0.00 0.00 0.00 0.00 61.98 62.91 2r59 s VAL 366 Cb 0.01 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2r59 s VAL 366 CO 0.43 -0.02 0.17 0.68 0.00 0.00 0.00 175.10 176.37 2r59 s VAL 367 N 2.49 3.37 -0.27 2.92 -7.23 -1.12 -4.79 120.40 115.76 2r59 s VAL 367 Ca 0.24 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 2r59 s VAL 367 Cb -0.15 -3.07 0.05 0.00 0.56 0.00 0.00 36.38 33.77 2r59 s VAL 367 CO 0.10 -0.22 -0.06 -0.62 -0.31 0.00 0.00 175.10 173.99 2r59 s ASP 368 N -3.87 4.57 -0.16 4.85 2.15 -1.26 -4.57 116.67 118.38 2r59 s ASP 368 Ca 0.37 -1.23 0.16 0.00 0.43 0.00 0.00 52.55 52.29 2r59 s ASP 368 Cb -0.04 -1.64 0.76 0.00 -0.30 0.00 0.00 42.92 41.69 2r59 s ASP 368 CO 0.24 -0.20 1.67 0.18 -0.17 0.00 0.00 175.17 176.88 2r59 n LEU 369 N 4.56 5.11 -4.72 -1.34 4.77 -1.26 -4.87 117.00 119.25 2r59 n LEU 369 Ca -0.14 -2.58 -0.42 0.00 -0.03 0.00 0.00 56.01 52.83 2r59 n LEU 369 Cb 0.44 -0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 2r59 n LEU 369 CO 0.24 0.73 1.32 -0.89 -1.33 0.00 0.00 177.39 177.47 2r59 s THR 370 N -2.20 2.16 -0.95 -5.08 2.01 -1.26 -1.93 115.64 108.38 2r59 s THR 370 Ca 0.52 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.64 2r59 s THR 370 Cb 0.36 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.79 2r59 s THR 370 CO 0.21 0.01 0.00 0.47 -0.69 0.00 0.00 174.62 174.62 2r59 n ASP 371 N 3.72 -3.16 -4.20 3.53 10.43 -1.26 -4.97 116.55 120.62 2r59 n ASP 371 Ca 0.14 0.25 -0.33 0.00 2.57 0.00 0.00 54.79 57.42 2r59 n ASP 371 Cb 0.36 -2.83 -0.16 0.00 1.84 0.00 0.00 41.12 40.34 2r59 n ASP 371 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2r59 s ILE 372 N -2.28 2.44 0.01 0.53 -1.09 -0.81 -5.10 121.20 114.90 2r59 s ILE 372 Ca 0.00 -0.83 -0.31 0.00 -2.23 0.00 0.00 60.65 57.28 2r59 s ILE 372 Cb 0.00 -2.03 -0.10 0.00 -1.58 0.00 0.00 42.46 38.75 2r59 s ILE 372 CO 0.00 0.52 1.96 -0.67 -1.23 0.00 0.00 174.94 175.52 2r59 n ASP 373 N 4.34 4.04 0.06 3.58 -0.08 -1.26 -4.89 116.55 122.34 2r59 n ASP 373 Ca -0.20 0.91 0.19 0.00 -1.51 0.00 0.00 54.79 54.19 2r59 n ASP 373 Cb 0.51 -1.50 0.72 0.00 2.34 0.00 0.00 41.12 43.19 2r59 n ASP 373 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2r59 h PRO 374 N 10.39 0.00 -0.38 -0.67 0.11 -1.99 -1.08 132.00 138.39 2r59 h PRO 374 Ca -0.50 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 2r59 h PRO 374 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2r59 h PRO 374 CO 0.94 0.00 -0.17 -0.44 -0.21 0.00 0.00 178.00 178.12 2r59 h ASP 375 N 0.00 0.71 -0.65 -2.05 3.45 -1.97 -1.51 116.42 114.40 2r59 h ASP 375 Ca 0.21 -0.23 -0.08 0.00 0.43 0.00 0.00 57.03 57.36 2r59 h ASP 375 Cb 0.91 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 39.46 2r59 h ASP 375 CO -0.00 0.89 0.10 0.58 -1.57 0.00 0.00 179.24 179.23 2r59 h VAL 376 N 0.64 1.26 0.00 -1.35 2.07 -1.60 -3.21 116.25 114.06 2r59 h VAL 376 Ca 0.10 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.58 2r59 h VAL 376 Cb 0.64 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2r59 h VAL 376 CO 0.05 0.39 -0.36 0.00 0.02 0.00 0.00 177.57 177.67 2r59 h ALA 377 N 1.08 0.77 -2.06 1.67 0.00 -1.11 -3.47 119.26 116.14 2r59 h ALA 377 Ca 0.20 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.49 2r59 h ALA 377 Cb 0.44 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.28 2r59 h ALA 377 CO 0.01 0.00 0.81 0.98 0.00 0.00 0.00 179.25 181.05 2r59 n TYR 378 N -2.24 2.13 -3.82 0.00 9.36 -0.61 -4.96 117.16 117.03 2r59 n TYR 378 Ca 0.04 0.29 -0.09 0.00 3.32 0.00 0.00 57.90 61.47 2r59 n TYR 378 Cb 0.44 -2.53 0.02 0.00 -0.63 0.00 0.00 39.34 36.65 2r59 n TYR 378 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 2r59 s SER 379 N 1.71 0.00 0.08 2.98 1.04 -1.26 -5.02 113.70 113.23 2r59 s SER 379 Ca 0.84 -1.11 0.13 0.00 0.48 0.00 0.00 55.95 56.29 2r59 s SER 379 Cb -0.76 0.84 0.59 0.00 0.10 0.00 0.00 66.02 66.79 2r59 s SER 379 CO 0.44 -1.66 1.41 -1.20 0.98 0.00 0.00 173.24 173.21 2r59 n SER 380 N -1.34 0.18 0.23 7.02 7.64 -1.26 -4.14 113.62 121.95 2r59 n SER 380 Ca -0.08 0.56 -0.16 0.00 1.01 0.00 0.00 58.87 60.20 2r59 n SER 380 Cb 0.60 -0.59 -0.08 0.00 -1.01 0.00 0.00 64.21 63.13 2r59 n SER 380 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2r59 h VAL 381 N 0.00 0.25 -0.34 0.44 2.07 -1.93 0.11 116.25 116.85 2r59 h VAL 381 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2r59 h VAL 381 Cb 0.18 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 2r59 h VAL 381 CO 0.00 0.00 0.22 1.55 0.02 0.00 0.00 177.57 179.36 2r59 h PRO 382 N -0.76 0.40 0.42 1.57 0.13 -1.88 0.13 132.00 132.01 2r59 h PRO 382 Ca -0.03 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.06 2r59 h PRO 382 Cb 0.68 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.73 2r59 h PRO 382 CO -0.06 0.26 -0.20 1.88 -0.23 0.00 0.00 178.00 179.65 2r59 h TYR 383 N 0.41 -0.53 0.02 1.56 -1.99 -1.69 -2.76 116.97 111.99 2r59 h TYR 383 Ca 0.13 -0.01 -0.33 0.00 2.00 0.00 0.00 58.73 60.51 2r59 h TYR 383 Cb 0.02 0.17 -0.05 0.00 2.00 0.00 0.00 36.73 38.87 2r59 h TYR 383 CO -0.00 -0.23 -1.98 0.39 -0.00 0.00 0.00 178.16 176.34 2r59 n GLU 384 N -5.25 0.67 -0.03 4.88 -0.58 0.34 -1.02 120.64 119.64 2r59 n GLU 384 Ca -0.11 0.21 -0.08 0.00 -0.42 0.00 0.00 57.16 56.76 2r59 n GLU 384 Cb 0.28 -1.69 0.08 0.00 -0.57 0.00 0.00 31.44 29.54 2r59 n GLU 384 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2r59 h LYS 385 N 0.01 0.63 -0.05 3.49 3.64 -0.93 0.19 116.57 123.55 2r59 h LYS 385 Ca -0.40 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 58.65 2r59 h LYS 385 Cb 2.06 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.89 2r59 h LYS 385 CO 0.06 0.92 -0.03 0.78 -2.27 0.00 0.00 179.45 178.91 2r59 h GLY 386 N 1.01 0.12 0.80 5.01 0.00 -1.53 -2.15 103.07 106.32 2r59 h GLY 386 Ca 0.04 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.31 2r59 h GLY 386 CO 0.08 0.09 0.30 -2.75 0.00 0.00 0.00 176.54 174.27 2r59 h PHE 387 N -0.29 0.56 -0.87 5.60 3.57 -1.07 -2.21 116.94 122.23 2r59 h PHE 387 Ca 0.01 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.58 2r59 h PHE 387 Cb 0.46 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.97 2r59 h PHE 387 CO 0.07 0.30 0.55 0.00 -2.23 0.00 0.00 178.31 177.00 2r59 h ALA 388 N 1.26 1.18 -0.33 2.41 0.00 -0.55 0.24 119.26 123.48 2r59 h ALA 388 Ca 0.23 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2r59 h ALA 388 Cb 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2r59 h ALA 388 CO -0.13 0.33 0.19 1.25 0.00 0.00 0.00 179.25 180.89 2r59 h LEU 389 N 1.02 0.41 -0.80 0.00 5.85 -1.12 0.35 115.31 121.02 2r59 h LEU 389 Ca 0.37 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 59.04 2r59 h LEU 389 Cb 0.12 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2r59 h LEU 389 CO -0.15 0.36 0.52 -0.07 -0.34 0.00 0.00 178.44 178.75 2r59 h LEU 390 N 0.42 0.87 -0.26 2.25 3.38 -0.78 -0.75 115.31 120.44 2r59 h LEU 390 Ca 0.12 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 2r59 h LEU 390 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2r59 h LEU 390 CO -0.02 0.61 -0.20 0.15 0.09 0.00 0.00 178.44 179.07 2r59 h PHE 391 N 1.02 0.71 -0.30 1.13 3.57 -0.16 0.12 116.94 123.04 2r59 h PHE 391 Ca 0.31 -0.20 0.06 0.00 3.53 0.00 0.00 57.97 61.67 2r59 h PHE 391 Cb -0.04 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.49 2r59 h PHE 391 CO -0.02 0.89 -0.05 -0.92 -2.23 0.00 0.00 178.31 175.97 2r59 h TYR 392 N 0.32 -0.12 -0.67 0.41 3.20 -0.25 -1.80 116.97 118.06 2r59 h TYR 392 Ca 0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2r59 h TYR 392 Cb 0.74 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 39.07 2r59 h TYR 392 CO 0.07 -0.11 0.43 -0.07 -1.64 0.00 0.00 178.16 176.84 2r59 h LEU 393 N 0.02 0.78 -0.51 2.82 3.38 -0.91 -0.39 115.31 120.50 2r59 h LEU 393 Ca 0.14 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.18 2r59 h LEU 393 Cb 0.21 -0.20 -0.10 0.00 0.09 0.00 0.00 40.66 40.66 2r59 h LEU 393 CO -0.29 0.59 -0.18 -0.08 0.09 0.00 0.00 178.44 178.57 2r59 h GLU 394 N 0.90 -0.06 -0.20 1.13 4.81 -0.52 0.12 114.58 120.77 2r59 h GLU 394 Ca 0.24 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.36 2r59 h GLU 394 Cb -0.07 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2r59 h GLU 394 CO -0.05 -0.04 -0.39 1.96 -0.73 0.00 0.00 179.01 179.76 2r59 h GLN 395 N -0.06 0.45 -0.44 1.92 4.20 -0.79 0.11 115.11 120.50 2r59 h GLN 395 Ca 0.24 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 2r59 h GLN 395 Cb 0.43 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2r59 h GLN 395 CO -0.56 0.77 -0.11 1.25 -0.67 0.00 0.00 178.83 179.51 2r59 h LEU 396 N 0.37 0.85 -1.46 1.46 5.85 -0.62 -3.34 115.31 118.43 2r59 h LEU 396 Ca 0.04 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.39 2r59 h LEU 396 Cb 0.86 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2r59 h LEU 396 CO 0.07 1.02 0.00 0.18 -0.34 0.00 0.00 178.44 179.37 2r59 n LEU 397 N -4.28 2.25 0.00 2.25 4.77 0.38 -4.93 117.00 117.44 2r59 n LEU 397 Ca -0.01 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 2r59 n LEU 397 Cb 0.38 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2r59 n LEU 397 CO 0.44 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 2r59 n GLY 398 N 1.26 1.35 0.00 -0.72 0.00 -1.00 -4.89 105.19 101.20 2r59 n GLY 398 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2r59 n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r59 n GLY 399 N 0.00 1.54 0.33 -0.02 0.00 0.36 -4.64 105.19 102.75 2r59 n GLY 399 Ca 0.00 -2.15 -0.01 0.00 0.00 0.00 0.00 46.02 43.86 2r59 n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r59 h PRO 400 N 0.00 0.95 -0.24 1.61 0.13 -1.99 -1.89 132.00 130.57 2r59 h PRO 400 Ca 0.00 -0.11 -0.07 0.00 -0.87 0.00 0.00 66.00 64.95 2r59 h PRO 400 Cb 0.00 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 30.94 2r59 h PRO 400 CO 0.00 0.71 -0.11 0.93 -0.23 0.00 0.00 178.00 179.30 2r59 h GLU 401 N 0.96 0.49 -0.39 0.86 5.08 -1.97 -0.10 114.58 119.50 2r59 h GLU 401 Ca 0.24 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2r59 h GLU 401 Cb 0.05 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 2r59 h GLU 401 CO -0.04 0.76 0.18 0.82 -1.00 0.00 0.00 179.01 179.74 2r59 h ILE 402 N 0.21 0.95 -0.04 3.13 2.04 -1.81 -2.75 117.51 119.25 2r59 h ILE 402 Ca 0.05 -0.13 -0.14 0.00 1.00 0.00 0.00 64.86 65.64 2r59 h ILE 402 Cb 0.61 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2r59 h ILE 402 CO 0.03 0.07 -0.63 0.15 0.00 0.00 0.00 178.15 177.77 2r59 h PHE 403 N 0.37 0.21 0.00 1.37 3.57 -1.18 -2.50 116.94 118.79 2r59 h PHE 403 Ca 0.17 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 2r59 h PHE 403 Cb 0.10 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2r59 h PHE 403 CO -0.11 0.75 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.45 2r59 h LEU 404 N 0.12 0.00 -0.63 0.59 3.38 -0.99 -1.19 115.31 116.59 2r59 h LEU 404 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2r59 h LEU 404 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2r59 h LEU 404 CO 0.09 0.19 -0.49 1.23 0.09 0.00 0.00 178.44 179.55 2r59 h GLY 405 N 1.15 0.54 0.88 0.83 0.00 -1.14 -1.82 103.07 103.51 2r59 h GLY 405 Ca -0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 2r59 h GLY 405 CO 0.02 0.53 0.07 -2.75 0.00 0.00 0.00 176.54 174.41 2r59 h PHE 406 N 0.39 0.37 -0.69 5.60 3.57 -1.30 -2.43 116.94 122.46 2r59 h PHE 406 Ca 0.02 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2r59 h PHE 406 Cb 1.00 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 2r59 h PHE 406 CO 0.04 0.43 0.44 1.25 -2.23 0.00 0.00 178.31 178.23 2r59 h LEU 407 N 0.21 0.73 -0.59 0.59 6.46 -1.09 0.21 115.31 121.84 2r59 h LEU 407 Ca 0.07 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.79 2r59 h LEU 407 Cb 0.23 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.96 2r59 h LEU 407 CO -0.00 0.52 0.21 0.50 -0.62 0.00 0.00 178.44 179.04 2r59 h LYS 408 N 0.87 0.90 -0.30 1.25 3.64 -1.30 -1.87 116.57 119.76 2r59 h LYS 408 Ca 0.27 -0.18 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 2r59 h LYS 408 Cb -0.02 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 2r59 h LYS 408 CO -0.09 0.79 -0.16 0.00 -2.27 0.00 0.00 179.45 177.72 2r59 h ALA 409 N 1.06 1.17 -0.15 5.00 0.00 -1.14 -1.20 119.26 124.00 2r59 h ALA 409 Ca 0.19 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2r59 h ALA 409 Cb 0.25 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2r59 h ALA 409 CO -0.01 0.53 0.04 -0.92 0.00 0.00 0.00 179.25 178.88 2r59 h TYR 410 N 0.48 0.25 -0.50 0.00 3.20 -0.33 -0.46 116.97 119.61 2r59 h TYR 410 Ca 0.08 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2r59 h TYR 410 Cb 0.56 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 2r59 h TYR 410 CO 0.02 0.38 0.33 0.28 -1.64 0.00 0.00 178.16 177.54 2r59 h VAL 411 N 0.05 1.13 -0.37 1.81 2.07 -1.22 -1.61 116.25 118.12 2r59 h VAL 411 Ca 0.05 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2r59 h VAL 411 Cb 0.26 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2r59 h VAL 411 CO 0.00 0.13 0.23 -0.33 0.02 0.00 0.00 177.57 177.62 2r59 h GLU 412 N 0.68 0.49 -0.62 1.57 5.08 -1.08 -1.45 114.58 119.25 2r59 h GLU 412 Ca 0.18 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2r59 h GLU 412 Cb -0.08 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 2r59 h GLU 412 CO -0.04 0.35 0.41 -0.22 -1.00 0.00 0.00 179.01 178.51 2r59 h LYS 413 N 0.49 0.82 -0.41 2.33 1.63 -0.67 -3.17 116.57 117.58 2r59 h LYS 413 Ca 0.13 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2r59 h LYS 413 Cb -0.02 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.42 2r59 h LYS 413 CO -0.03 0.55 0.00 1.19 -3.45 0.00 0.00 179.45 177.71 2r59 n PHE 414 N -4.65 0.97 -1.80 1.91 3.72 -0.64 -5.01 117.46 111.97 2r59 n PHE 414 Ca 0.05 -0.67 -0.41 0.00 -0.05 0.00 0.00 57.45 56.37 2r59 n PHE 414 Cb 0.02 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 38.36 2r59 n PHE 414 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2r59 s SER 415 N -1.30 6.29 -1.01 4.37 0.01 -0.56 -1.56 113.70 119.94 2r59 s SER 415 Ca 0.39 3.04 0.00 0.00 1.31 0.00 0.00 55.95 60.69 2r59 s SER 415 Cb 0.27 -2.67 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2r59 s SER 415 CO 0.16 -0.91 0.00 -1.22 0.41 0.00 0.00 173.24 171.68 2r59 n TYR 416 N 0.39 0.00 -4.50 2.43 4.02 0.48 -4.95 117.16 115.03 2r59 n TYR 416 Ca 0.01 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.67 2r59 n TYR 416 Cb 0.39 -2.08 -0.11 0.00 -0.02 0.00 0.00 39.34 37.52 2r59 n TYR 416 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 2r59 s LYS 417 N -2.59 1.73 -0.06 -0.72 1.02 -0.60 -5.02 119.74 113.49 2r59 s LYS 417 Ca 0.00 -1.96 0.05 0.00 0.02 0.00 0.00 55.97 54.08 2r59 s LYS 417 Cb 0.00 -1.13 -0.00 0.00 -0.52 0.00 0.00 37.83 36.17 2r59 s LYS 417 CO 0.00 -0.12 -0.22 -1.12 -0.92 0.00 0.00 175.35 172.97 2r59 s SER 418 N -3.55 2.75 0.17 2.83 0.01 -1.26 -1.98 113.70 112.67 2r59 s SER 418 Ca 0.35 -0.47 0.02 0.00 1.31 0.00 0.00 55.95 57.17 2r59 s SER 418 Cb 0.09 -0.92 -0.05 0.00 0.21 0.00 0.00 66.02 65.35 2r59 s SER 418 CO 0.16 0.18 -0.02 0.27 0.41 0.00 0.00 173.24 174.24 2r59 s ILE 419 N 0.08 0.82 0.46 1.44 -4.36 0.27 -4.65 121.20 115.25 2r59 s ILE 419 Ca -0.08 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.37 2r59 s ILE 419 Cb -0.14 -2.08 -0.01 0.00 1.25 0.00 0.00 42.46 41.47 2r59 s ILE 419 CO 0.05 -0.53 0.29 0.42 0.24 0.00 0.00 174.94 175.41 2r59 s THR 420 N -3.56 2.13 0.38 8.37 -4.23 -1.26 -0.29 115.64 117.18 2r59 s THR 420 Ca 0.22 -1.56 0.06 0.00 -1.18 0.00 0.00 61.69 59.23 2r59 s THR 420 Cb 0.05 -2.69 0.28 0.00 1.34 0.00 0.00 72.50 71.48 2r59 s THR 420 CO 0.03 0.00 2.02 0.74 -0.54 0.00 0.00 174.62 176.87 2r59 h THR 421 N 1.11 1.09 -0.25 3.99 2.02 -1.97 -1.91 112.91 117.00 2r59 h THR 421 Ca -0.41 -0.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.42 2r59 h THR 421 Cb 1.27 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2r59 h THR 421 CO 0.63 0.13 -0.32 0.44 0.37 0.00 0.00 175.52 176.77 2r59 h ASP 422 N 0.70 0.54 -0.40 4.18 3.45 -1.99 0.20 116.42 123.10 2r59 h ASP 422 Ca 0.22 -0.21 0.04 0.00 0.43 0.00 0.00 57.03 57.51 2r59 h ASP 422 Cb 0.03 -0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 38.61 2r59 h ASP 422 CO -0.06 0.83 0.18 0.44 -1.57 0.00 0.00 179.24 179.07 2r59 h ASP 423 N 0.45 0.24 0.26 6.45 3.32 -1.79 -0.41 116.42 124.95 2r59 h ASP 423 Ca 0.05 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 2r59 h ASP 423 Cb 0.78 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.32 2r59 h ASP 423 CO 0.06 0.18 -0.13 -0.25 -1.72 0.00 0.00 179.24 177.39 2r59 h TRP 424 N 0.37 -0.33 -0.82 4.55 7.01 -0.78 -1.37 115.95 124.58 2r59 h TRP 424 Ca 0.18 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.18 2r59 h TRP 424 Cb 0.11 0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.24 2r59 h TRP 424 CO -0.12 -0.19 0.54 -0.22 -2.79 0.00 0.00 178.44 175.66 2r59 h LYS 425 N -0.37 1.06 -0.29 2.65 3.64 -0.87 0.15 116.57 122.54 2r59 h LYS 425 Ca -0.04 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2r59 h LYS 425 Cb 0.28 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2r59 h LYS 425 CO 0.06 0.70 0.16 -0.44 -2.27 0.00 0.00 179.45 177.66 2r59 h ASP 426 N 1.10 0.25 -0.58 4.20 3.32 -0.97 -1.66 116.42 122.07 2r59 h ASP 426 Ca 0.31 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.27 2r59 h ASP 426 Cb -0.10 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2r59 h ASP 426 CO -0.08 0.18 -0.00 0.15 -1.72 0.00 0.00 179.24 177.77 2r59 h PHE 427 N 0.33 1.13 -0.99 4.55 3.57 -0.83 0.12 116.94 124.83 2r59 h PHE 427 Ca 0.12 -0.19 0.10 0.00 3.53 0.00 0.00 57.97 61.52 2r59 h PHE 427 Cb 0.02 -0.30 -0.08 0.00 2.79 0.00 0.00 35.95 38.38 2r59 h PHE 427 CO -0.09 1.00 0.62 1.25 -2.23 0.00 0.00 178.31 178.87 2r59 h LEU 428 N 0.95 0.94 -0.41 0.59 5.85 -0.38 0.34 115.31 123.19 2r59 h LEU 428 Ca 0.17 0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.75 2r59 h LEU 428 Cb 0.55 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2r59 h LEU 428 CO 0.03 0.53 -0.79 1.88 -0.34 0.00 0.00 178.44 179.75 2r59 h TYR 429 N 1.03 0.23 0.03 1.25 -1.99 -1.05 -1.77 116.97 114.70 2r59 h TYR 429 Ca 0.47 -0.12 -0.00 0.00 2.00 0.00 0.00 58.73 61.08 2r59 h TYR 429 Cb 0.38 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.08 2r59 h TYR 429 CO -0.01 0.89 -0.02 1.03 -0.00 0.00 0.00 178.16 180.05 2r59 h SER 430 N 0.10 -0.04 -0.63 3.88 0.87 -0.17 -2.82 113.55 114.74 2r59 h SER 430 Ca -0.03 -0.30 -0.06 0.00 -1.23 0.00 0.00 61.79 60.18 2r59 h SER 430 Cb 1.38 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 63.33 2r59 h SER 430 CO 0.12 0.28 0.17 0.22 -0.53 0.00 0.00 176.83 177.09 2r59 h TYR 431 N -0.36 1.05 -1.13 2.24 3.20 -0.30 -3.05 116.97 118.62 2r59 h TYR 431 Ca -0.00 -0.12 -0.66 0.00 3.14 0.00 0.00 58.73 61.09 2r59 h TYR 431 Cb 0.33 -0.30 -0.33 0.00 1.54 0.00 0.00 36.73 37.97 2r59 h TYR 431 CO 0.03 0.87 0.37 1.19 -1.64 0.00 0.00 178.16 178.98 2r59 n PHE 432 N -4.34 3.09 0.27 -3.82 3.72 -0.67 -4.73 117.46 110.98 2r59 n PHE 432 Ca 0.04 -2.73 0.13 0.00 -0.05 0.00 0.00 57.45 54.84 2r59 n PHE 432 Cb 0.23 -1.04 0.78 0.00 -0.94 0.00 0.00 39.48 38.51 2r59 n PHE 432 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2r59 h LYS 433 N 2.24 0.00 0.00 -1.08 2.10 -1.38 0.99 116.57 119.45 2r59 h LYS 433 Ca 0.52 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.17 2r59 h LYS 433 Cb 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2r59 h LYS 433 CO 1.31 0.08 0.00 -0.25 -2.00 0.00 0.00 179.45 178.59 2r59 n ASP 434 N -3.77 0.00 -0.47 7.07 10.43 -1.26 -3.14 116.55 125.41 2r59 n ASP 434 Ca -0.02 -0.85 0.07 0.00 2.57 0.00 0.00 54.79 56.55 2r59 n ASP 434 Cb 0.18 -0.03 0.13 0.00 1.84 0.00 0.00 41.12 43.23 2r59 n ASP 434 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2r59 n LYS 435 N -1.03 1.04 0.17 -1.24 5.02 0.33 -4.85 118.16 117.60 2r59 n LYS 435 Ca 0.22 -2.51 0.14 0.00 -2.02 0.00 0.00 58.31 54.14 2r59 n LYS 435 Cb 0.12 -1.22 0.71 0.00 -0.02 0.00 0.00 35.03 34.62 2r59 n LYS 435 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 2r59 h VAL 436 N 2.17 0.78 -0.45 -0.18 -1.51 -1.47 -0.84 116.25 114.74 2r59 h VAL 436 Ca -0.03 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.37 2r59 h VAL 436 Cb 1.16 0.88 -0.02 0.00 -2.13 0.00 0.00 31.29 31.19 2r59 h VAL 436 CO 0.01 0.00 -0.02 0.44 -1.23 0.00 0.00 177.57 176.77 2r59 h ASP 437 N 0.00 0.80 -0.20 4.19 3.32 -1.88 0.30 116.42 122.94 2r59 h ASP 437 Ca 0.10 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 2r59 h ASP 437 Cb 0.42 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2r59 h ASP 437 CO -0.00 0.92 0.10 0.58 -1.72 0.00 0.00 179.24 179.12 2r59 h VAL 438 N 0.66 1.13 -0.36 -1.35 2.07 -1.61 -2.94 116.25 113.85 2r59 h VAL 438 Ca 0.13 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.30 2r59 h VAL 438 Cb 0.52 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2r59 h VAL 438 CO 0.03 0.12 0.21 -0.07 0.02 0.00 0.00 177.57 177.88 2r59 h LEU 439 N 0.20 0.33 -1.46 2.57 3.38 -0.90 -1.89 115.31 117.54 2r59 h LEU 439 Ca 0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2r59 h LEU 439 Cb 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2r59 h LEU 439 CO -0.01 0.24 0.01 0.59 0.09 0.00 0.00 178.44 179.36 2r59 n ASN 440 N -4.89 0.57 0.22 -0.43 5.03 0.10 0.05 115.26 115.90 2r59 n ASN 440 Ca 0.00 0.77 0.14 0.00 0.87 0.00 0.00 54.58 56.36 2r59 n ASN 440 Cb 0.06 -0.84 0.46 0.00 -1.02 0.00 0.00 39.78 38.44 2r59 n ASN 440 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2r59 h GLN 441 N 0.00 0.00 -6.74 3.52 4.20 -1.16 -3.45 115.11 111.48 2r59 h GLN 441 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2r59 h GLN 441 Cb 0.01 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.82 2r59 h GLN 441 CO 0.00 0.00 0.59 0.08 -0.67 0.00 0.00 178.83 178.83 2r59 s VAL 442 N -3.40 3.24 -1.26 -0.54 1.01 0.11 -4.92 120.40 114.63 2r59 s VAL 442 Ca 0.05 1.11 -0.15 0.00 0.00 0.00 0.00 61.98 62.98 2r59 s VAL 442 Cb 0.08 -3.71 0.12 0.00 0.00 0.00 0.00 36.38 32.88 2r59 s VAL 442 CO 0.57 0.21 1.62 -0.67 0.00 0.00 0.00 175.10 176.83 2r59 n ASP 443 N 1.93 5.04 -0.21 3.32 -0.08 -1.26 -4.83 116.55 120.46 2r59 n ASP 443 Ca 0.03 -2.96 -0.00 0.00 -1.51 0.00 0.00 54.79 50.35 2r59 n ASP 443 Cb 0.43 -1.64 0.11 0.00 2.34 0.00 0.00 41.12 42.36 2r59 n ASP 443 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 2r59 h TRP 444 N 7.17 0.46 -0.60 -0.67 4.06 -1.93 -1.98 115.95 122.46 2r59 h TRP 444 Ca 0.39 0.03 -0.06 0.00 2.06 0.00 0.00 58.89 61.30 2r59 h TRP 444 Cb 0.85 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 28.87 2r59 h TRP 444 CO 1.26 0.15 0.12 -0.97 -3.56 0.00 0.00 178.44 175.43 2r59 h ASN 445 N 0.46 0.90 0.52 -3.49 -0.73 -1.98 0.12 115.58 111.39 2r59 h ASN 445 Ca 0.31 -0.19 -0.03 0.00 1.87 0.00 0.00 56.30 58.26 2r59 h ASN 445 Cb 0.34 -0.24 0.01 0.00 0.27 0.00 0.00 38.32 38.70 2r59 h ASN 445 CO -0.28 0.90 -0.25 0.00 -0.37 0.00 0.00 177.43 177.43 2r59 h ALA 446 N 1.22 -0.69 -0.53 1.57 0.00 -1.83 -1.31 119.26 117.68 2r59 h ALA 446 Ca 0.19 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2r59 h ALA 446 Cb 0.37 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2r59 h ALA 446 CO 0.01 -0.80 0.28 -1.49 0.00 0.00 0.00 179.25 177.24 2r59 h TRP 447 N -0.87 0.51 0.04 0.00 4.06 -1.02 -2.10 115.95 116.58 2r59 h TRP 447 Ca -0.07 0.02 -0.31 0.00 2.06 0.00 0.00 58.89 60.59 2r59 h TRP 447 Cb 0.60 -0.15 -0.04 0.00 -1.00 0.00 0.00 29.16 28.57 2r59 h TRP 447 CO -0.01 0.25 -1.73 -0.07 -3.56 0.00 0.00 178.44 173.32 2r59 h LEU 448 N 0.54 0.15 0.00 -4.49 3.38 -0.84 -3.39 115.31 110.65 2r59 h LEU 448 Ca 0.23 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2r59 h LEU 448 Cb 0.12 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2r59 h LEU 448 CO -0.15 1.27 -0.27 -1.22 0.09 0.00 0.00 178.44 178.16 2r59 n TYR 449 N -3.21 0.00 -3.33 1.13 4.01 -0.54 -1.10 117.16 114.12 2r59 n TYR 449 Ca -0.20 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.18 2r59 n TYR 449 Cb 1.05 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 40.02 2r59 n TYR 449 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2r59 s SER 450 N -1.02 6.91 0.93 7.72 0.01 -0.79 -4.87 113.70 122.58 2r59 s SER 450 Ca 0.00 1.14 -0.13 0.00 1.31 0.00 0.00 55.95 58.27 2r59 s SER 450 Cb 0.00 -2.31 0.15 0.00 0.21 0.00 0.00 66.02 64.07 2r59 s SER 450 CO 0.00 0.17 1.16 -2.16 0.41 0.00 0.00 173.24 172.82 2r59 s PRO 451 N -1.63 0.98 0.32 12.44 0.04 -1.26 -4.43 135.00 141.46 2r59 s PRO 451 Ca 0.34 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.57 2r59 s PRO 451 Cb -0.17 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2r59 s PRO 451 CO 0.19 -2.28 0.00 0.41 0.04 0.00 0.00 177.00 175.35 2r59 n GLY 452 N -2.34 -2.46 3.72 0.56 0.00 -1.02 -4.88 105.19 98.77 2r59 n GLY 452 Ca 0.08 -1.76 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 2r59 n GLY 452 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r59 s LEU 453 N 0.00 3.32 0.82 0.99 1.43 -1.26 -4.88 118.68 119.09 2r59 s LEU 453 Ca 0.00 2.42 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 2r59 s LEU 453 Cb 0.00 -4.60 0.09 0.00 0.03 0.00 0.00 46.19 41.71 2r59 s LEU 453 CO 0.00 -2.33 1.12 -2.84 0.23 0.00 0.00 176.35 172.53 2r59 s PRO 454 N -3.86 1.83 0.00 1.29 0.02 -1.26 -4.91 135.00 128.11 2r59 s PRO 454 Ca 0.76 1.34 0.22 0.00 0.02 0.00 0.00 61.00 63.34 2r59 s PRO 454 Cb -0.31 -1.84 1.15 0.00 0.02 0.00 0.00 34.50 33.52 2r59 s PRO 454 CO 0.46 -1.99 1.72 -0.35 -0.33 0.00 0.00 177.00 176.51 2r59 n PRO 455 N -3.70 0.36 -3.67 5.54 -0.04 -1.26 -4.65 135.00 127.57 2r59 n PRO 455 Ca 0.10 0.07 -0.09 0.00 -0.04 0.00 0.00 63.50 63.54 2r59 n PRO 455 Cb 0.52 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 2r59 n PRO 455 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2r59 s ILE 456 N -2.51 -0.07 -0.17 0.52 1.10 -1.26 -5.14 121.20 113.66 2r59 s ILE 456 Ca 0.22 0.07 -0.17 0.00 -0.51 0.00 0.00 60.65 60.26 2r59 s ILE 456 Cb 0.15 -0.74 -0.04 0.00 0.15 0.00 0.00 42.46 41.98 2r59 s ILE 456 CO 0.33 0.03 0.46 -0.75 -2.11 0.00 0.00 174.94 172.90 2r59 s LYS 457 N 1.58 4.23 1.19 3.50 2.20 -1.26 -5.03 119.74 126.14 2r59 s LYS 457 Ca -0.09 0.35 -0.16 0.00 -0.36 0.00 0.00 55.97 55.71 2r59 s LYS 457 Cb -0.08 -3.51 0.23 0.00 -1.51 0.00 0.00 37.83 32.96 2r59 s LYS 457 CO -0.15 -0.01 0.57 -2.30 -0.36 0.00 0.00 175.35 173.10 2r59 n PRO 458 N 4.31 -2.45 -3.02 4.03 -0.02 -1.26 -4.99 135.00 131.60 2r59 n PRO 458 Ca -0.07 -0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 60.31 2r59 n PRO 458 Cb 0.51 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 32.02 2r59 n PRO 458 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2r59 s ASN 459 N -2.20 6.94 -0.12 2.55 0.01 -1.26 -5.07 114.94 115.78 2r59 s ASN 459 Ca 0.62 1.14 0.03 0.00 -0.71 0.00 0.00 52.86 53.95 2r59 s ASN 459 Cb -0.18 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.07 2r59 s ASN 459 CO 0.64 -0.19 -0.23 -0.31 -1.51 0.00 0.00 177.10 175.50 2r59 s TYR 460 N 1.22 2.63 0.30 2.20 1.51 -1.26 -5.10 117.35 118.85 2r59 s TYR 460 Ca 0.37 -1.22 -0.30 0.00 -1.01 0.00 0.00 57.07 54.91 2r59 s TYR 460 Cb -0.17 -1.78 -0.12 0.00 -0.11 0.00 0.00 41.96 39.78 2r59 s TYR 460 CO 0.16 -0.53 1.53 -3.47 -1.11 0.00 0.00 175.55 172.13 2r59 n ASP 461 N 3.85 3.59 -0.77 2.29 2.03 -1.26 -4.93 116.55 121.34 2r59 n ASP 461 Ca -0.20 1.16 0.09 0.00 0.52 0.00 0.00 54.79 56.37 2r59 n ASP 461 Cb 0.52 -1.56 0.11 0.00 -0.72 0.00 0.00 41.12 39.47 2r59 n ASP 461 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2r59 n MET 462 N 1.74 1.73 -0.04 -0.67 2.81 -1.26 -4.50 117.12 116.92 2r59 n MET 462 Ca 0.08 -1.72 -0.08 0.00 -1.81 0.00 0.00 57.70 54.16 2r59 n MET 462 Cb 0.36 -1.36 -0.02 0.00 -0.71 0.00 0.00 33.22 31.49 2r59 n MET 462 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2r59 h THR 463 N 3.41 0.38 0.00 2.03 2.02 -1.92 0.12 112.91 118.96 2r59 h THR 463 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2r59 h THR 463 Cb 0.76 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2r59 h THR 463 CO 0.00 0.00 0.00 -0.07 0.37 0.00 0.00 175.52 175.82 2r59 h LEU 464 N -0.26 0.00 0.00 2.58 3.38 -1.87 -3.28 115.31 115.85 2r59 h LEU 464 Ca 0.13 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.89 2r59 h LEU 464 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 2r59 h LEU 464 CO -0.38 0.00 -1.26 0.74 0.09 0.00 0.00 178.44 177.63 2r59 h THR 465 N 0.00 1.01 -0.55 0.22 2.02 -1.52 -3.40 112.91 110.69 2r59 h THR 465 Ca 0.00 -2.66 0.08 0.00 0.77 0.00 0.00 66.41 64.60 2r59 h THR 465 Cb 0.78 2.45 -0.06 0.00 -1.74 0.00 0.00 68.15 69.57 2r59 h THR 465 CO 0.00 0.57 0.20 0.78 0.37 0.00 0.00 175.52 177.45 2r59 h ASN 466 N 0.00 0.20 -0.28 4.18 -0.26 -1.10 -1.50 115.58 116.83 2r59 h ASN 466 Ca -0.14 0.07 -0.03 0.00 -0.56 0.00 0.00 56.30 55.64 2r59 h ASN 466 Cb 1.75 0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 39.04 2r59 h ASN 466 CO 0.08 0.13 0.09 0.00 -1.06 0.00 0.00 177.43 176.67 2r59 h ALA 467 N 1.37 1.49 -0.15 -0.83 0.00 -1.79 -0.04 119.26 119.30 2r59 h ALA 467 Ca 0.27 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2r59 h ALA 467 Cb 0.31 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2r59 h ALA 467 CO -0.27 0.38 0.01 0.00 0.00 0.00 0.00 179.25 179.37 2r59 h ILE 469 N 0.02 1.19 -0.41 0.00 2.04 -0.94 -0.97 117.51 118.43 2r59 h ILE 469 Ca 0.04 -0.59 0.03 0.00 1.00 0.00 0.00 64.86 65.35 2r59 h ILE 469 Cb 0.33 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 2r59 h ILE 469 CO 0.00 0.20 0.20 0.00 0.00 0.00 0.00 178.15 178.56 2r59 h ALA 470 N 0.96 0.51 -0.42 1.87 0.00 -1.06 0.17 119.26 121.30 2r59 h ALA 470 Ca 0.11 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2r59 h ALA 470 Cb 0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2r59 h ALA 470 CO -0.01 -0.16 -0.17 1.25 0.00 0.00 0.00 179.25 180.16 2r59 h LEU 471 N 0.40 0.88 -0.49 0.00 5.85 -1.36 -1.76 115.31 118.84 2r59 h LEU 471 Ca 0.18 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.55 2r59 h LEU 471 Cb 0.10 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2r59 h LEU 471 CO -0.13 1.07 0.23 -1.28 -0.34 0.00 0.00 178.44 177.99 2r59 h SER 472 N 0.68 0.33 -0.05 1.25 0.87 -0.89 -1.79 113.55 113.94 2r59 h SER 472 Ca 0.10 0.03 -0.08 0.00 -1.23 0.00 0.00 61.79 60.61 2r59 h SER 472 Cb 0.73 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 2r59 h SER 472 CO 0.06 0.23 -0.18 1.56 -0.53 0.00 0.00 176.83 177.96 2r59 h GLN 473 N 0.46 0.42 -0.41 2.24 1.08 -0.87 -1.45 115.11 116.58 2r59 h GLN 473 Ca 0.22 -0.13 0.01 0.00 -1.45 0.00 0.00 58.65 57.29 2r59 h GLN 473 Cb 0.14 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 2r59 h GLN 473 CO -0.16 0.59 0.26 0.00 -0.95 0.00 0.00 178.83 178.57 2r59 h ARG 474 N 0.38 0.52 -0.08 1.46 3.08 -0.79 0.62 114.38 119.57 2r59 h ARG 474 Ca 0.07 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 2r59 h ARG 474 Cb 0.54 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2r59 h ARG 474 CO 0.04 0.35 0.01 -1.49 -1.07 0.00 0.00 179.97 177.80 2r59 h TRP 475 N 0.54 0.15 -0.52 3.04 4.06 -0.93 -1.63 115.95 120.65 2r59 h TRP 475 Ca 0.15 -0.02 0.03 0.00 2.06 0.00 0.00 58.89 61.11 2r59 h TRP 475 Cb -0.05 -0.04 -0.04 0.00 -1.00 0.00 0.00 29.16 28.03 2r59 h TRP 475 CO -0.05 0.38 0.30 0.82 -3.56 0.00 0.00 178.44 176.32 2r59 h ILE 476 N -0.11 1.02 -0.03 1.49 2.04 -1.14 -2.41 117.51 118.36 2r59 h ILE 476 Ca 0.02 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2r59 h ILE 476 Cb 0.31 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2r59 h ILE 476 CO 0.00 0.11 0.00 0.35 0.00 0.00 0.00 178.15 178.61 2r59 n THR 477 N -4.82 0.03 -2.32 -0.27 -2.24 0.20 -4.90 114.28 99.95 2r59 n THR 477 Ca 0.04 -0.15 -0.39 0.00 -2.27 0.00 0.00 64.05 61.29 2r59 n THR 477 Cb 0.10 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 2r59 n THR 477 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2r59 s ALA 478 N -1.97 3.26 0.52 6.98 0.00 -0.61 -5.04 121.76 124.89 2r59 s ALA 478 Ca 0.39 0.98 0.09 0.00 0.00 0.00 0.00 51.96 53.42 2r59 s ALA 478 Cb 0.20 -3.38 0.06 0.00 0.00 0.00 0.00 23.12 20.00 2r59 s ALA 478 CO 0.32 -0.44 0.71 0.15 0.00 0.00 0.00 175.76 176.50 2r59 s LYS 479 N -2.05 2.50 0.30 0.00 -0.14 -1.26 -4.97 119.74 114.12 2r59 s LYS 479 Ca 0.53 -1.47 0.06 0.00 -1.36 0.00 0.00 55.97 53.73 2r59 s LYS 479 Cb -0.32 -2.68 0.77 0.00 -1.68 0.00 0.00 37.83 33.92 2r59 s LYS 479 CO 0.41 -0.65 1.74 1.49 -0.76 0.00 0.00 175.35 177.58 2r59 h GLU 480 N 0.34 0.58 0.00 1.68 4.81 -2.01 0.62 114.58 120.59 2r59 h GLU 480 Ca -0.34 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2r59 h GLU 480 Cb 1.28 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2r59 h GLU 480 CO 0.42 0.38 0.00 -0.40 -0.73 0.00 0.00 179.01 178.69 2r59 n ASP 481 N -4.89 0.00 -0.00 1.04 3.85 -1.26 -2.41 116.55 112.88 2r59 n ASP 481 Ca 0.24 -0.38 0.10 0.00 -0.71 0.00 0.00 54.79 54.04 2r59 n ASP 481 Cb 0.64 -0.13 -0.11 0.00 -1.35 0.00 0.00 41.12 40.17 2r59 n ASP 481 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2r59 n ASP 482 N -1.13 0.83 0.02 -1.12 8.00 0.21 -4.49 116.55 118.88 2r59 n ASP 482 Ca 0.13 -0.82 -0.03 0.00 0.71 0.00 0.00 54.79 54.79 2r59 n ASP 482 Cb 0.12 1.12 0.23 0.00 -0.02 0.00 0.00 41.12 42.56 2r59 n ASP 482 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2r59 h LEU 483 N 0.00 0.46 -2.09 0.64 3.38 -1.48 -2.04 115.31 114.17 2r59 h LEU 483 Ca 0.00 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 57.90 2r59 h LEU 483 Cb 0.58 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2r59 h LEU 483 CO 0.00 0.68 0.21 -1.13 0.09 0.00 0.00 178.44 178.29 2r59 h ASN 484 N 0.42 0.00 1.31 -0.43 -1.24 -1.79 -1.89 115.58 111.96 2r59 h ASN 484 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.08 2r59 h ASN 484 Cb 0.61 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.66 2r59 h ASN 484 CO 0.04 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 174.64 2r59 n SER 485 N -4.20 0.82 -4.79 1.15 3.41 -0.77 -4.79 113.62 104.45 2r59 n SER 485 Ca 0.03 0.60 -0.35 0.00 -0.26 0.00 0.00 58.87 58.89 2r59 n SER 485 Cb 0.35 -0.81 -0.04 0.00 -0.26 0.00 0.00 64.21 63.45 2r59 n SER 485 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2r59 s PHE 486 N -3.16 3.19 -0.07 7.33 0.08 -0.71 -5.06 117.98 119.58 2r59 s PHE 486 Ca 0.09 1.62 -0.27 0.00 0.12 0.00 0.00 56.93 58.49 2r59 s PHE 486 Cb 0.11 -3.08 0.06 0.00 -0.57 0.00 0.00 43.02 39.55 2r59 s PHE 486 CO 0.55 -0.62 0.62 1.21 -0.10 0.00 0.00 175.22 176.88 2r59 s ASN 487 N -1.76 -0.59 0.65 1.36 3.84 -1.26 -4.99 114.94 112.20 2r59 s ASN 487 Ca 0.61 0.69 0.22 0.00 0.21 0.00 0.00 52.86 54.59 2r59 s ASN 487 Cb -0.19 0.60 1.17 0.00 -0.55 0.00 0.00 41.25 42.28 2r59 s ASN 487 CO 0.24 -0.54 1.65 0.00 -2.79 0.00 0.00 177.10 175.66 2r59 h ALA 488 N 3.39 1.72 0.00 1.71 0.00 -1.96 0.96 119.26 125.09 2r59 h ALA 488 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2r59 h ALA 488 Cb 1.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2r59 h ALA 488 CO 0.36 -0.64 0.00 1.79 0.00 0.00 0.00 179.25 180.76 2r59 h THR 489 N 0.00 0.00 -0.53 0.00 1.35 -1.96 -2.92 112.91 108.85 2r59 h THR 489 Ca 0.06 -0.31 0.15 0.00 -0.55 0.00 0.00 66.41 65.76 2r59 h THR 489 Cb 1.21 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 68.83 2r59 h THR 489 CO -0.00 0.00 0.38 0.44 -0.25 0.00 0.00 175.52 176.09 2r59 h ASP 490 N 0.00 0.03 0.15 5.36 3.32 -1.22 -2.69 116.42 121.37 2r59 h ASP 490 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2r59 h ASP 490 Cb 0.34 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2r59 h ASP 490 CO 0.00 0.01 -0.39 0.18 -1.72 0.00 0.00 179.24 177.32 2r59 n LEU 491 N -4.39 1.36 0.18 1.55 4.77 -1.10 -4.60 117.00 114.77 2r59 n LEU 491 Ca 0.10 -0.44 0.04 0.00 -0.03 0.00 0.00 56.01 55.68 2r59 n LEU 491 Cb 0.59 -0.08 0.46 0.00 -2.33 0.00 0.00 43.42 42.05 2r59 n LEU 491 CO 0.37 0.26 0.89 0.07 -1.33 0.00 0.00 177.39 177.64 2r59 h LYS 492 N 1.51 0.08 -0.47 3.23 2.10 -1.62 -2.47 116.57 118.94 2r59 h LYS 492 Ca 0.00 -0.02 -0.07 0.00 -2.00 0.00 0.00 60.65 58.57 2r59 h LYS 492 Cb 0.60 -0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 31.87 2r59 h LYS 492 CO 0.00 0.26 0.06 -0.25 -2.00 0.00 0.00 179.45 177.52 2r59 n ASP 493 N -4.30 4.53 -4.61 7.07 8.00 -1.26 -4.94 116.55 121.04 2r59 n ASP 493 Ca -0.02 -3.11 -0.34 0.00 0.71 0.00 0.00 54.79 52.03 2r59 n ASP 493 Cb 0.26 -0.64 -0.10 0.00 -0.02 0.00 0.00 41.12 40.61 2r59 n ASP 493 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2r59 s LEU 494 N -2.89 3.56 0.93 0.64 1.43 -0.93 -5.11 118.68 116.31 2r59 s LEU 494 Ca 0.49 0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 53.50 2r59 s LEU 494 Cb 0.39 -1.86 0.15 0.00 0.03 0.00 0.00 46.19 44.90 2r59 s LEU 494 CO 0.11 0.24 1.15 -0.94 0.23 0.00 0.00 176.35 177.14 2r59 s SER 495 N -0.02 3.31 0.47 2.29 1.04 -1.26 -4.78 113.70 114.75 2r59 s SER 495 Ca 0.04 0.90 0.13 0.00 0.48 0.00 0.00 55.95 57.49 2r59 s SER 495 Cb -0.13 -1.42 1.09 0.00 0.10 0.00 0.00 66.02 65.67 2r59 s SER 495 CO 0.02 -2.67 2.10 0.77 0.98 0.00 0.00 173.24 174.44 2r59 h SER 496 N -1.58 0.22 -0.55 7.02 4.64 -1.99 -1.00 113.55 120.30 2r59 h SER 496 Ca -0.50 -0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.71 2r59 h SER 496 Cb 1.32 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 2r59 h SER 496 CO 0.59 0.15 -0.06 0.45 -0.87 0.00 0.00 176.83 177.09 2r59 h HIS 497 N 0.25 1.12 -0.14 4.77 3.86 -1.94 -1.30 115.15 121.77 2r59 h HIS 497 Ca 0.09 -0.22 -0.10 0.00 -1.16 0.00 0.00 60.37 58.98 2r59 h HIS 497 Cb 0.04 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.22 2r59 h HIS 497 CO -0.00 1.03 -0.36 1.96 0.86 0.00 0.00 177.93 181.42 2r59 h GLN 498 N 0.90 0.30 -0.48 2.45 4.20 -1.68 -1.17 115.11 119.62 2r59 h GLN 498 Ca 0.15 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 2r59 h GLN 498 Cb 0.62 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2r59 h GLN 498 CO 0.04 0.62 -0.07 1.25 -0.67 0.00 0.00 178.83 180.00 2r59 h LEU 499 N 0.26 0.90 -0.72 1.46 5.85 -1.01 0.75 115.31 122.80 2r59 h LEU 499 Ca 0.03 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 2r59 h LEU 499 Cb 0.76 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2r59 h LEU 499 CO 0.06 1.03 0.36 -1.13 -0.34 0.00 0.00 178.44 178.42 2r59 h ASN 500 N 0.75 0.93 0.06 1.25 -1.24 -1.07 -1.87 115.58 114.39 2r59 h ASN 500 Ca 0.13 -0.12 -0.15 0.00 0.71 0.00 0.00 56.30 56.87 2r59 h ASN 500 Cb 0.61 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 2r59 h ASN 500 CO 0.04 0.79 -0.50 -0.08 -1.29 0.00 0.00 177.43 176.39 2r59 h GLU 501 N 1.00 0.50 -0.49 6.67 4.57 -0.97 0.50 114.58 126.36 2r59 h GLU 501 Ca 0.25 -0.29 0.09 0.00 -1.18 0.00 0.00 59.36 58.23 2r59 h GLU 501 Cb 0.09 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 28.63 2r59 h GLU 501 CO -0.03 0.88 0.08 0.35 -1.18 0.00 0.00 179.01 179.10 2r59 h PHE 502 N 0.39 0.11 -0.16 0.92 3.57 -0.58 0.34 116.94 121.53 2r59 h PHE 502 Ca 0.02 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 2r59 h PHE 502 Cb 1.01 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.77 2r59 h PHE 502 CO 0.04 -0.03 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.48 2r59 h LEU 503 N 0.20 0.51 -0.50 0.59 3.38 -1.07 -2.25 115.31 116.17 2r59 h LEU 503 Ca 0.25 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2r59 h LEU 503 Cb 0.34 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2r59 h LEU 503 CO -0.34 0.95 0.25 0.00 0.09 0.00 0.00 178.44 179.38 2r59 h ALA 504 N 1.07 0.65 -0.59 1.53 0.00 -0.43 0.20 119.26 121.68 2r59 h ALA 504 Ca 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2r59 h ALA 504 Cb 1.05 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2r59 h ALA 504 CO 0.10 0.20 0.31 1.96 0.00 0.00 0.00 179.25 181.82 2r59 h GLN 505 N 0.67 0.83 -0.03 0.00 1.08 -0.84 -2.03 115.11 114.79 2r59 h GLN 505 Ca 0.17 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 57.21 2r59 h GLN 505 Cb 0.10 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.38 2r59 h GLN 505 CO -0.02 0.65 -0.22 1.15 -0.95 0.00 0.00 178.83 179.44 2r59 h THR 506 N 0.80 1.49 -1.09 -0.54 2.02 -1.16 -2.97 112.91 111.47 2r59 h THR 506 Ca 0.21 -1.75 0.31 0.00 0.77 0.00 0.00 66.41 65.95 2r59 h THR 506 Cb 0.07 2.53 -0.12 0.00 -1.74 0.00 0.00 68.15 68.90 2r59 h THR 506 CO -0.03 0.48 0.68 0.25 0.37 0.00 0.00 175.52 177.27 2r59 h LEU 507 N -0.39 0.45 -2.50 2.58 5.85 -0.56 0.58 115.31 121.31 2r59 h LEU 507 Ca -0.02 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2r59 h LEU 507 Cb 0.90 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.00 2r59 h LEU 507 CO 0.04 -0.01 -0.02 1.56 -0.34 0.00 0.00 178.44 179.67 2r59 h GLN 508 N 0.34 0.00 -0.44 1.25 4.20 -1.19 -2.25 115.11 117.02 2r59 h GLN 508 Ca 0.68 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.39 2r59 h GLN 508 Cb 1.72 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.50 2r59 h GLN 508 CO -0.41 0.02 0.00 0.54 -0.67 0.00 0.00 178.83 178.31 2r59 n ARG 509 N -3.41 2.93 -2.00 1.46 3.00 0.17 -5.02 116.66 113.79 2r59 n ARG 509 Ca -0.02 -2.32 -0.34 0.00 -0.01 0.00 0.00 57.85 55.15 2r59 n ARG 509 Cb 0.13 -1.44 0.03 0.00 0.00 0.00 0.00 32.46 31.17 2r59 n ARG 509 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2r59 s ALA 510 N -1.26 2.57 0.52 7.54 0.00 -0.85 -4.46 121.76 125.83 2r59 s ALA 510 Ca 0.32 0.71 -0.20 0.00 0.00 0.00 0.00 51.96 52.80 2r59 s ALA 510 Cb 0.19 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.89 2r59 s ALA 510 CO 0.19 -1.04 1.12 -1.25 0.00 0.00 0.00 175.76 174.77 2r59 s PRO 511 N -3.66 3.50 0.29 0.00 0.04 -1.26 -5.05 135.00 128.85 2r59 s PRO 511 Ca 0.70 1.58 0.06 0.00 0.04 0.00 0.00 61.00 63.39 2r59 s PRO 511 Cb -0.23 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 2r59 s PRO 511 CO 0.34 -0.72 0.38 -0.51 0.04 0.00 0.00 177.00 176.53 2r59 s LEU 512 N -3.63 4.08 0.53 -3.56 1.02 -1.26 -5.00 118.68 110.87 2r59 s LEU 512 Ca 0.70 -0.10 -0.22 0.00 0.02 0.00 0.00 54.13 54.53 2r59 s LEU 512 Cb -0.23 -2.72 -0.06 0.00 0.02 0.00 0.00 46.19 43.20 2r59 s LEU 512 CO 0.27 -0.23 1.31 -2.65 0.02 0.00 0.00 176.35 175.06 2r59 n PRO 513 N -1.48 1.67 -0.31 1.29 -0.02 -1.26 -4.72 135.00 130.17 2r59 n PRO 513 Ca -0.05 0.61 0.01 0.00 -2.02 0.00 0.00 63.50 62.06 2r59 n PRO 513 Cb 0.58 -2.50 0.15 0.00 -0.02 0.00 0.00 33.50 31.70 2r59 n PRO 513 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2r59 h LEU 514 N 1.48 0.82 -1.01 2.45 5.85 -1.97 -1.46 115.31 121.47 2r59 h LEU 514 Ca -0.50 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.31 2r59 h LEU 514 Cb 1.31 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 42.12 2r59 h LEU 514 CO 0.57 0.52 0.65 1.23 -0.34 0.00 0.00 178.44 181.07 2r59 h GLY 515 N 0.95 1.55 0.73 3.75 0.00 -1.95 -0.83 103.07 107.27 2r59 h GLY 515 Ca 0.38 -0.47 0.03 0.00 0.00 0.00 0.00 47.33 47.27 2r59 h GLY 515 CO -0.19 0.32 -0.05 0.45 0.00 0.00 0.00 176.54 177.08 2r59 h HIS 516 N 1.16 -0.11 -0.59 5.60 3.86 -1.64 -1.35 115.15 122.09 2r59 h HIS 516 Ca 0.44 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.63 2r59 h HIS 516 Cb 0.20 0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 2r59 h HIS 516 CO -0.00 -0.08 0.25 0.82 0.86 0.00 0.00 177.93 179.78 2r59 h ILE 517 N -0.04 1.22 -0.98 2.45 1.08 -1.10 -0.98 117.51 119.17 2r59 h ILE 517 Ca 0.06 -0.67 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 2r59 h ILE 517 Cb 0.12 0.57 -0.05 0.00 -3.07 0.00 0.00 36.82 34.40 2r59 h ILE 517 CO -0.13 0.26 0.63 0.11 -0.69 0.00 0.00 178.15 178.33 2r59 h LYS 518 N 0.81 1.30 -0.50 2.37 1.57 -1.13 -1.90 116.57 119.09 2r59 h LYS 518 Ca 0.20 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2r59 h LYS 518 Cb 0.17 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2r59 h LYS 518 CO -0.02 0.88 0.30 -0.09 -0.57 0.00 0.00 179.45 179.95 2r59 h ARG 519 N 1.33 0.68 -0.65 3.15 9.65 -0.71 -0.68 114.38 127.15 2r59 h ARG 519 Ca 0.36 -0.06 0.06 0.00 -1.10 0.00 0.00 59.98 59.23 2r59 h ARG 519 Cb -0.12 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 28.26 2r59 h ARG 519 CO -0.07 0.50 0.36 1.98 2.80 0.00 0.00 179.97 185.53 2r59 h MET 520 N 0.67 0.64 -0.78 0.20 4.05 -0.73 -0.01 114.93 118.97 2r59 h MET 520 Ca 0.18 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.51 2r59 h MET 520 Cb -0.00 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 30.62 2r59 h MET 520 CO -0.03 0.43 0.31 0.37 0.23 0.00 0.00 176.91 178.21 2r59 h GLN 521 N 0.66 1.17 -0.76 0.39 5.75 -1.10 0.71 115.11 121.93 2r59 h GLN 521 Ca 0.29 -0.22 -0.04 0.00 -0.15 0.00 0.00 58.65 58.53 2r59 h GLN 521 Cb 0.19 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.51 2r59 h GLN 521 CO -0.18 0.95 0.30 1.49 -2.65 0.00 0.00 178.83 178.75 2r59 h GLU 522 N 1.14 1.13 0.00 1.69 4.81 0.49 -0.55 114.58 123.29 2r59 h GLU 522 Ca 0.26 -0.20 -0.31 0.00 -0.13 0.00 0.00 59.36 58.98 2r59 h GLU 522 Cb 0.22 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.36 2r59 h GLU 522 CO -0.02 0.92 -2.25 1.33 -0.73 0.00 0.00 179.01 178.25 2r59 n VAL 523 N -4.28 1.24 0.19 0.32 0.24 -0.19 -4.49 118.33 111.36 2r59 n VAL 523 Ca 0.07 -0.81 0.07 0.00 -2.04 0.00 0.00 64.34 61.63 2r59 n VAL 523 Cb 0.18 -0.46 -0.10 0.00 -1.47 0.00 0.00 33.84 31.98 2r59 n VAL 523 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2r59 n TYR 524 N -2.72 0.00 -3.89 6.34 4.01 0.23 -3.37 117.16 117.76 2r59 n TYR 524 Ca -0.28 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.18 2r59 n TYR 524 Cb 1.07 -0.24 -0.00 0.00 -0.31 0.00 0.00 39.34 39.86 2r59 n TYR 524 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2r59 n ASN 525 N -1.81 -1.96 0.25 7.72 4.05 -0.22 -4.87 115.26 118.42 2r59 n ASN 525 Ca -0.01 -1.03 0.11 0.00 0.45 0.00 0.00 54.58 54.09 2r59 n ASN 525 Cb 0.34 -3.03 0.64 0.00 1.23 0.00 0.00 39.78 38.96 2r59 n ASN 525 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 2r59 h PHE 526 N -1.91 0.00 -0.17 1.20 0.04 -1.79 -2.37 116.94 111.93 2r59 h PHE 526 Ca -0.65 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.17 2r59 h PHE 526 Cb 1.37 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.52 2r59 h PHE 526 CO 0.44 0.16 0.18 -0.91 -0.60 0.00 0.00 178.31 177.58 2r59 h ASN 527 N 0.00 0.00 1.65 2.17 -0.26 -1.90 -1.81 115.58 115.43 2r59 h ASN 527 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2r59 h ASN 527 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 2r59 h ASN 527 CO 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.39 2r59 h ALA 528 N 1.80 1.00 -2.27 -0.83 0.00 -1.80 -3.46 119.26 113.70 2r59 h ALA 528 Ca 0.08 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.44 2r59 h ALA 528 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2r59 h ALA 528 CO -0.00 0.00 0.83 0.42 0.00 0.00 0.00 179.25 180.50 2r59 s ILE 529 N -3.19 4.07 -0.21 0.00 1.01 -0.68 -4.92 121.20 117.27 2r59 s ILE 529 Ca 0.08 1.37 0.19 0.00 0.00 0.00 0.00 60.65 62.29 2r59 s ILE 529 Cb 0.09 -3.88 0.03 0.00 0.01 0.00 0.00 42.46 38.71 2r59 s ILE 529 CO 0.62 -0.05 1.18 0.78 0.00 0.00 0.00 174.94 177.47 2r59 h ASN 530 N 7.96 0.00 -1.46 3.58 2.35 -1.89 -3.43 115.58 122.69 2r59 h ASN 530 Ca -0.33 0.00 -0.71 0.00 -0.55 0.00 0.00 56.30 54.71 2r59 h ASN 530 Cb 1.15 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.52 2r59 h ASN 530 CO 0.92 0.32 1.06 -3.20 -1.65 0.00 0.00 177.43 174.88 2r59 n ASN 531 N -2.97 2.44 -0.16 5.81 2.85 -1.26 -4.85 115.26 117.12 2r59 n ASN 531 Ca -0.02 0.90 -0.01 0.00 -0.11 0.00 0.00 54.58 55.34 2r59 n ASN 531 Cb 0.69 -1.19 0.22 0.00 1.24 0.00 0.00 39.78 40.74 2r59 n ASN 531 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 2r59 h SER 532 N 8.73 0.81 -0.26 1.20 4.64 -1.91 0.12 113.55 126.88 2r59 h SER 532 Ca -0.41 -0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 60.71 2r59 h SER 532 Cb 1.32 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2r59 h SER 532 CO 0.98 0.69 -0.27 -0.33 -0.87 0.00 0.00 176.83 177.03 2r59 h GLU 533 N 0.89 0.64 -0.47 4.77 4.39 -1.88 -0.48 114.58 122.43 2r59 h GLU 533 Ca 0.22 -0.34 -0.10 0.00 0.34 0.00 0.00 59.36 59.48 2r59 h GLU 533 Cb 0.10 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2r59 h GLU 533 CO -0.03 0.94 -0.11 0.82 -1.16 0.00 0.00 179.01 179.48 2r59 h ILE 534 N 0.36 1.27 -0.56 3.13 2.04 -1.86 -2.35 117.51 119.54 2r59 h ILE 534 Ca 0.04 -1.23 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 2r59 h ILE 534 Cb 0.83 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 2r59 h ILE 534 CO 0.07 0.43 0.01 -0.09 0.00 0.00 0.00 178.15 178.56 2r59 h ARG 535 N 0.75 0.99 -0.10 2.37 2.43 -0.69 -1.65 114.38 118.48 2r59 h ARG 535 Ca 0.12 -0.31 0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2r59 h ARG 535 Cb 0.66 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 2r59 h ARG 535 CO 0.05 0.98 -0.14 0.35 -1.51 0.00 0.00 179.97 179.70 2r59 h PHE 536 N 0.88 -0.36 -0.55 2.20 3.57 -1.01 0.44 116.94 122.11 2r59 h PHE 536 Ca 0.16 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2r59 h PHE 536 Cb 0.53 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.42 2r59 h PHE 536 CO 0.04 -0.21 0.27 0.00 -2.23 0.00 0.00 178.31 176.18 2r59 h ARG 537 N -0.19 0.78 -0.30 1.11 3.08 -1.26 -1.42 114.38 116.19 2r59 h ARG 537 Ca 0.08 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.04 2r59 h ARG 537 Cb 0.30 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 2r59 h ARG 537 CO -0.21 0.64 0.14 2.35 -1.07 0.00 0.00 179.97 181.81 2r59 h TRP 538 N 0.74 0.25 -0.50 3.04 -0.00 -1.16 -0.22 115.95 118.11 2r59 h TRP 538 Ca 0.19 0.01 -0.07 0.00 -0.00 0.00 0.00 58.89 59.03 2r59 h TRP 538 Cb 0.11 -0.07 -0.02 0.00 -0.00 0.00 0.00 29.16 29.18 2r59 h TRP 538 CO -0.00 0.14 0.04 -0.07 -0.00 0.00 0.00 178.44 178.54 2r59 h LEU 539 N 0.29 0.77 -0.74 0.65 3.38 -0.73 -0.97 115.31 117.97 2r59 h LEU 539 Ca 0.12 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2r59 h LEU 539 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2r59 h LEU 539 CO -0.09 0.81 0.21 0.03 0.09 0.00 0.00 178.44 179.48 2r59 h ARG 540 N 0.76 1.16 -0.69 1.13 3.08 -1.01 -0.83 114.38 117.98 2r59 h ARG 540 Ca 0.15 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.89 2r59 h ARG 540 Cb 0.40 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 2r59 h ARG 540 CO 0.01 1.00 0.24 1.25 -1.07 0.00 0.00 179.97 181.40 2r59 h LEU 541 N 1.11 0.99 -0.23 3.04 5.85 -0.51 0.32 115.31 125.87 2r59 h LEU 541 Ca 0.23 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 2r59 h LEU 541 Cb 0.34 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2r59 h LEU 541 CO -0.00 0.92 -0.11 0.00 -0.34 0.00 0.00 178.44 178.90 2r59 h ILE 543 N 0.20 1.28 0.00 0.00 1.08 -1.01 -1.23 117.51 117.83 2r59 h ILE 543 Ca 0.05 -0.99 -0.02 0.00 -0.39 0.00 0.00 64.86 63.51 2r59 h ILE 543 Cb 0.61 1.52 -0.00 0.00 -3.07 0.00 0.00 36.82 35.88 2r59 h ILE 543 CO 0.03 0.30 -0.10 1.56 -0.69 0.00 0.00 178.15 179.26 2r59 h GLN 544 N 0.12 0.00 -0.13 2.37 4.20 -0.95 -0.98 115.11 119.74 2r59 h GLN 544 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2r59 h GLN 544 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 2r59 h GLN 544 CO 0.02 0.10 0.00 0.43 -0.67 0.00 0.00 178.83 178.70 2r59 n SER 545 N -4.41 1.11 -1.89 1.46 7.64 -0.38 -4.42 113.62 112.72 2r59 n SER 545 Ca -0.03 -1.67 -0.12 0.00 1.01 0.00 0.00 58.87 58.06 2r59 n SER 545 Cb 0.17 -0.08 0.03 0.00 -1.01 0.00 0.00 64.21 63.32 2r59 n SER 545 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2r59 n LYS 546 N -0.03 -3.43 -3.13 1.43 4.76 -0.37 -4.41 118.16 112.98 2r59 n LYS 546 Ca 0.14 0.43 -0.43 0.00 -2.87 0.00 0.00 58.31 55.58 2r59 n LYS 546 Cb 0.23 -4.26 -0.07 0.00 -1.84 0.00 0.00 35.03 29.09 2r59 n LYS 546 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 2r59 s TRP 547 N -3.05 3.07 0.44 2.13 -0.00 -0.54 -4.94 118.94 116.05 2r59 s TRP 547 Ca 0.24 -0.10 0.09 0.00 -0.00 0.00 0.00 56.10 56.34 2r59 s TRP 547 Cb -0.11 -3.32 0.96 0.00 -0.00 0.00 0.00 33.47 31.01 2r59 s TRP 547 CO 0.30 -0.86 2.08 0.93 -0.00 0.00 0.00 176.95 179.40 2r59 h GLU 548 N 8.87 0.41 -0.13 5.86 5.08 -1.94 -2.19 114.58 130.54 2r59 h GLU 548 Ca -0.26 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.12 2r59 h GLU 548 Cb 1.10 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2r59 h GLU 548 CO 0.89 0.27 0.10 -0.44 -1.00 0.00 0.00 179.01 178.82 2r59 h ASP 549 N 0.42 0.00 1.55 1.42 5.19 -1.97 -1.11 116.42 121.92 2r59 h ASP 549 Ca 0.11 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.52 2r59 h ASP 549 Cb -0.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.46 2r59 h ASP 549 CO -0.02 0.00 -0.04 0.00 -3.12 0.00 0.00 179.24 176.05 2r59 h ALA 550 N 1.92 0.97 -0.16 3.45 0.00 -1.77 -3.37 119.26 120.31 2r59 h ALA 550 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2r59 h ALA 550 Cb 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 2r59 h ALA 550 CO -0.00 0.00 -0.25 0.82 0.00 0.00 0.00 179.25 179.82 2r59 h ILE 551 N 0.00 0.40 0.00 0.00 2.04 -1.31 -0.00 117.51 118.64 2r59 h ILE 551 Ca 0.00 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 2r59 h ILE 551 Cb 0.80 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2r59 h ILE 551 CO 0.00 0.00 -0.23 1.55 0.00 0.00 0.00 178.15 179.47 2r59 h PRO 552 N -0.30 0.00 -0.25 2.37 0.13 -1.77 -1.10 132.00 131.08 2r59 h PRO 552 Ca 0.11 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.11 2r59 h PRO 552 Cb 0.47 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 2r59 h PRO 552 CO -0.34 0.23 -0.35 -0.07 -0.23 0.00 0.00 178.00 177.25 2r59 h LEU 553 N 0.00 0.74 -0.64 1.56 3.38 -1.67 -1.44 115.31 117.23 2r59 h LEU 553 Ca -0.00 -0.51 -0.12 0.00 0.09 0.00 0.00 57.88 57.34 2r59 h LEU 553 Cb 0.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2r59 h LEU 553 CO 0.03 1.10 -0.21 0.00 0.09 0.00 0.00 178.44 179.45 2r59 h ALA 554 N 0.66 0.83 -0.38 1.53 0.00 -0.76 -1.75 119.26 119.38 2r59 h ALA 554 Ca 0.03 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 2r59 h ALA 554 Cb 0.93 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2r59 h ALA 554 CO 0.08 0.64 -0.36 -0.07 0.00 0.00 0.00 179.25 179.55 2r59 h LEU 555 N 0.74 0.94 -0.10 0.00 3.38 -1.17 -1.10 115.31 118.00 2r59 h LEU 555 Ca 0.10 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 2r59 h LEU 555 Cb 0.74 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 2r59 h LEU 555 CO 0.06 1.20 0.04 0.50 0.09 0.00 0.00 178.44 180.32 2r59 h LYS 556 N 0.74 0.15 -0.57 1.13 3.64 -1.18 -2.05 116.57 118.43 2r59 h LYS 556 Ca 0.07 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 2r59 h LYS 556 Cb 0.93 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.70 2r59 h LYS 556 CO 0.09 0.27 0.10 1.98 -2.27 0.00 0.00 179.45 179.61 2r59 h MET 557 N 0.00 0.90 0.00 1.90 4.05 -1.25 0.60 114.93 121.13 2r59 h MET 557 Ca 0.03 -0.21 -0.05 0.00 -0.28 0.00 0.00 59.70 59.19 2r59 h MET 557 Cb 0.17 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 2r59 h MET 557 CO -0.00 0.83 -0.23 0.00 0.23 0.00 0.00 176.91 177.74 2r59 h ALA 558 N 1.25 1.52 0.00 0.39 0.00 -0.94 -3.28 119.26 118.20 2r59 h ALA 558 Ca 0.18 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 2r59 h ALA 558 Cb 0.37 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2r59 h ALA 558 CO 0.01 0.29 -1.92 0.25 0.00 0.00 0.00 179.25 177.88 2r59 n THR 559 N -4.12 0.71 0.61 0.00 -2.24 -0.79 -4.48 114.28 103.97 2r59 n THR 559 Ca -0.02 -0.54 0.13 0.00 -2.27 0.00 0.00 64.05 61.35 2r59 n THR 559 Cb 0.30 -0.39 0.43 0.00 -2.10 0.00 0.00 70.33 68.57 2r59 n THR 559 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2r59 n GLU 560 N -2.39 0.23 -4.19 -0.78 0.28 0.18 -4.80 120.64 109.17 2r59 n GLU 560 Ca -0.18 0.24 -0.11 0.00 -0.16 0.00 0.00 57.16 56.95 2r59 n GLU 560 Cb 0.81 -1.79 -0.10 0.00 1.43 0.00 0.00 31.44 31.78 2r59 n GLU 560 CO 0.00 0.00 0.00 1.14 -0.16 0.00 0.00 177.13 178.11 2r59 s GLN 561 N -3.13 1.04 -0.06 3.44 1.03 -1.24 -4.85 119.66 115.89 2r59 s GLN 561 Ca 0.10 -1.51 0.09 0.00 0.04 0.00 0.00 55.36 54.08 2r59 s GLN 561 Cb 0.12 0.12 0.14 0.00 0.03 0.00 0.00 33.01 33.42 2r59 s GLN 561 CO 0.55 -0.26 1.06 0.41 -2.54 0.00 0.00 175.29 174.52 2r59 n GLY 562 N -0.18 2.64 3.66 2.60 0.00 0.14 -4.75 105.19 109.31 2r59 n GLY 562 Ca -0.04 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2r59 n GLY 562 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2r59 s ARG 563 N -1.44 4.13 0.45 1.61 3.52 -1.22 -4.24 118.95 121.75 2r59 s ARG 563 Ca 0.16 2.31 0.12 0.00 -0.13 0.00 0.00 55.73 58.19 2r59 s ARG 563 Cb 0.14 -4.06 1.01 0.00 -1.56 0.00 0.00 34.95 30.48 2r59 s ARG 563 CO 0.01 -0.93 2.05 0.52 -0.81 0.00 0.00 175.30 176.14 2r59 h MET 564 N 10.08 0.19 -0.78 5.12 2.86 -1.20 0.07 114.93 131.27 2r59 h MET 564 Ca -0.43 -0.02 0.20 0.00 -2.06 0.00 0.00 59.70 57.39 2r59 h MET 564 Cb 1.20 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.78 2r59 h MET 564 CO 0.95 0.21 0.54 -0.22 1.06 0.00 0.00 176.91 179.45 2r59 h LYS 565 N 0.19 0.14 0.00 1.72 3.64 -1.89 -0.85 116.57 119.53 2r59 h LYS 565 Ca 0.05 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.09 2r59 h LYS 565 Cb 0.13 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 2r59 h LYS 565 CO 0.00 0.09 -2.09 1.19 -2.27 0.00 0.00 179.45 176.38 2r59 n PHE 566 N -4.38 0.00 -0.21 1.91 3.72 -0.19 -4.49 117.46 113.82 2r59 n PHE 566 Ca 0.16 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.49 2r59 n PHE 566 Cb 0.75 -0.83 0.03 0.00 -0.94 0.00 0.00 39.48 38.49 2r59 n PHE 566 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2r59 h THR 567 N -0.96 1.20 0.43 4.37 2.02 -1.05 -2.24 112.91 116.68 2r59 h THR 567 Ca -0.50 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 2r59 h THR 567 Cb 1.43 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2r59 h THR 567 CO -0.30 0.22 -0.21 0.03 0.37 0.00 0.00 175.52 175.63 2r59 h ARG 568 N 0.81 -0.56 -0.24 6.66 3.08 -1.37 -0.80 114.38 121.95 2r59 h ARG 568 Ca 0.21 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 2r59 h ARG 568 Cb 0.07 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2r59 h ARG 568 CO -0.03 -0.27 0.02 -1.35 -1.07 0.00 0.00 179.97 177.26 2r59 h PRO 569 N -0.81 0.34 -0.40 0.04 0.11 -1.75 -1.33 132.00 128.20 2r59 h PRO 569 Ca -0.06 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.95 2r59 h PRO 569 Cb 0.55 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 2r59 h PRO 569 CO 0.10 0.36 0.07 -0.07 -0.21 0.00 0.00 178.00 178.24 2r59 h LEU 570 N 0.34 0.64 -0.79 2.35 3.38 -1.35 -0.19 115.31 119.69 2r59 h LEU 570 Ca 0.08 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2r59 h LEU 570 Cb 0.20 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2r59 h LEU 570 CO 0.00 0.73 0.25 -0.26 0.09 0.00 0.00 178.44 179.25 2r59 h PHE 571 N 0.51 1.19 -0.37 1.13 0.04 -0.94 -1.05 116.94 117.45 2r59 h PHE 571 Ca 0.12 -0.11 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 2r59 h PHE 571 Cb 0.36 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 2r59 h PHE 571 CO 0.02 0.93 0.07 -0.22 -0.60 0.00 0.00 178.31 178.52 2r59 h LYS 572 N 1.12 0.61 -0.27 1.51 3.64 -1.05 -0.55 116.57 121.57 2r59 h LYS 572 Ca 0.25 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2r59 h LYS 572 Cb 0.29 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2r59 h LYS 572 CO -0.01 0.66 0.16 -0.44 -2.27 0.00 0.00 179.45 177.55 2r59 h ASP 573 N 0.45 0.33 -0.99 4.20 5.19 -0.95 -0.99 116.42 123.67 2r59 h ASP 573 Ca 0.11 -0.06 0.01 0.00 -0.62 0.00 0.00 57.03 56.48 2r59 h ASP 573 Cb 0.34 -0.08 -0.05 0.00 0.18 0.00 0.00 39.33 39.72 2r59 h ASP 573 CO 0.01 0.29 0.66 -0.07 -3.12 0.00 0.00 179.24 177.00 2r59 h LEU 574 N 0.34 1.13 -1.26 1.55 3.38 -1.06 -1.91 115.31 117.48 2r59 h LEU 574 Ca 0.10 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2r59 h LEU 574 Cb 0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 2r59 h LEU 574 CO -0.02 0.81 -0.14 0.00 0.09 0.00 0.00 178.44 179.19 2r59 h ALA 575 N 1.37 1.39 0.00 1.53 0.00 -0.92 -2.81 119.26 119.82 2r59 h ALA 575 Ca 0.37 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2r59 h ALA 575 Cb -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2r59 h ALA 575 CO -0.08 0.42 -0.21 0.00 0.00 0.00 0.00 179.25 179.37 2r59 n ALA 576 N -2.48 2.50 -2.59 0.00 0.00 -0.39 -4.56 120.51 112.99 2r59 n ALA 576 Ca -0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 2r59 n ALA 576 Cb 0.30 -1.37 -0.05 0.00 0.00 0.00 0.00 19.45 18.33 2r59 n ALA 576 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2r59 s PHE 577 N -3.12 3.13 0.29 0.00 5.36 -0.76 -4.96 117.98 117.91 2r59 s PHE 577 Ca 0.09 0.58 0.04 0.00 -0.96 0.00 0.00 56.93 56.68 2r59 s PHE 577 Cb 0.13 -3.35 0.67 0.00 -0.34 0.00 0.00 43.02 40.12 2r59 s PHE 577 CO 0.64 -0.70 1.80 0.38 -1.46 0.00 0.00 175.22 175.88 2r59 h ASP 578 N 8.42 0.85 0.14 6.13 3.04 -1.84 -1.33 116.42 131.83 2r59 h ASP 578 Ca -0.25 0.08 -0.02 0.00 -3.24 0.00 0.00 57.03 53.60 2r59 h ASP 578 Cb 1.10 -0.08 -0.00 0.00 -1.04 0.00 0.00 39.33 39.30 2r59 h ASP 578 CO 0.90 0.36 -0.10 0.11 -2.04 0.00 0.00 179.24 178.48 2r59 h LYS 579 N 0.86 0.00 -0.01 4.15 1.79 -1.93 -3.18 116.57 118.25 2r59 h LYS 579 Ca 0.55 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.02 2r59 h LYS 579 Cb 0.74 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.39 2r59 h LYS 579 CO -0.34 0.10 -0.27 -1.13 -1.08 0.00 0.00 179.45 176.73 2r59 n SER 580 N -4.14 1.19 0.01 0.86 3.41 -0.76 -4.78 113.62 109.41 2r59 n SER 580 Ca -0.03 -1.09 -0.10 0.00 -0.26 0.00 0.00 58.87 57.39 2r59 n SER 580 Cb 0.18 0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 64.63 2r59 n SER 580 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 2r59 h HIS 581 N 1.08 -0.79 -0.50 7.33 6.17 -1.00 0.34 115.15 127.78 2r59 h HIS 581 Ca 0.00 0.03 0.01 0.00 0.71 0.00 0.00 60.37 61.12 2r59 h HIS 581 Cb 0.36 0.36 -0.03 0.00 2.52 0.00 0.00 27.41 30.63 2r59 h HIS 581 CO 0.00 -0.37 0.32 -0.44 0.71 0.00 0.00 177.93 178.15 2r59 h ASP 582 N -0.38 0.54 -0.86 3.26 3.45 -1.86 -1.61 116.42 118.97 2r59 h ASP 582 Ca 0.09 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.51 2r59 h ASP 582 Cb 0.51 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.12 2r59 h ASP 582 CO -0.32 0.39 0.43 1.56 -1.57 0.00 0.00 179.24 179.73 2r59 h GLN 583 N 0.65 1.23 0.31 3.56 4.20 -1.67 -0.73 115.11 122.67 2r59 h GLN 583 Ca 0.19 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 2r59 h GLN 583 Cb -0.04 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.49 2r59 h GLN 583 CO -0.06 0.94 -0.28 0.00 -0.67 0.00 0.00 178.83 178.76 2r59 h ALA 584 N 1.24 -0.61 -0.26 3.87 0.00 0.07 0.29 119.26 123.86 2r59 h ALA 584 Ca 0.30 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2r59 h ALA 584 Cb 0.10 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2r59 h ALA 584 CO -0.04 -0.87 0.05 0.28 0.00 0.00 0.00 179.25 178.67 2r59 h VAL 585 N -0.61 0.88 -0.74 0.00 2.07 -1.23 -0.39 116.25 116.22 2r59 h VAL 585 Ca -0.02 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 2r59 h VAL 585 Cb 0.55 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 2r59 h VAL 585 CO -0.04 0.03 0.45 0.03 0.02 0.00 0.00 177.57 178.06 2r59 h ARG 586 N 0.15 1.00 -0.26 1.57 3.08 -1.06 -1.57 114.38 117.30 2r59 h ARG 586 Ca 0.12 -0.08 -0.18 0.00 0.07 0.00 0.00 59.98 59.91 2r59 h ARG 586 Cb 0.12 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 2r59 h ARG 586 CO -0.16 0.70 -0.55 1.15 -1.07 0.00 0.00 179.97 180.04 2r59 h THR 587 N 1.02 1.29 -0.02 2.04 2.02 -0.43 -1.94 112.91 116.89 2r59 h THR 587 Ca 0.27 -1.75 0.01 0.00 0.77 0.00 0.00 66.41 65.71 2r59 h THR 587 Cb -0.05 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2r59 h THR 587 CO -0.05 0.56 -0.05 0.22 0.37 0.00 0.00 175.52 176.57 2r59 h TYR 588 N 0.61 -0.12 -0.66 3.16 3.20 -0.87 -1.54 116.97 120.74 2r59 h TYR 588 Ca 0.01 0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.98 2r59 h TYR 588 Cb 1.14 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 39.39 2r59 h TYR 588 CO 0.06 -0.08 0.29 1.96 -1.64 0.00 0.00 178.16 178.76 2r59 h GLN 589 N -0.08 0.48 -0.39 1.82 1.08 -1.09 0.13 115.11 117.07 2r59 h GLN 589 Ca 0.03 -0.03 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 2r59 h GLN 589 Cb 0.11 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2r59 h GLN 589 CO -0.07 0.32 -0.25 0.93 -0.95 0.00 0.00 178.83 178.81 2r59 h GLU 590 N 0.49 0.81 0.00 1.46 5.08 -1.17 -3.26 114.58 117.99 2r59 h GLU 590 Ca 0.33 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2r59 h GLU 590 Cb 0.39 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2r59 h GLU 590 CO -0.29 0.97 -1.06 0.72 -1.00 0.00 0.00 179.01 178.35 2r59 n HIS 591 N -4.10 0.55 -0.24 4.33 8.25 -0.60 -4.57 115.22 118.85 2r59 n HIS 591 Ca -0.00 0.16 0.03 0.00 -0.26 0.00 0.00 57.72 57.65 2r59 n HIS 591 Cb 0.45 -0.68 0.12 0.00 1.12 0.00 0.00 29.99 31.01 2r59 n HIS 591 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2r59 h LYS 592 N 0.00 0.08 -0.02 -0.41 3.64 -0.80 -0.43 116.57 118.63 2r59 h LYS 592 Ca 0.00 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2r59 h LYS 592 Cb 0.86 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2r59 h LYS 592 CO 0.00 0.05 -0.01 0.00 -2.27 0.00 0.00 179.45 177.22 2r59 h ALA 593 N 1.66 1.94 -0.68 5.00 0.00 -1.81 -1.46 119.26 123.91 2r59 h ALA 593 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2r59 h ALA 593 Cb 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2r59 h ALA 593 CO -0.63 0.04 0.00 -1.13 0.00 0.00 0.00 179.25 177.53 2r59 n SER 594 N -4.51 3.81 -4.93 0.00 3.41 -0.20 -4.97 113.62 106.24 2r59 n SER 594 Ca -0.03 -2.00 -0.26 0.00 -0.26 0.00 0.00 58.87 56.32 2r59 n SER 594 Cb 0.11 -0.45 0.06 0.00 -0.26 0.00 0.00 64.21 63.67 2r59 n SER 594 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2r59 s MET 595 N -1.09 2.36 0.31 4.33 1.00 -0.55 -5.04 119.30 120.61 2r59 s MET 595 Ca 0.47 -0.18 -0.29 0.00 0.00 0.00 0.00 55.69 55.70 2r59 s MET 595 Cb 0.25 -2.18 -0.10 0.00 0.00 0.00 0.00 34.83 32.80 2r59 s MET 595 CO 0.33 -1.13 1.26 -1.58 0.00 0.00 0.00 175.02 173.89 2r59 s HIS 596 N -3.21 3.20 0.32 -0.03 5.65 -1.26 -4.85 115.29 115.11 2r59 s HIS 596 Ca 0.59 1.47 0.07 0.00 0.25 0.00 0.00 55.06 57.43 2r59 s HIS 596 Cb -0.11 -3.57 0.75 0.00 -1.18 0.00 0.00 32.58 28.47 2r59 s HIS 596 CO 0.45 -1.54 1.81 -1.00 -0.65 0.00 0.00 174.74 173.82 2r59 h PRO 597 N 3.68 0.74 0.01 2.88 0.13 -1.88 0.94 132.00 138.50 2r59 h PRO 597 Ca -0.48 -0.04 -0.19 0.00 -0.87 0.00 0.00 66.00 64.42 2r59 h PRO 597 Cb 1.22 -0.17 0.02 0.00 0.13 0.00 0.00 31.00 32.20 2r59 h PRO 597 CO 0.67 0.49 -0.74 0.28 -0.23 0.00 0.00 178.00 178.47 2r59 h VAL 598 N 0.76 1.39 -0.52 1.56 2.07 -1.91 -2.45 116.25 117.15 2r59 h VAL 598 Ca 0.53 -2.15 0.02 0.00 0.82 0.00 0.00 66.70 65.92 2r59 h VAL 598 Cb 0.82 2.57 -0.03 0.00 -1.52 0.00 0.00 31.29 33.13 2r59 h VAL 598 CO -0.30 0.64 0.32 0.74 0.02 0.00 0.00 177.57 178.99 2r59 h THR 599 N 0.02 1.07 -0.84 2.57 2.02 -1.83 -1.57 112.91 114.34 2r59 h THR 599 Ca -0.09 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 66.92 2r59 h THR 599 Cb 1.44 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 68.16 2r59 h THR 599 CO 0.15 0.12 0.53 0.00 0.37 0.00 0.00 175.52 176.68 2r59 h ALA 600 N 1.22 1.15 0.14 6.16 0.00 -0.82 -0.48 119.26 126.63 2r59 h ALA 600 Ca 0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2r59 h ALA 600 Cb -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2r59 h ALA 600 CO -0.08 0.29 -0.07 1.98 0.00 0.00 0.00 179.25 181.37 2r59 h MET 601 N 0.98 -0.18 -0.70 0.00 -1.53 -0.85 -1.68 114.93 110.97 2r59 h MET 601 Ca 0.36 0.01 -0.07 0.00 -3.44 0.00 0.00 59.70 56.56 2r59 h MET 601 Cb 0.13 0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.19 2r59 h MET 601 CO -0.16 0.11 0.16 -0.07 0.14 0.00 0.00 176.91 177.09 2r59 h LEU 602 N -0.48 1.08 -0.24 3.39 3.38 -1.15 -1.14 115.31 120.16 2r59 h LEU 602 Ca -0.02 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 2r59 h LEU 602 Cb 0.38 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2r59 h LEU 602 CO 0.03 1.04 -0.03 0.58 0.09 0.00 0.00 178.44 180.15 2r59 h VAL 603 N 1.07 1.27 -0.52 1.22 2.07 -1.08 -0.11 116.25 120.18 2r59 h VAL 603 Ca 0.22 -0.99 0.10 0.00 0.82 0.00 0.00 66.70 66.85 2r59 h VAL 603 Cb 0.39 1.44 -0.11 0.00 -1.52 0.00 0.00 31.29 31.50 2r59 h VAL 603 CO 0.01 0.31 -0.30 1.23 0.02 0.00 0.00 177.57 178.84 2r59 h GLY 604 N 0.19 -0.05 0.68 2.17 0.00 -1.20 0.08 103.07 104.93 2r59 h GLY 604 Ca 0.06 0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.81 2r59 h GLY 604 CO 0.02 -0.21 0.04 0.50 0.00 0.00 0.00 176.54 176.89 2r59 h LYS 605 N -0.17 0.14 -0.97 4.80 1.57 -1.08 -1.02 116.57 119.85 2r59 h LYS 605 Ca 0.22 -0.01 0.15 0.00 -1.87 0.00 0.00 60.65 59.14 2r59 h LYS 605 Cb 0.53 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.72 2r59 h LYS 605 CO -0.62 0.09 0.61 -0.44 -0.57 0.00 0.00 179.45 178.52 2r59 h ASP 606 N 0.14 0.78 0.39 0.86 3.32 0.02 -1.88 116.42 120.05 2r59 h ASP 606 Ca 0.12 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2r59 h ASP 606 Cb 0.13 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2r59 h ASP 606 CO -0.17 0.37 -0.38 0.18 -1.72 0.00 0.00 179.24 177.51 2r59 n LEU 607 N -4.63 0.71 -3.42 1.55 4.77 -0.08 -4.96 117.00 110.93 2r59 n LEU 607 Ca 0.20 -0.10 -0.17 0.00 -0.03 0.00 0.00 56.01 55.91 2r59 n LEU 607 Cb 0.47 -0.20 0.08 0.00 -2.33 0.00 0.00 43.42 41.44 2r59 n LEU 607 CO 0.27 0.15 0.08 0.29 -1.33 0.00 0.00 177.39 176.85 2r59 n LYS 608 N -1.14 -5.80 -4.43 3.23 5.02 -0.62 -5.04 118.16 109.37 2r59 n LYS 608 Ca 0.09 0.84 -0.21 0.00 -2.02 0.00 0.00 58.31 57.00 2r59 n LYS 608 Cb 0.34 -5.81 -0.11 0.00 -0.02 0.00 0.00 35.03 29.44 2r59 n LYS 608 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2r59 s VAL 609 N -3.39 1.28 0.00 -0.18 -7.23 -0.48 -5.04 120.40 105.36 2r59 s VAL 609 Ca 0.07 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.22 2r59 s VAL 609 Cb -0.01 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.26 2r59 s VAL 609 CO 0.74 -0.11 0.00 0.47 -0.31 0.00 0.00 175.10 175.89