#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i5t h VAL 11 N 0.00 1.28 -0.72 0.00 2.07 -2.04 -2.31 116.25 114.53 3i5t h VAL 11 Ca 0.00 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 3i5t h VAL 11 Cb 0.00 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3i5t h VAL 11 CO 0.00 0.44 0.35 1.23 0.02 0.00 0.00 177.57 179.61 3i5t h GLY 12 N 0.68 1.09 1.77 2.17 0.00 -1.99 -1.42 103.07 105.37 3i5t h GLY 12 Ca 0.10 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.80 3i5t h GLY 12 CO 0.05 0.49 -0.46 0.00 0.00 0.00 0.00 176.54 176.63 3i5t h ALA 13 N 1.37 1.04 -0.23 3.60 0.00 -1.95 -1.96 119.26 121.14 3i5t h ALA 13 Ca 0.25 -0.44 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 3i5t h ALA 13 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3i5t h ALA 13 CO -0.03 0.62 -0.51 0.00 0.00 0.00 0.00 179.25 179.33 3i5t h ALA 14 N 1.33 0.37 -0.34 0.00 0.00 -1.08 -2.52 119.26 117.02 3i5t h ALA 14 Ca 0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 3i5t h ALA 14 Cb 0.89 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3i5t h ALA 14 CO 0.07 0.55 0.20 0.52 0.00 0.00 0.00 179.25 180.59 3i5t h MET 15 N 0.47 0.46 -0.48 0.00 0.00 -1.21 -1.42 114.93 112.76 3i5t h MET 15 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 59.70 59.68 3i5t h MET 15 Cb 1.12 -0.10 -0.03 0.00 0.00 0.00 0.00 31.60 32.59 3i5t h MET 15 CO 0.11 0.35 0.28 -0.09 0.00 0.00 0.00 176.91 177.55 3i5t h ARG 16 N 0.44 0.54 0.00 1.72 2.43 -1.38 -1.75 114.38 116.38 3i5t h ARG 16 Ca 0.12 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 3i5t h ARG 16 Cb 0.01 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3i5t h ARG 16 CO -0.02 0.36 -1.33 -0.25 -1.51 0.00 0.00 179.97 177.21 3i5t n ASP 17 N -4.83 0.64 0.00 -3.80 10.43 -0.95 -3.80 116.55 114.24 3i5t n ASP 17 Ca 0.03 0.25 0.00 0.00 2.57 0.00 0.00 54.79 57.64 3i5t n ASP 17 Cb 0.08 0.77 0.00 0.00 1.84 0.00 0.00 41.12 43.80 3i5t n ASP 17 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 3i5t n HIS 18 N -2.62 0.00 -4.71 1.24 8.25 -0.54 -5.04 115.22 111.80 3i5t n HIS 18 Ca -0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.10 3i5t n HIS 18 Cb 0.62 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.59 3i5t n HIS 18 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3i5t s ILE 19 N -0.31 3.29 -0.29 1.59 1.01 -0.66 -5.02 121.20 120.81 3i5t s ILE 19 Ca 0.00 -0.60 -0.17 0.00 0.00 0.00 0.00 60.65 59.88 3i5t s ILE 19 Cb 0.00 -2.37 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 3i5t s ILE 19 CO 0.00 0.54 0.48 -0.22 0.00 0.00 0.00 174.94 175.74 3i5t s LEU 20 N -0.03 4.14 0.30 2.97 2.96 -1.26 -4.81 118.68 122.95 3i5t s LEU 20 Ca -0.02 0.29 -0.14 0.00 -0.22 0.00 0.00 54.13 54.04 3i5t s LEU 20 Cb -0.14 -2.58 -0.09 0.00 0.50 0.00 0.00 46.19 43.89 3i5t s LEU 20 CO 0.04 -0.33 0.69 -0.76 -1.32 0.00 0.00 176.35 174.67 3i5t s LEU 21 N 2.28 4.10 0.33 -0.68 1.43 -1.26 -5.05 118.68 119.84 3i5t s LEU 21 Ca 0.19 1.20 -0.29 0.00 -1.03 0.00 0.00 54.13 54.20 3i5t s LEU 21 Cb -0.16 -3.97 -0.11 0.00 0.03 0.00 0.00 46.19 41.99 3i5t s LEU 21 CO 0.11 -0.16 1.56 -2.84 0.23 0.00 0.00 176.35 175.24 3i5t s PRO 22 N -2.91 4.10 -1.46 1.29 0.02 -1.26 -2.84 135.00 131.95 3i5t s PRO 22 Ca 0.52 2.61 -0.08 0.00 0.02 0.00 0.00 61.00 64.07 3i5t s PRO 22 Cb -0.11 -2.99 0.03 0.00 0.02 0.00 0.00 34.50 31.46 3i5t s PRO 22 CO 0.18 -0.61 0.74 0.00 -0.33 0.00 0.00 177.00 176.98 3i5t n ALA 23 N 1.40 -1.10 -2.10 -1.55 0.00 -1.26 -4.95 120.51 110.95 3i5t n ALA 23 Ca 0.05 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 3i5t n ALA 23 Cb 0.38 -4.01 -0.03 0.00 0.00 0.00 0.00 19.45 15.79 3i5t n ALA 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3i5t s GLN 24 N -6.02 4.22 -0.32 0.00 2.00 -1.13 -4.94 119.66 113.47 3i5t s GLN 24 Ca 0.43 2.09 -0.28 0.00 -2.00 0.00 0.00 55.36 55.60 3i5t s GLN 24 Cb -0.20 -3.76 -0.02 0.00 0.80 0.00 0.00 33.01 29.82 3i5t s GLN 24 CO 0.53 -0.73 1.89 -2.00 -0.50 0.00 0.00 175.29 174.48 3i5t s GLU 25 N 3.22 3.27 0.56 1.67 2.12 -1.26 -4.86 118.70 123.41 3i5t s GLU 25 Ca 0.69 1.53 0.34 0.00 0.36 0.00 0.00 54.97 57.88 3i5t s GLU 25 Cb -0.33 -4.24 1.60 0.00 0.26 0.00 0.00 34.13 31.42 3i5t s GLU 25 CO 0.28 -1.94 2.08 0.52 -0.54 0.00 0.00 175.26 175.66 3i5t h MET 26 N 13.41 0.00 0.00 4.30 2.86 -1.99 -1.35 114.93 132.16 3i5t h MET 26 Ca -0.35 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.26 3i5t h MET 26 Cb 1.18 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 3i5t h MET 26 CO 1.02 0.05 -0.17 0.00 1.06 0.00 0.00 176.91 178.87 3i5t h ALA 27 N 1.95 1.09 -0.21 6.32 0.00 -2.04 -3.01 119.26 123.37 3i5t h ALA 27 Ca -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3i5t h ALA 27 Cb 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3i5t h ALA 27 CO 0.01 0.21 -0.02 1.63 0.00 0.00 0.00 179.25 181.08 3i5t n LYS 28 N -3.43 2.35 -1.75 0.00 5.02 -0.52 -5.00 118.16 114.82 3i5t n LYS 28 Ca -0.01 -2.86 -0.42 0.00 -2.02 0.00 0.00 58.31 53.01 3i5t n LYS 28 Cb 0.35 -1.76 -0.03 0.00 -0.02 0.00 0.00 35.03 33.57 3i5t n LYS 28 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3i5t s LEU 29 N -2.93 4.40 0.00 -0.35 2.96 -1.14 -1.68 118.68 119.95 3i5t s LEU 29 Ca 0.40 2.66 0.00 0.00 -0.22 0.00 0.00 54.13 56.97 3i5t s LEU 29 Cb 0.34 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.48 3i5t s LEU 29 CO 0.06 -1.00 0.00 0.61 -1.32 0.00 0.00 176.35 174.70 3i5t n GLY 30 N 4.30 0.58 0.00 7.98 0.00 -1.25 -4.83 105.19 111.97 3i5t n GLY 30 Ca 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3i5t n GLY 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i5t n LYS 31 N -2.80 2.69 -2.03 1.61 5.02 -0.68 -4.86 118.16 117.11 3i5t n LYS 31 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 3i5t n LYS 31 Cb 0.00 -0.21 -0.02 0.00 -0.02 0.00 0.00 35.03 34.78 3i5t n LYS 31 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3i5t s SER 32 N -0.39 6.66 -0.07 4.39 0.01 -0.91 -5.03 113.70 118.36 3i5t s SER 32 Ca 0.00 2.76 0.04 0.00 1.31 0.00 0.00 55.95 60.06 3i5t s SER 32 Cb 0.00 -2.65 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 3i5t s SER 32 CO 0.00 -0.63 -0.18 0.00 0.41 0.00 0.00 173.24 172.83 3i5t s ALA 33 N -0.95 2.45 0.02 1.44 0.00 -1.26 -4.66 121.76 118.80 3i5t s ALA 33 Ca 0.51 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.53 3i5t s ALA 33 Cb -0.41 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.80 3i5t s ALA 33 CO 0.53 0.44 -0.14 -0.65 0.00 0.00 0.00 175.76 175.95 3i5t s GLN 34 N -0.31 1.01 0.29 0.00 -0.21 -1.26 -5.12 119.66 114.05 3i5t s GLN 34 Ca 0.02 -0.65 -0.30 0.00 0.02 0.00 0.00 55.36 54.45 3i5t s GLN 34 Cb -0.13 -1.00 -0.13 0.00 1.00 0.00 0.00 33.01 32.76 3i5t s GLN 34 CO 0.02 0.26 1.42 -2.30 -2.12 0.00 0.00 175.29 172.57 3i5t n PRO 35 N 2.25 2.25 -3.30 2.91 -0.02 -1.26 -4.97 135.00 132.86 3i5t n PRO 35 Ca -0.16 0.80 -0.41 0.00 -2.02 0.00 0.00 63.50 61.70 3i5t n PRO 35 Cb 0.55 -2.46 -0.08 0.00 -0.02 0.00 0.00 33.50 31.48 3i5t n PRO 35 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3i5t s VAL 36 N -0.43 5.07 0.13 -1.45 1.01 -1.26 -5.05 120.40 118.42 3i5t s VAL 36 Ca 0.62 0.15 -0.23 0.00 0.00 0.00 0.00 61.98 62.52 3i5t s VAL 36 Cb -0.58 -3.93 -0.07 0.00 0.00 0.00 0.00 36.38 31.79 3i5t s VAL 36 CO 0.54 -0.21 0.71 -0.76 0.00 0.00 0.00 175.10 175.37 3i5t s LEU 37 N 2.25 4.56 -0.05 3.92 1.02 -1.26 -1.05 118.68 128.07 3i5t s LEU 37 Ca 0.16 1.51 -0.04 0.00 0.02 0.00 0.00 54.13 55.78 3i5t s LEU 37 Cb -0.16 -3.16 -0.03 0.00 0.02 0.00 0.00 46.19 42.87 3i5t s LEU 37 CO 0.13 0.22 -0.09 0.35 0.02 0.00 0.00 176.35 176.98 3i5t n THR 38 N 1.71 0.51 -4.08 5.49 -2.24 -0.35 -4.90 114.28 110.43 3i5t n THR 38 Ca -0.07 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 3i5t n THR 38 Cb 0.49 -1.62 -0.07 0.00 -2.10 0.00 0.00 70.33 67.04 3i5t n THR 38 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3i5t s HIS 39 N -2.14 0.70 -0.07 4.78 -3.43 -1.25 -5.01 115.29 108.86 3i5t s HIS 39 Ca -0.09 -1.00 -0.24 0.00 -0.80 0.00 0.00 55.06 52.93 3i5t s HIS 39 Cb 0.03 -0.09 0.05 0.00 -1.43 0.00 0.00 32.58 31.15 3i5t s HIS 39 CO 0.12 -0.89 0.55 0.00 -2.00 0.00 0.00 174.74 172.52 3i5t s ALA 40 N -3.98 -1.40 -0.26 -1.38 0.00 -1.26 -0.44 121.76 113.05 3i5t s ALA 40 Ca 0.29 1.08 -0.21 0.00 0.00 0.00 0.00 51.96 53.12 3i5t s ALA 40 Cb 0.02 -0.17 0.07 0.00 0.00 0.00 0.00 23.12 23.03 3i5t s ALA 40 CO 0.11 -0.32 0.67 -1.83 0.00 0.00 0.00 175.76 174.39 3i5t s GLU 41 N -0.92 0.76 7.84 0.00 1.03 -0.49 -4.49 118.70 122.43 3i5t s GLU 41 Ca -0.10 0.99 0.00 0.00 0.03 0.00 0.00 54.97 55.90 3i5t s GLU 41 Cb -0.02 0.32 0.00 0.00 -0.80 0.00 0.00 34.13 33.63 3i5t s GLU 41 CO 0.06 -0.11 0.00 0.41 -1.33 0.00 0.00 175.26 174.30 3i5t n GLY 42 N 3.09 3.56 0.86 -3.83 0.00 -0.08 -1.50 105.19 107.29 3i5t n GLY 42 Ca -0.15 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 45.91 3i5t n GLY 42 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3i5t n ILE 43 N 0.00 0.30 -4.16 -0.61 -5.35 -1.26 -0.45 119.36 107.83 3i5t n ILE 43 Ca 0.00 -0.53 -0.33 0.00 -0.27 0.00 0.00 62.75 61.62 3i5t n ILE 43 Cb 0.00 0.77 -0.08 0.00 -1.74 0.00 0.00 39.64 38.59 3i5t n ILE 43 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3i5t s TYR 44 N -1.70 3.22 0.26 4.28 1.51 -0.56 -0.07 117.35 124.29 3i5t s TYR 44 Ca 0.35 0.17 0.06 0.00 -1.01 0.00 0.00 57.07 56.64 3i5t s TYR 44 Cb 0.20 -1.72 -0.06 0.00 -0.11 0.00 0.00 41.96 40.27 3i5t s TYR 44 CO 0.29 0.52 -0.04 0.14 -1.11 0.00 0.00 175.55 175.36 3i5t s VAL 45 N -1.15 1.43 -0.00 0.71 -7.23 -0.05 -1.39 120.40 112.72 3i5t s VAL 45 Ca 0.21 -2.09 0.04 0.00 -1.81 0.00 0.00 61.98 58.33 3i5t s VAL 45 Cb -0.12 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 3i5t s VAL 45 CO 0.12 -0.33 -0.12 -1.00 -0.31 0.00 0.00 175.10 173.46 3i5t s HIS 46 N -3.16 1.09 0.76 2.82 3.76 0.42 -0.69 115.29 120.29 3i5t s HIS 46 Ca 0.29 -0.22 -0.09 0.00 -0.15 0.00 0.00 55.06 54.88 3i5t s HIS 46 Cb 0.04 -0.69 0.08 0.00 1.11 0.00 0.00 32.58 33.12 3i5t s HIS 46 CO 0.10 -0.01 1.09 0.95 -0.85 0.00 0.00 174.74 176.02 3i5t s THR 47 N -0.36 2.16 -0.94 1.30 -4.23 -0.72 -1.21 115.64 111.65 3i5t s THR 47 Ca 0.04 -0.18 0.15 0.00 -1.18 0.00 0.00 61.69 60.52 3i5t s THR 47 Cb -0.05 -2.98 0.13 0.00 1.34 0.00 0.00 72.50 70.94 3i5t s THR 47 CO -0.00 0.00 1.47 -1.84 -0.54 0.00 0.00 174.62 173.71 3i5t n GLU 48 N -3.11 0.02 0.18 3.99 0.28 -0.21 -0.66 120.64 121.13 3i5t n GLU 48 Ca 0.09 0.28 0.13 0.00 -0.16 0.00 0.00 57.16 57.50 3i5t n GLU 48 Cb 0.61 -1.54 0.33 0.00 1.43 0.00 0.00 31.44 32.26 3i5t n GLU 48 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 3i5t h ASP 49 N 0.00 0.00 0.00 -1.84 3.32 -1.93 -3.48 116.42 112.50 3i5t h ASP 49 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3i5t h ASP 49 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3i5t h ASP 49 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 3i5t n GLY 50 N 0.97 3.07 3.62 2.75 0.00 0.16 -5.05 105.19 110.72 3i5t n GLY 50 Ca 0.04 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.57 3i5t n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i5t n ARG 51 N -1.95 1.58 -3.22 1.61 1.74 -1.26 -4.60 116.66 110.55 3i5t n ARG 51 Ca 0.00 0.57 -0.39 0.00 -0.77 0.00 0.00 57.85 57.26 3i5t n ARG 51 Cb 0.00 -2.24 -0.06 0.00 -1.02 0.00 0.00 32.46 29.15 3i5t n ARG 51 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3i5t s ARG 52 N 0.41 4.33 0.06 5.56 3.52 -1.26 -1.75 118.95 129.82 3i5t s ARG 52 Ca 0.79 0.66 0.06 0.00 -0.13 0.00 0.00 55.73 57.11 3i5t s ARG 52 Cb -0.82 -3.38 -0.03 0.00 -1.56 0.00 0.00 34.95 29.17 3i5t s ARG 52 CO 0.45 0.27 -0.15 -0.51 -0.81 0.00 0.00 175.30 174.54 3i5t s LEU 53 N 0.18 2.22 -0.08 -0.88 1.02 0.14 -4.77 118.68 116.51 3i5t s LEU 53 Ca 0.30 -0.54 -0.30 0.00 0.02 0.00 0.00 54.13 53.61 3i5t s LEU 53 Cb -0.17 -0.64 -0.03 0.00 0.02 0.00 0.00 46.19 45.38 3i5t s LEU 53 CO 0.15 0.01 1.18 -0.63 0.02 0.00 0.00 176.35 177.08 3i5t s ILE 54 N -1.03 4.34 -1.33 -0.59 1.01 -0.60 -0.87 121.20 122.14 3i5t s ILE 54 Ca 0.01 1.65 -0.17 0.00 0.00 0.00 0.00 60.65 62.15 3i5t s ILE 54 Cb -0.09 -4.06 0.07 0.00 0.01 0.00 0.00 42.46 38.39 3i5t s ILE 54 CO 0.02 -0.03 1.84 -0.67 0.00 0.00 0.00 174.94 176.10 3i5t n ASP 55 N 5.43 4.71 -0.28 3.58 2.03 0.90 -1.57 116.55 131.36 3i5t n ASP 55 Ca 0.11 -2.91 0.07 0.00 0.52 0.00 0.00 54.79 52.59 3i5t n ASP 55 Cb 0.46 -1.72 0.22 0.00 -0.72 0.00 0.00 41.12 39.36 3i5t n ASP 55 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 3i5t h GLY 56 N 11.87 1.27 -0.04 0.27 0.00 -1.76 -1.52 103.07 113.16 3i5t h GLY 56 Ca 0.47 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.62 3i5t h GLY 56 CO 1.55 -0.11 0.00 -1.05 0.00 0.00 0.00 176.54 176.93 3i5t n PRO 57 N -4.97 1.16 -3.89 4.80 -0.02 -1.25 -0.48 135.00 130.35 3i5t n PRO 57 Ca 0.16 -0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.06 3i5t n PRO 57 Cb 0.46 -1.16 0.01 0.00 -0.02 0.00 0.00 33.50 32.79 3i5t n PRO 57 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i5t n ALA 58 N -0.40 -2.38 -0.14 3.55 0.00 -0.57 -0.22 120.51 120.34 3i5t n ALA 58 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.17 3i5t n ALA 58 Cb 0.08 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 16.69 3i5t n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i5t n GLY 59 N -1.92 2.03 2.50 0.00 0.00 -1.26 -1.79 105.19 104.75 3i5t n GLY 59 Ca -0.17 0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 3i5t n GLY 59 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3i5t n MET 60 N 0.00 0.48 -4.00 1.61 1.56 -1.23 -4.93 117.12 110.61 3i5t n MET 60 Ca 0.00 -2.67 -0.30 0.00 -0.27 0.00 0.00 57.70 54.47 3i5t n MET 60 Cb 0.00 -1.49 -0.08 0.00 2.15 0.00 0.00 33.22 33.81 3i5t n MET 60 CO 0.00 0.00 0.00 -2.67 -0.73 0.00 0.00 175.97 172.57 3i5t n TRP 61 N 2.36 -1.00 0.00 1.12 2.14 0.69 -4.82 117.44 117.94 3i5t n TRP 61 Ca 0.22 0.53 0.00 0.00 2.07 0.00 0.00 57.50 60.31 3i5t n TRP 61 Cb 0.54 -1.97 0.00 0.00 -0.81 0.00 0.00 31.31 29.06 3i5t n TRP 61 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3i5t n ALA 63 N -1.84 5.50 -0.24 0.00 0.00 -0.74 -3.39 120.51 119.79 3i5t n ALA 63 Ca 0.00 -3.22 -0.01 0.00 0.00 0.00 0.00 53.44 50.21 3i5t n ALA 63 Cb 0.26 -3.39 0.11 0.00 0.00 0.00 0.00 19.45 16.44 3i5t n ALA 63 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3i5t h GLN 64 N 6.16 0.70 -0.35 0.00 1.08 -1.89 -1.83 115.11 118.98 3i5t h GLN 64 Ca 0.61 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.77 3i5t h GLN 64 Cb 0.43 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3i5t h GLN 64 CO 1.77 0.46 0.00 1.33 -0.95 0.00 0.00 178.83 181.44 3i5t n VAL 65 N -4.77 0.45 -4.04 -0.54 0.24 -1.26 0.56 118.33 108.97 3i5t n VAL 65 Ca 0.09 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 3i5t n VAL 65 Cb 0.18 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 3i5t n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3i5t n GLY 66 N 1.33 -1.98 3.84 7.63 0.00 -0.69 -4.88 105.19 110.44 3i5t n GLY 66 Ca 0.18 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 3i5t n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i5t s TYR 67 N 0.00 3.35 0.00 1.61 2.02 0.40 -4.63 117.35 120.10 3i5t s TYR 67 Ca 0.00 0.18 0.00 0.00 -0.37 0.00 0.00 57.07 56.88 3i5t s TYR 67 Cb 0.00 -1.70 0.00 0.00 -0.40 0.00 0.00 41.96 39.86 3i5t s TYR 67 CO 0.00 0.56 0.00 0.41 -1.57 0.00 0.00 175.55 174.95 3i5t n GLY 68 N 0.52 0.86 3.51 0.71 0.00 -1.26 -0.90 105.19 108.64 3i5t n GLY 68 Ca -0.08 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 3i5t n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i5t s ARG 69 N -0.81 3.32 0.50 1.61 1.81 -1.26 -4.91 118.95 119.20 3i5t s ARG 69 Ca 0.00 -0.32 0.14 0.00 -1.72 0.00 0.00 55.73 53.84 3i5t s ARG 69 Cb 0.00 -4.05 1.18 0.00 -0.45 0.00 0.00 34.95 31.62 3i5t s ARG 69 CO 0.00 -1.45 2.13 0.00 -0.68 0.00 0.00 175.30 175.30 3i5t h ARG 70 N 9.27 0.12 -0.76 3.54 2.47 -1.99 -2.87 114.38 124.16 3i5t h ARG 70 Ca -0.26 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.53 3i5t h ARG 70 Cb 1.08 -0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 29.31 3i5t h ARG 70 CO 1.07 0.08 0.43 0.93 0.56 0.00 0.00 179.97 183.05 3i5t h GLU 71 N 0.12 0.74 -0.05 0.04 3.07 -1.97 0.73 114.58 117.26 3i5t h GLU 71 Ca 0.03 -0.04 -0.13 0.00 -0.50 0.00 0.00 59.36 58.72 3i5t h GLU 71 Cb -0.01 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 27.74 3i5t h GLU 71 CO -0.01 0.49 -0.48 0.82 -1.40 0.00 0.00 179.01 178.43 3i5t h ILE 72 N 0.76 1.42 -0.08 3.13 2.04 -1.82 -2.95 117.51 120.01 3i5t h ILE 72 Ca 0.35 -1.91 -0.00 0.00 1.00 0.00 0.00 64.86 64.30 3i5t h ILE 72 Cb 0.26 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 38.76 3i5t h ILE 72 CO -0.21 0.56 0.04 0.58 0.00 0.00 0.00 178.15 179.12 3i5t h VAL 73 N -0.08 1.08 -0.87 1.67 2.07 -1.40 -1.15 116.25 117.58 3i5t h VAL 73 Ca -0.05 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 67.30 3i5t h VAL 73 Cb 1.16 1.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.96 3i5t h VAL 73 CO 0.10 0.07 0.55 0.44 0.02 0.00 0.00 177.57 178.75 3i5t h ASP 74 N 0.04 0.88 0.30 0.57 3.45 0.36 0.17 116.42 122.20 3i5t h ASP 74 Ca 0.03 0.01 -0.14 0.00 0.43 0.00 0.00 57.03 57.36 3i5t h ASP 74 Cb 0.08 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 3i5t h ASP 74 CO -0.00 0.57 -0.54 0.00 -1.57 0.00 0.00 179.24 177.69 3i5t h ALA 75 N 1.40 0.91 0.60 3.45 0.00 -1.37 -0.96 119.26 123.28 3i5t h ALA 75 Ca 0.37 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3i5t h ALA 75 Cb 0.13 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.84 3i5t h ALA 75 CO -0.16 0.69 -0.29 0.52 0.00 0.00 0.00 179.25 180.01 3i5t h MET 76 N 0.20 -0.77 -0.80 0.00 2.86 -0.58 -2.87 114.93 112.97 3i5t h MET 76 Ca 0.00 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3i5t h MET 76 Cb 1.02 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.82 3i5t h MET 76 CO 0.09 -0.48 0.50 0.00 1.06 0.00 0.00 176.91 178.08 3i5t h ALA 77 N -0.53 1.02 -0.46 6.32 0.00 -0.94 -0.83 119.26 123.85 3i5t h ALA 77 Ca -0.08 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3i5t h ALA 77 Cb 0.64 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3i5t h ALA 77 CO 0.13 0.46 0.10 1.25 0.00 0.00 0.00 179.25 181.19 3i5t h HIS 78 N 1.09 0.78 -0.32 0.00 6.17 -1.25 -1.66 115.15 119.97 3i5t h HIS 78 Ca 0.29 -0.10 -0.17 0.00 0.71 0.00 0.00 60.37 61.10 3i5t h HIS 78 Cb -0.08 -0.22 -0.00 0.00 2.52 0.00 0.00 27.41 29.63 3i5t h HIS 78 CO -0.01 0.72 -0.48 0.37 0.71 0.00 0.00 177.93 179.24 3i5t h GLN 79 N 0.61 0.87 -0.96 5.26 5.75 -1.39 -1.17 115.11 124.08 3i5t h GLN 79 Ca 0.14 -0.51 0.09 0.00 -0.15 0.00 0.00 58.65 58.22 3i5t h GLN 79 Cb 0.35 0.04 -0.07 0.00 1.07 0.00 0.00 27.48 28.87 3i5t h GLN 79 CO 0.00 1.15 0.62 0.00 -2.65 0.00 0.00 178.83 177.95 3i5t h ALA 80 N 0.76 1.51 -0.04 3.38 0.00 -1.03 -0.36 119.26 123.47 3i5t h ALA 80 Ca 0.03 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3i5t h ALA 80 Cb 1.08 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.62 3i5t h ALA 80 CO 0.11 0.32 -0.42 0.52 0.00 0.00 0.00 179.25 179.77 3i5t h MET 81 N 1.04 0.37 0.01 0.00 2.86 -1.13 -3.29 114.93 114.79 3i5t h MET 81 Ca 0.44 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3i5t h MET 81 Cb 0.30 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.04 3i5t h MET 81 CO -0.19 0.99 -0.00 0.28 1.06 0.00 0.00 176.91 179.05 3i5t h VAL 82 N -0.14 1.34 -0.72 -2.22 2.07 -1.01 -3.44 116.25 112.13 3i5t h VAL 82 Ca -0.04 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 3i5t h VAL 82 Cb 1.11 2.05 -0.18 0.00 -1.52 0.00 0.00 31.29 32.75 3i5t h VAL 82 CO 0.09 0.27 -0.33 -0.22 0.02 0.00 0.00 177.57 177.39 3i5t s LEU 83 N -9.30 -1.11 0.27 2.57 2.96 -0.16 -5.05 118.68 108.86 3i5t s LEU 83 Ca -0.16 -0.63 0.14 0.00 -0.22 0.00 0.00 54.13 53.26 3i5t s LEU 83 Cb 0.02 1.42 0.26 0.00 0.50 0.00 0.00 46.19 48.39 3i5t s LEU 83 CO 0.67 -0.11 1.53 1.55 -1.32 0.00 0.00 176.35 178.67 3i5t h PRO 84 N 6.27 0.00 -3.55 0.98 0.13 -1.61 -3.43 132.00 130.79 3i5t h PRO 84 Ca 0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.93 3i5t h PRO 84 Cb 1.19 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.04 3i5t h PRO 84 CO 0.03 0.60 -0.65 -0.47 -0.23 0.00 0.00 178.00 177.28 3i5t s TYR 85 N -3.24 -0.07 -0.03 1.56 5.04 -1.26 -4.17 117.35 115.18 3i5t s TYR 85 Ca 0.01 0.18 -0.03 0.00 -2.44 0.00 0.00 57.07 54.80 3i5t s TYR 85 Cb 0.10 -0.01 0.01 0.00 0.35 0.00 0.00 41.96 42.41 3i5t s TYR 85 CO 0.75 -0.05 0.08 0.00 -1.34 0.00 0.00 175.55 174.99 3i5t s ALA 86 N 0.21 -0.20 -0.05 3.97 0.00 -1.26 -5.03 121.76 119.40 3i5t s ALA 86 Ca -0.01 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 3i5t s ALA 86 Cb -0.02 -0.12 -0.06 0.00 0.00 0.00 0.00 23.12 22.92 3i5t s ALA 86 CO -0.01 -0.05 1.64 0.45 0.00 0.00 0.00 175.76 177.80 3i5t s SER 87 N -0.03 6.68 0.05 0.00 0.15 -1.26 -4.86 113.70 114.42 3i5t s SER 87 Ca -0.01 2.24 0.20 0.00 0.70 0.00 0.00 55.95 59.08 3i5t s SER 87 Cb -0.01 -2.54 0.82 0.00 -1.71 0.00 0.00 66.02 62.58 3i5t s SER 87 CO 0.00 -0.91 1.62 -0.81 1.20 0.00 0.00 173.24 174.34 3i5t n PRO 88 N 6.96 0.04 0.09 5.44 -0.04 -1.26 0.19 135.00 146.42 3i5t n PRO 88 Ca 0.17 0.22 -0.07 0.00 -0.04 0.00 0.00 63.50 63.78 3i5t n PRO 88 Cb 0.43 -1.57 0.04 0.00 -0.04 0.00 0.00 33.50 32.36 3i5t n PRO 88 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3i5t h TRP 89 N 0.00 0.27 0.00 0.54 6.55 -1.94 -3.41 115.95 117.96 3i5t h TRP 89 Ca 0.00 -0.13 0.00 0.00 0.95 0.00 0.00 58.89 59.71 3i5t h TRP 89 Cb 0.35 -0.04 0.00 0.00 -0.86 0.00 0.00 29.16 28.61 3i5t h TRP 89 CO 0.00 0.89 -0.80 0.66 -1.05 0.00 0.00 178.44 178.14 3i5t n TYR 90 N -3.73 0.00 -5.22 0.49 4.02 -0.97 -5.08 117.16 106.68 3i5t n TYR 90 Ca -0.03 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.54 3i5t n TYR 90 Cb 0.74 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.89 3i5t n TYR 90 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 3i5t s MET 91 N -1.80 2.84 0.18 -0.72 -1.94 0.13 -5.06 119.30 112.92 3i5t s MET 91 Ca 0.00 -0.88 -0.08 0.00 -1.71 0.00 0.00 55.69 53.02 3i5t s MET 91 Cb 0.00 -2.26 -0.06 0.00 2.01 0.00 0.00 34.83 34.52 3i5t s MET 91 CO 0.00 0.28 0.48 0.00 -0.01 0.00 0.00 175.02 175.76 3i5t s ALA 92 N 0.11 3.66 0.12 3.03 0.00 -1.26 -4.27 121.76 123.14 3i5t s ALA 92 Ca -0.11 -0.36 0.06 0.00 0.00 0.00 0.00 51.96 51.54 3i5t s ALA 92 Cb -0.16 -2.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 3i5t s ALA 92 CO 0.06 0.56 -0.13 0.95 0.00 0.00 0.00 175.76 177.20 3i5t s THR 93 N -1.69 1.29 0.12 0.00 -4.23 -1.26 -5.07 115.64 104.79 3i5t s THR 93 Ca 0.43 -1.75 -0.20 0.00 -1.18 0.00 0.00 61.69 58.99 3i5t s THR 93 Cb -0.12 -1.55 -0.08 0.00 1.34 0.00 0.00 72.50 72.09 3i5t s THR 93 CO 0.22 -0.46 1.76 -1.28 -0.54 0.00 0.00 174.62 174.31 3i5t h SER 94 N 3.43 0.13 -0.59 3.99 0.87 -1.99 -2.77 113.55 116.62 3i5t h SER 94 Ca -0.39 0.01 0.12 0.00 -1.23 0.00 0.00 61.79 60.29 3i5t h SER 94 Cb 1.20 -0.02 -0.09 0.00 -0.44 0.00 0.00 62.40 63.04 3i5t h SER 94 CO 0.52 0.10 0.04 -0.65 -0.53 0.00 0.00 176.83 176.31 3i5t h PRO 95 N 0.18 0.15 -0.25 2.24 0.11 -1.94 0.71 132.00 133.21 3i5t h PRO 95 Ca 0.07 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3i5t h PRO 95 Cb 0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 3i5t h PRO 95 CO -0.04 0.10 0.09 0.00 -0.21 0.00 0.00 178.00 177.94 3i5t h ALA 96 N 1.52 0.33 -0.31 -0.75 0.00 -1.83 -1.04 119.26 117.17 3i5t h ALA 96 Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3i5t h ALA 96 Cb 0.48 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3i5t h ALA 96 CO -0.47 -0.06 0.20 0.00 0.00 0.00 0.00 179.25 178.92 3i5t h ALA 97 N 0.92 0.39 -0.02 0.00 0.00 -1.17 -1.74 119.26 117.63 3i5t h ALA 97 Ca 0.08 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 3i5t h ALA 97 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3i5t h ALA 97 CO -0.00 -0.13 -0.76 0.00 0.00 0.00 0.00 179.25 178.36 3i5t h ARG 98 N 0.41 0.17 -0.31 0.00 2.47 -0.84 -2.13 114.38 114.14 3i5t h ARG 98 Ca 0.11 -0.16 -0.09 0.00 -1.26 0.00 0.00 59.98 58.59 3i5t h ARG 98 Cb -0.02 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 3i5t h ARG 98 CO -0.02 0.85 -0.15 1.25 0.56 0.00 0.00 179.97 182.45 3i5t h LEU 99 N 0.11 0.68 -0.68 3.04 5.85 -1.09 -0.92 115.31 122.30 3i5t h LEU 99 Ca -0.02 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.25 3i5t h LEU 99 Cb 1.33 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 3i5t h LEU 99 CO 0.11 0.94 0.27 0.00 -0.34 0.00 0.00 178.44 179.42 3i5t h ALA 100 N 0.76 0.89 -0.57 1.25 0.00 -1.33 -1.00 119.26 119.26 3i5t h ALA 100 Ca 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3i5t h ALA 100 Cb 0.68 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3i5t h ALA 100 CO 0.05 0.50 0.37 1.49 0.00 0.00 0.00 179.25 181.66 3i5t h GLU 101 N 0.97 0.72 -0.24 0.00 4.81 -1.31 -1.71 114.58 117.82 3i5t h GLU 101 Ca 0.23 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 3i5t h GLU 101 Cb 0.21 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3i5t h GLU 101 CO -0.02 0.48 0.08 -0.22 -0.73 0.00 0.00 179.01 178.60 3i5t h LYS 102 N 0.74 0.37 -0.51 1.92 1.63 -0.87 -3.14 116.57 116.71 3i5t h LYS 102 Ca 0.21 -0.08 -0.11 0.00 -0.85 0.00 0.00 60.65 59.83 3i5t h LYS 102 Cb -0.05 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.50 3i5t h LYS 102 CO -0.06 0.44 -0.11 0.82 -3.45 0.00 0.00 179.45 177.10 3i5t h ILE 103 N 0.22 1.26 -0.36 2.00 2.04 -1.09 -2.11 117.51 119.47 3i5t h ILE 103 Ca 0.08 -1.23 0.10 0.00 1.00 0.00 0.00 64.86 64.81 3i5t h ILE 103 Cb 0.23 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 3i5t h ILE 103 CO -0.00 0.43 0.38 0.00 0.00 0.00 0.00 178.15 178.96 3i5t h ALA 104 N 1.03 2.06 0.00 1.87 0.00 -1.29 0.13 119.26 123.07 3i5t h ALA 104 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3i5t h ALA 104 Cb 0.64 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3i5t h ALA 104 CO 0.04 -0.56 -0.07 1.79 0.00 0.00 0.00 179.25 180.45 3i5t h THR 105 N 0.00 0.00 0.00 0.00 1.35 -1.34 -3.36 112.91 109.57 3i5t h THR 105 Ca 0.17 -0.59 -0.24 0.00 -0.55 0.00 0.00 66.41 65.20 3i5t h THR 105 Cb 0.93 1.55 -0.05 0.00 -1.73 0.00 0.00 68.15 68.85 3i5t h THR 105 CO -0.00 0.00 -2.14 0.18 -0.25 0.00 0.00 175.52 173.31 3i5t n LEU 106 N -2.42 0.00 -4.77 3.87 4.77 0.40 -5.00 117.00 113.85 3i5t n LEU 106 Ca 0.05 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.70 3i5t n LEU 106 Cb 0.45 0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.91 3i5t n LEU 106 CO 0.32 0.32 0.74 0.42 -1.33 0.00 0.00 177.39 177.86 3i5t s THR 107 N -2.69 3.29 0.73 -5.08 -4.23 -0.81 -4.67 115.64 102.18 3i5t s THR 107 Ca -0.08 0.58 -0.11 0.00 -1.18 0.00 0.00 61.69 60.90 3i5t s THR 107 Cb 0.07 -3.11 0.03 0.00 1.34 0.00 0.00 72.50 70.83 3i5t s THR 107 CO 0.76 -0.38 1.07 -2.84 -0.54 0.00 0.00 174.62 172.68 3i5t s PRO 108 N -4.16 2.65 4.97 3.99 0.02 -1.26 -4.87 135.00 136.34 3i5t s PRO 108 Ca 0.66 0.94 0.00 0.00 0.02 0.00 0.00 61.00 62.63 3i5t s PRO 108 Cb -0.20 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.36 3i5t s PRO 108 CO 0.42 -1.30 0.00 0.41 -0.33 0.00 0.00 177.00 176.20 3i5t n GLY 109 N -1.85 2.93 1.47 0.52 0.00 -1.26 -3.05 105.19 103.95 3i5t n GLY 109 Ca 0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 3i5t n GLY 109 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i5t n ASP 110 N 2.11 3.98 -3.95 1.61 5.75 -1.26 -4.85 116.55 119.94 3i5t n ASP 110 Ca 0.00 -3.30 -0.40 0.00 -0.01 0.00 0.00 54.79 51.08 3i5t n ASP 110 Cb 0.00 -0.66 -0.03 0.00 -1.03 0.00 0.00 41.12 39.39 3i5t n ASP 110 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3i5t n LEU 111 N -0.52 4.79 -0.00 -2.12 4.32 -1.17 -1.07 117.00 121.23 3i5t n LEU 111 Ca 0.34 -3.42 0.08 0.00 -0.02 0.00 0.00 56.01 52.98 3i5t n LEU 111 Cb 1.17 -1.46 -0.10 0.00 -1.62 0.00 0.00 43.42 41.41 3i5t n LEU 111 CO 0.30 -0.15 -0.09 0.59 -1.22 0.00 0.00 177.39 176.82 3i5t n ASN 112 N 8.44 0.82 -4.14 -1.43 3.02 -1.17 -4.51 115.26 116.29 3i5t n ASN 112 Ca 0.49 -0.83 -0.30 0.00 -0.03 0.00 0.00 54.58 53.91 3i5t n ASN 112 Cb 0.42 1.06 -0.17 0.00 -0.61 0.00 0.00 39.78 40.49 3i5t n ASN 112 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3i5t s ARG 113 N -2.67 2.58 -0.10 3.52 3.52 -1.22 -4.77 118.95 119.81 3i5t s ARG 113 Ca 0.05 -0.71 0.01 0.00 -0.13 0.00 0.00 55.73 54.95 3i5t s ARG 113 Cb 0.13 -2.03 -0.02 0.00 -1.56 0.00 0.00 34.95 31.47 3i5t s ARG 113 CO 0.71 0.08 -0.10 0.42 -0.81 0.00 0.00 175.30 175.60 3i5t s ILE 114 N 0.58 3.35 -0.16 4.11 -1.09 -1.26 -0.71 121.20 126.03 3i5t s ILE 114 Ca -0.14 -0.59 -0.03 0.00 -2.23 0.00 0.00 60.65 57.66 3i5t s ILE 114 Cb -0.17 -2.38 -0.02 0.00 -1.58 0.00 0.00 42.46 38.31 3i5t s ILE 114 CO 0.05 0.56 -0.06 0.12 -1.23 0.00 0.00 174.94 174.38 3i5t s PHE 115 N -0.25 2.97 0.03 3.97 5.36 -0.61 -4.99 117.98 124.47 3i5t s PHE 115 Ca 0.02 -0.42 0.00 0.00 -0.96 0.00 0.00 56.93 55.57 3i5t s PHE 115 Cb -0.13 -1.95 -0.04 0.00 -0.34 0.00 0.00 43.02 40.56 3i5t s PHE 115 CO 0.03 -0.12 0.13 -0.06 -1.46 0.00 0.00 175.22 173.74 3i5t s PHE 116 N 0.46 3.37 0.00 10.12 0.08 -1.26 -1.04 117.98 129.70 3i5t s PHE 116 Ca -0.05 0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.22 3i5t s PHE 116 Cb -0.15 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 3i5t s PHE 116 CO 0.03 0.57 0.00 0.25 -0.10 0.00 0.00 175.22 175.97 3i5t n THR 117 N 0.74 0.00 0.80 0.64 -2.24 0.09 -4.33 114.28 109.98 3i5t n THR 117 Ca -0.10 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.79 3i5t n THR 117 Cb 0.52 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.84 3i5t n THR 117 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3i5t n THR 118 N 0.00 0.04 -1.35 4.28 -2.24 -1.26 -1.17 114.28 112.59 3i5t n THR 118 Ca 0.00 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3i5t n THR 118 Cb 0.00 1.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 3i5t n THR 118 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i5t n GLY 119 N 1.15 -1.43 0.23 3.38 0.00 -1.26 -3.44 105.19 103.83 3i5t n GLY 119 Ca 0.12 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 3i5t n GLY 119 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3i5t h GLY 120 N 0.00 0.88 0.99 -0.02 0.00 -1.82 -2.44 103.07 100.65 3i5t h GLY 120 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 47.33 46.34 3i5t h GLY 120 CO 0.00 0.89 0.24 1.76 0.00 0.00 0.00 176.54 179.43 3i5t h SER 121 N 0.56 0.46 0.25 0.19 0.02 -1.96 -1.36 113.55 111.70 3i5t h SER 121 Ca 0.02 -0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.82 3i5t h SER 121 Cb 1.05 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 3i5t h SER 121 CO 0.10 0.36 -0.44 0.71 -1.14 0.00 0.00 176.83 176.42 3i5t h THR 122 N 0.51 1.32 -0.14 -2.27 1.35 -1.92 0.36 112.91 112.12 3i5t h THR 122 Ca 0.14 -1.60 -0.02 0.00 -0.55 0.00 0.00 66.41 64.38 3i5t h THR 122 Cb -0.01 1.73 -0.00 0.00 -1.73 0.00 0.00 68.15 68.13 3i5t h THR 122 CO -0.03 0.48 -0.01 0.00 -0.25 0.00 0.00 175.52 175.71 3i5t h ALA 123 N 1.34 0.18 -0.50 6.62 0.00 -1.29 -0.08 119.26 125.55 3i5t h ALA 123 Ca 0.01 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 3i5t h ALA 123 Cb 0.86 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3i5t h ALA 123 CO 0.07 -0.11 -0.06 0.28 0.00 0.00 0.00 179.25 179.43 3i5t h VAL 124 N -0.03 1.27 -0.53 0.00 2.07 -1.08 0.16 116.25 118.11 3i5t h VAL 124 Ca 0.04 -1.18 0.08 0.00 0.82 0.00 0.00 66.70 66.46 3i5t h VAL 124 Cb 0.38 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 3i5t h VAL 124 CO 0.01 0.41 0.18 -0.78 0.02 0.00 0.00 177.57 177.41 3i5t h ASP 125 N 0.78 0.18 0.58 0.57 3.58 -0.28 -0.58 116.42 121.24 3i5t h ASP 125 Ca 0.13 0.07 -0.10 0.00 0.42 0.00 0.00 57.03 57.55 3i5t h ASP 125 Cb 0.60 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 3i5t h ASP 125 CO 0.04 0.12 -0.48 0.28 -2.88 0.00 0.00 179.24 176.32 3i5t h SER 126 N 0.36 0.00 -0.57 2.28 0.02 -0.72 -0.14 113.55 114.78 3i5t h SER 126 Ca 0.26 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.13 3i5t h SER 126 Cb 0.29 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 3i5t h SER 126 CO -0.27 0.48 0.04 0.00 -1.14 0.00 0.00 176.83 175.95 3i5t h ALA 127 N 1.52 0.76 -0.18 3.77 0.00 -0.24 -0.44 119.26 124.45 3i5t h ALA 127 Ca -0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 3i5t h ALA 127 Cb 0.90 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3i5t h ALA 127 CO 0.06 0.56 -0.55 -0.07 0.00 0.00 0.00 179.25 179.25 3i5t h LEU 128 N 0.87 0.80 -1.48 0.00 3.38 -0.80 -2.09 115.31 115.99 3i5t h LEU 128 Ca 0.17 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 3i5t h LEU 128 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3i5t h LEU 128 CO 0.02 1.25 -0.02 0.03 0.09 0.00 0.00 178.44 179.81 3i5t h ARG 129 N 0.39 0.31 -0.57 1.13 3.08 -1.04 -2.13 114.38 115.54 3i5t h ARG 129 Ca -0.02 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3i5t h ARG 129 Cb 1.17 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.14 3i5t h ARG 129 CO 0.12 0.36 0.30 0.35 -1.07 0.00 0.00 179.97 180.02 3i5t h PHE 130 N 0.31 0.80 -0.82 3.04 3.04 -0.86 -2.07 116.94 120.38 3i5t h PHE 130 Ca 0.07 -0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.97 3i5t h PHE 130 Cb 0.24 -0.25 -0.04 0.00 2.56 0.00 0.00 35.95 38.46 3i5t h PHE 130 CO 0.00 0.60 0.41 0.66 -2.02 0.00 0.00 178.31 177.96 3i5t h SER 131 N 0.77 1.05 0.36 0.41 4.64 -0.74 0.14 113.55 120.19 3i5t h SER 131 Ca 0.20 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3i5t h SER 131 Cb 0.07 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 3i5t h SER 131 CO -0.03 0.88 -0.45 -0.33 -0.87 0.00 0.00 176.83 176.03 3i5t h GLU 132 N 1.16 -0.80 -0.45 4.77 5.08 -1.41 -2.74 114.58 120.19 3i5t h GLU 132 Ca 0.28 0.05 0.09 0.00 -1.00 0.00 0.00 59.36 58.79 3i5t h GLU 132 Cb 0.09 0.18 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 3i5t h GLU 132 CO -0.04 -0.53 -0.13 0.35 -1.00 0.00 0.00 179.01 177.66 3i5t h PHE 133 N -0.83 -0.30 -0.01 4.33 3.57 -0.97 -1.01 116.94 121.72 3i5t h PHE 133 Ca -0.04 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.53 3i5t h PHE 133 Cb 0.74 0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.62 3i5t h PHE 133 CO -0.28 -0.22 -0.43 -0.92 -2.23 0.00 0.00 178.31 174.23 3i5t h TYR 134 N -0.03 -1.24 -0.07 0.41 3.20 -0.77 0.03 116.97 118.51 3i5t h TYR 134 Ca 0.22 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 62.05 3i5t h TYR 134 Cb 0.36 0.54 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 3i5t h TYR 134 CO -0.41 -0.51 -0.31 -0.91 -1.64 0.00 0.00 178.16 174.39 3i5t h ASN 135 N -0.58 0.13 -0.29 -2.11 2.35 -1.20 -1.29 115.58 112.59 3i5t h ASN 135 Ca 0.05 -0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3i5t h ASN 135 Cb 0.66 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 3i5t h ASN 135 CO -0.33 0.44 0.03 0.78 -1.65 0.00 0.00 177.43 176.71 3i5t h ASN 136 N 0.12 0.47 -0.55 5.81 2.35 -0.74 0.39 115.58 123.43 3i5t h ASN 136 Ca 0.02 -0.27 -0.06 0.00 -0.55 0.00 0.00 56.30 55.44 3i5t h ASN 136 Cb 0.61 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.83 3i5t h ASN 136 CO 0.04 0.62 0.13 0.58 -1.65 0.00 0.00 177.43 177.16 3i5t h VAL 137 N 0.29 1.24 0.00 2.81 2.07 -0.74 -2.26 116.25 119.66 3i5t h VAL 137 Ca 0.09 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3i5t h VAL 137 Cb 0.36 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3i5t h VAL 137 CO 0.01 0.33 0.00 0.18 0.02 0.00 0.00 177.57 178.11 3i5t n LEU 138 N -4.26 0.00 -0.99 2.57 4.77 -0.51 -4.88 117.00 113.70 3i5t n LEU 138 Ca 0.04 0.32 -0.06 0.00 -0.03 0.00 0.00 56.01 56.28 3i5t n LEU 138 Cb 0.24 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.02 3i5t n LEU 138 CO 0.41 -0.13 -0.01 0.61 -1.33 0.00 0.00 177.39 176.94 3i5t n GLY 139 N 0.24 0.33 2.45 -0.72 0.00 -0.85 -5.00 105.19 101.63 3i5t n GLY 139 Ca 0.08 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 3i5t n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i5t n ARG 140 N -1.64 2.38 0.29 1.61 1.74 0.13 -4.96 116.66 116.20 3i5t n ARG 140 Ca -0.03 -4.51 0.19 0.00 -0.77 0.00 0.00 57.85 52.73 3i5t n ARG 140 Cb 0.54 -2.13 0.86 0.00 -1.02 0.00 0.00 32.46 30.71 3i5t n ARG 140 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3i5t h PRO 141 N 4.00 0.00 0.00 5.56 0.13 -1.89 -2.30 132.00 137.50 3i5t h PRO 141 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3i5t h PRO 141 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 3i5t h PRO 141 CO 0.79 0.00 -0.28 1.96 -0.23 0.00 0.00 178.00 180.24 3i5t h GLN 142 N 0.00 0.00 -5.39 0.86 1.08 -1.93 -3.42 115.11 106.31 3i5t h GLN 142 Ca 0.00 0.00 -0.70 0.00 -1.45 0.00 0.00 58.65 56.50 3i5t h GLN 142 Cb 0.30 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.61 3i5t h GLN 142 CO 0.00 0.00 1.85 0.21 -0.95 0.00 0.00 178.83 179.94 3i5t s LYS 143 N -3.21 4.04 0.00 1.46 2.20 -0.87 -4.33 119.74 119.02 3i5t s LYS 143 Ca 0.06 -2.25 0.00 0.00 -0.36 0.00 0.00 55.97 53.42 3i5t s LYS 143 Cb 0.09 -5.34 0.00 0.00 -1.51 0.00 0.00 37.83 31.07 3i5t s LYS 143 CO 0.68 -2.05 0.00 1.63 -0.36 0.00 0.00 175.35 175.25 3i5t n LYS 144 N 7.23 3.44 -2.32 4.03 4.76 -0.45 -4.15 118.16 130.71 3i5t n LYS 144 Ca 0.44 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.52 3i5t n LYS 144 Cb 0.45 -0.49 -0.01 0.00 -1.84 0.00 0.00 35.03 33.14 3i5t n LYS 144 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3i5t s ARG 145 N -0.53 3.73 -0.11 1.97 0.52 0.74 -4.43 118.95 120.83 3i5t s ARG 145 Ca 0.00 1.67 0.01 0.00 -0.52 0.00 0.00 55.73 56.89 3i5t s ARG 145 Cb 0.00 -2.31 -0.01 0.00 0.52 0.00 0.00 34.95 33.15 3i5t s ARG 145 CO 0.00 -0.55 -0.16 0.42 0.02 0.00 0.00 175.30 175.02 3i5t s ILE 146 N -1.64 2.75 -0.22 1.52 1.01 0.72 0.37 121.20 125.71 3i5t s ILE 146 Ca 0.65 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 60.47 3i5t s ILE 146 Cb -0.26 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 3i5t s ILE 146 CO 0.31 0.54 0.03 -0.63 0.00 0.00 0.00 174.94 175.19 3i5t s ILE 147 N 0.25 4.14 0.20 2.92 -1.09 0.04 -1.48 121.20 126.18 3i5t s ILE 147 Ca -0.11 -0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.09 3i5t s ILE 147 Cb -0.16 -2.90 -0.01 0.00 -1.58 0.00 0.00 42.46 37.81 3i5t s ILE 147 CO 0.06 0.40 0.08 1.33 -1.23 0.00 0.00 174.94 175.58 3i5t n VAL 148 N 4.43 0.00 -4.31 2.92 0.24 -0.70 -0.71 118.33 120.20 3i5t n VAL 148 Ca -0.17 -1.17 -0.22 0.00 -2.04 0.00 0.00 64.34 60.75 3i5t n VAL 148 Cb 0.52 0.44 -0.13 0.00 -1.47 0.00 0.00 33.84 33.20 3i5t n VAL 148 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3i5t s ARG 149 N -2.75 1.03 0.71 7.34 3.00 -1.26 -0.23 118.95 126.79 3i5t s ARG 149 Ca 0.11 -0.99 -0.16 0.00 0.00 0.00 0.00 55.73 54.69 3i5t s ARG 149 Cb 0.01 -1.15 0.02 0.00 0.00 0.00 0.00 34.95 33.83 3i5t s ARG 149 CO 0.08 0.27 1.20 0.66 0.00 0.00 0.00 175.30 177.51 3i5t n TYR 150 N 1.41 1.48 -0.28 -0.53 4.02 -0.50 -2.38 117.16 120.39 3i5t n TYR 150 Ca -0.19 0.41 0.00 0.00 -0.01 0.00 0.00 57.90 58.11 3i5t n TYR 150 Cb 0.54 -2.18 0.00 0.00 -0.02 0.00 0.00 39.34 37.68 3i5t n TYR 150 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3i5t n ASP 151 N -2.32 0.00 -4.81 7.72 8.00 0.14 -3.95 116.55 121.32 3i5t n ASP 151 Ca 0.15 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.33 3i5t n ASP 151 Cb 0.49 -0.98 0.03 0.00 -0.02 0.00 0.00 41.12 40.65 3i5t n ASP 151 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3i5t s GLY 152 N -2.00 1.86 -0.05 0.44 0.00 -1.00 -3.38 107.32 103.19 3i5t s GLY 152 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.93 3i5t s GLY 152 CO 0.00 0.53 0.01 -0.47 0.00 0.00 0.00 173.10 173.17 3i5t s TYR 153 N -2.80 0.41 0.00 1.90 5.04 -1.26 0.11 117.35 120.75 3i5t s TYR 153 Ca 0.60 -0.01 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 3i5t s TYR 153 Cb -0.15 -0.59 0.00 0.00 0.35 0.00 0.00 41.96 41.57 3i5t s TYR 153 CO 0.47 -0.23 0.30 0.72 -1.34 0.00 0.00 175.55 175.47 3i5t n HIS 154 N 4.83 0.00 -0.53 4.97 8.25 -1.26 -4.91 115.22 126.57 3i5t n HIS 154 Ca -0.13 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 3i5t n HIS 154 Cb 0.50 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 3i5t n HIS 154 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i5t n GLY 155 N -0.01 0.60 0.00 -1.41 0.00 -1.25 -4.48 105.19 98.65 3i5t n GLY 155 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3i5t n GLY 155 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3i5t n SER 156 N 3.00 1.01 -4.83 1.61 2.88 -1.26 -2.93 113.62 113.09 3i5t n SER 156 Ca 0.00 -1.52 -0.31 0.00 -1.33 0.00 0.00 58.87 55.71 3i5t n SER 156 Cb 0.00 -0.01 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 3i5t n SER 156 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3i5t s THR 157 N -0.52 4.12 0.18 2.46 -4.23 -1.26 -4.76 115.64 111.62 3i5t s THR 157 Ca 0.00 0.69 -0.19 0.00 -1.18 0.00 0.00 61.69 61.01 3i5t s THR 157 Cb 0.00 -3.48 0.11 0.00 1.34 0.00 0.00 72.50 70.47 3i5t s THR 157 CO 0.00 -0.90 1.62 0.00 -0.54 0.00 0.00 174.62 174.80 3i5t h ALA 158 N -0.66 0.05 -0.43 3.99 0.00 -1.98 0.33 119.26 120.57 3i5t h ALA 158 Ca -0.44 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 3i5t h ALA 158 Cb 1.21 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 3i5t h ALA 158 CO 0.58 -0.60 -0.02 1.25 0.00 0.00 0.00 179.25 180.46 3i5t h LEU 159 N -0.15 0.76 -0.48 0.00 6.46 -1.98 -1.29 115.31 118.63 3i5t h LEU 159 Ca 0.21 -0.32 -0.17 0.00 -0.12 0.00 0.00 57.88 57.48 3i5t h LEU 159 Cb 0.47 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 3i5t h LEU 159 CO -0.53 0.90 -0.73 0.71 -0.62 0.00 0.00 178.44 178.17 3i5t h THR 160 N 0.61 1.45 -0.09 1.05 1.35 -1.79 -1.91 112.91 113.58 3i5t h THR 160 Ca 0.12 -2.30 -0.09 0.00 -0.55 0.00 0.00 66.41 63.59 3i5t h THR 160 Cb 0.52 2.23 -0.01 0.00 -1.73 0.00 0.00 68.15 69.16 3i5t h THR 160 CO 0.03 0.67 -0.34 0.00 -0.25 0.00 0.00 175.52 175.63 3i5t h ALA 161 N 1.11 1.27 0.00 6.62 0.00 -0.22 -2.39 119.26 125.64 3i5t h ALA 161 Ca -0.02 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3i5t h ALA 161 Cb 1.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3i5t h ALA 161 CO 0.11 0.51 -0.24 0.00 0.00 0.00 0.00 179.25 179.63 3i5t h ALA 162 N 1.50 1.21 -0.03 0.00 0.00 -0.91 -2.36 119.26 118.68 3i5t h ALA 162 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3i5t h ALA 162 Cb 0.68 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3i5t h ALA 162 CO 0.05 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.60 3i5t s THR 164 N -1.98 5.07 -2.25 0.00 2.01 -0.89 -4.62 115.64 112.97 3i5t s THR 164 Ca 0.40 1.02 0.24 0.00 0.31 0.00 0.00 61.69 63.66 3i5t s THR 164 Cb 0.20 -3.88 0.56 0.00 0.01 0.00 0.00 72.50 69.40 3i5t s THR 164 CO 0.33 0.13 1.73 0.61 -0.69 0.00 0.00 174.62 176.74 3i5t n GLY 165 N 3.96 -0.21 3.56 4.40 0.00 0.12 -4.71 105.19 112.30 3i5t n GLY 165 Ca -0.03 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 3i5t n GLY 165 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i5t s ARG 166 N -1.92 3.53 0.31 1.61 1.81 -0.95 -0.69 118.95 122.65 3i5t s ARG 166 Ca 0.35 -1.00 0.24 0.00 -1.72 0.00 0.00 55.73 53.60 3i5t s ARG 166 Cb 0.18 -5.22 1.11 0.00 -0.45 0.00 0.00 34.95 30.58 3i5t s ARG 166 CO 0.29 -2.22 1.73 1.79 -0.68 0.00 0.00 175.30 176.22 3i5t h THR 167 N 6.71 0.00 0.00 0.02 1.35 -1.93 -1.95 112.91 117.12 3i5t h THR 167 Ca 0.14 -0.17 -0.01 0.00 -0.55 0.00 0.00 66.41 65.82 3i5t h THR 167 Cb 1.01 0.84 -0.00 0.00 -1.73 0.00 0.00 68.15 68.28 3i5t h THR 167 CO 1.41 0.00 -0.06 1.23 -0.25 0.00 0.00 175.52 177.85 3i5t h GLY 168 N 1.45 0.00 1.74 5.82 0.00 -1.98 -2.48 103.07 107.62 3i5t h GLY 168 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i5t h GLY 168 CO 0.00 0.00 -0.19 0.70 0.00 0.00 0.00 176.54 177.05 3i5t n ASN 169 N -3.42 0.79 -0.05 0.19 3.02 -0.73 -4.41 115.26 110.64 3i5t n ASN 169 Ca -0.02 0.44 -0.16 0.00 -0.03 0.00 0.00 54.58 54.81 3i5t n ASN 169 Cb 0.19 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.80 3i5t n ASN 169 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 3i5t h TRP 170 N 0.00 1.02 -2.07 3.10 4.06 -1.59 -3.45 115.95 117.01 3i5t h TRP 170 Ca 0.00 -0.40 -0.64 0.00 2.06 0.00 0.00 58.89 59.91 3i5t h TRP 170 Cb 0.74 -0.18 0.08 0.00 -1.00 0.00 0.00 29.16 28.81 3i5t h TRP 170 CO 0.00 1.22 0.32 -2.30 -3.56 0.00 0.00 178.44 174.13 3i5t n PRO 171 N -4.04 1.31 -1.05 0.49 -0.02 -1.26 -1.01 135.00 129.43 3i5t n PRO 171 Ca -0.06 0.47 -0.02 0.00 -2.02 0.00 0.00 63.50 61.87 3i5t n PRO 171 Cb 0.66 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 32.14 3i5t n PRO 171 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3i5t n ASN 172 N 2.02 -4.35 -4.35 2.55 3.02 -1.26 -5.02 115.26 107.88 3i5t n ASN 172 Ca 0.14 0.04 -0.27 0.00 -0.03 0.00 0.00 54.58 54.46 3i5t n ASN 172 Cb 0.26 -1.99 -0.13 0.00 -0.61 0.00 0.00 39.78 37.30 3i5t n ASN 172 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3i5t s PHE 173 N -1.68 2.13 -1.08 3.10 0.08 -0.18 -5.07 117.98 115.28 3i5t s PHE 173 Ca 0.00 -0.39 -0.14 0.00 0.12 0.00 0.00 56.93 56.52 3i5t s PHE 173 Cb 0.00 -1.18 0.19 0.00 -0.57 0.00 0.00 43.02 41.46 3i5t s PHE 173 CO 0.00 0.26 1.21 -0.51 -0.10 0.00 0.00 175.22 176.08 3i5t s ASP 174 N -1.86 7.00 -0.17 1.36 1.01 -1.26 -4.83 116.67 117.91 3i5t s ASP 174 Ca 0.11 -2.89 -0.25 0.00 0.71 0.00 0.00 52.55 50.23 3i5t s ASP 174 Cb -0.10 -2.33 -0.22 0.00 1.01 0.00 0.00 42.92 41.28 3i5t s ASP 174 CO 0.05 -0.69 0.49 0.40 0.21 0.00 0.00 175.17 175.63 3i5t h ILE 175 N 4.70 1.35 -2.78 0.77 1.08 -1.96 -3.47 117.51 117.20 3i5t h ILE 175 Ca 0.22 -2.25 -0.56 0.00 -0.39 0.00 0.00 64.86 61.89 3i5t h ILE 175 Cb 0.93 2.78 0.07 0.00 -3.07 0.00 0.00 36.82 37.53 3i5t h ILE 175 CO 1.10 0.46 0.81 0.00 -0.69 0.00 0.00 178.15 179.83 3i5t n ALA 176 N -3.01 1.96 -3.50 1.87 0.00 -1.26 -4.78 120.51 111.80 3i5t n ALA 176 Ca -0.21 0.40 -0.17 0.00 0.00 0.00 0.00 53.44 53.47 3i5t n ALA 176 Cb 0.57 -2.40 -0.05 0.00 0.00 0.00 0.00 19.45 17.57 3i5t n ALA 176 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3i5t s GLN 177 N 0.13 1.09 0.52 0.00 -2.07 -1.26 -5.06 119.66 113.01 3i5t s GLN 177 Ca 0.70 0.12 0.26 0.00 -1.82 0.00 0.00 55.36 54.62 3i5t s GLN 177 Cb -0.58 0.51 1.41 0.00 -1.09 0.00 0.00 33.01 33.26 3i5t s GLN 177 CO 0.44 -0.37 2.06 0.22 -1.32 0.00 0.00 175.29 176.32 3i5t h ASP 178 N 2.83 0.00 0.33 12.60 3.58 -2.03 -2.50 116.42 131.23 3i5t h ASP 178 Ca -0.28 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.13 3i5t h ASP 178 Cb 1.17 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.22 3i5t h ASP 178 CO 0.39 0.12 -0.17 -0.09 -2.88 0.00 0.00 179.24 176.61 3i5t h ARG 179 N 0.00 0.00 -5.18 0.28 2.43 -1.95 -3.43 114.38 106.52 3i5t h ARG 179 Ca -0.00 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.50 3i5t h ARG 179 Cb 0.33 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.56 3i5t h ARG 179 CO 0.02 0.17 -0.83 0.42 -1.51 0.00 0.00 179.97 178.24 3i5t s ILE 180 N -4.30 2.42 -0.10 1.20 1.01 -0.94 -0.20 121.20 120.29 3i5t s ILE 180 Ca -0.03 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.80 3i5t s ILE 180 Cb 0.14 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.61 3i5t s ILE 180 CO 0.63 0.53 -0.22 -0.55 0.00 0.00 0.00 174.94 175.33 3i5t s SER 181 N 0.86 2.91 -0.19 3.58 0.15 -0.55 -4.63 113.70 115.83 3i5t s SER 181 Ca -0.05 -0.53 -0.16 0.00 0.70 0.00 0.00 55.95 55.92 3i5t s SER 181 Cb -0.15 -1.33 -0.04 0.00 -1.71 0.00 0.00 66.02 62.79 3i5t s SER 181 CO -0.02 0.13 0.38 -0.36 1.20 0.00 0.00 173.24 174.58 3i5t s PHE 182 N 0.43 3.40 0.63 3.44 0.40 -1.26 -1.72 117.98 123.31 3i5t s PHE 182 Ca -0.17 0.63 -0.01 0.00 -0.60 0.00 0.00 56.93 56.78 3i5t s PHE 182 Cb -0.17 -2.48 0.07 0.00 0.51 0.00 0.00 43.02 40.94 3i5t s PHE 182 CO 0.07 0.06 0.89 -0.51 0.70 0.00 0.00 175.22 176.43 3i5t s LEU 183 N 1.06 3.10 0.53 -0.37 1.43 0.69 -4.86 118.68 120.25 3i5t s LEU 183 Ca 0.19 -0.01 -0.21 0.00 -1.03 0.00 0.00 54.13 53.07 3i5t s LEU 183 Cb -0.14 -2.67 -0.05 0.00 0.03 0.00 0.00 46.19 43.35 3i5t s LEU 183 CO 0.07 -1.44 1.20 -0.44 0.23 0.00 0.00 176.35 175.98 3i5t s SER 184 N -4.53 5.62 0.18 2.29 0.01 -1.26 -1.41 113.70 114.59 3i5t s SER 184 Ca 0.60 2.39 -0.32 0.00 1.31 0.00 0.00 55.95 59.94 3i5t s SER 184 Cb -0.09 -2.60 -0.11 0.00 0.21 0.00 0.00 66.02 63.42 3i5t s SER 184 CO 0.41 -1.30 1.77 -0.55 0.41 0.00 0.00 173.24 173.99 3i5t s SER 185 N -1.44 6.39 -0.38 2.44 0.15 -1.25 -4.49 113.70 115.11 3i5t s SER 185 Ca 0.71 2.84 -0.06 0.00 0.70 0.00 0.00 55.95 60.13 3i5t s SER 185 Cb -0.30 -2.59 -0.18 0.00 -1.71 0.00 0.00 66.02 61.24 3i5t s SER 185 CO 0.35 -0.99 3.35 -0.81 1.20 0.00 0.00 173.24 176.34 3i5t n PRO 186 N 4.68 2.43 -2.80 5.44 -0.04 -1.26 -4.90 135.00 138.55 3i5t n PRO 186 Ca 0.17 -1.49 -0.42 0.00 -0.04 0.00 0.00 63.50 61.71 3i5t n PRO 186 Cb 0.36 -2.17 -0.04 0.00 -0.04 0.00 0.00 33.50 31.61 3i5t n PRO 186 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3i5t s ASN 187 N 1.72 6.75 0.51 3.54 3.84 -1.26 -4.00 114.94 126.04 3i5t s ASN 187 Ca 0.66 0.75 0.29 0.00 0.21 0.00 0.00 52.86 54.77 3i5t s ASN 187 Cb 0.30 -2.47 1.40 0.00 -0.55 0.00 0.00 41.25 39.93 3i5t s ASN 187 CO -0.05 -0.78 1.85 -0.65 -2.79 0.00 0.00 177.10 174.69 3i5t h PRO 188 N 8.22 0.10 -0.27 0.43 0.11 -1.91 -0.83 132.00 137.85 3i5t h PRO 188 Ca -0.23 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3i5t h PRO 188 Cb 1.08 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3i5t h PRO 188 CO 0.96 0.07 0.00 2.89 -0.21 0.00 0.00 178.00 181.71 3i5t n ARG 189 N -4.33 1.58 -0.10 1.05 1.85 -1.26 -2.35 116.66 113.09 3i5t n ARG 189 Ca 0.21 -0.84 0.10 0.00 -1.00 0.00 0.00 57.85 56.32 3i5t n ARG 189 Cb 0.98 -1.22 0.15 0.00 -1.05 0.00 0.00 32.46 31.32 3i5t n ARG 189 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3i5t n HIS 190 N 0.18 0.28 0.24 2.89 8.25 -0.32 -4.49 115.22 122.24 3i5t n HIS 190 Ca 0.08 -0.16 0.09 0.00 -0.26 0.00 0.00 57.72 57.47 3i5t n HIS 190 Cb 0.22 -0.00 0.62 0.00 1.12 0.00 0.00 29.99 31.94 3i5t n HIS 190 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i5t h ALA 191 N 3.91 1.45 -0.76 -1.41 0.00 -1.58 -3.48 119.26 117.40 3i5t h ALA 191 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3i5t h ALA 191 Cb 0.87 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3i5t h ALA 191 CO 0.00 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.86 3i5t n GLY 192 N -0.81 3.77 0.55 0.00 0.00 -1.26 -1.70 105.19 105.74 3i5t n GLY 192 Ca -0.02 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.06 3i5t n GLY 192 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i5t n ASN 193 N 8.59 1.64 -4.92 1.61 3.02 -1.26 -4.90 115.26 119.05 3i5t n ASN 193 Ca 0.00 -1.80 -0.29 0.00 -0.03 0.00 0.00 54.58 52.46 3i5t n ASN 193 Cb 0.00 -0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 38.99 3i5t n ASN 193 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3i5t s ARG 194 N -1.71 3.55 0.66 3.52 0.52 -0.69 -5.09 118.95 119.70 3i5t s ARG 194 Ca 0.29 -0.24 -0.16 0.00 -0.52 0.00 0.00 55.73 55.10 3i5t s ARG 194 Cb 0.15 -2.85 0.00 0.00 0.52 0.00 0.00 34.95 32.78 3i5t s ARG 194 CO 0.22 0.43 1.13 -1.54 0.02 0.00 0.00 175.30 175.56 3i5t s SER 195 N -2.87 4.99 0.37 0.23 1.04 -1.26 -4.82 113.70 111.37 3i5t s SER 195 Ca 0.39 2.10 0.09 0.00 0.48 0.00 0.00 55.95 59.01 3i5t s SER 195 Cb -0.11 -2.56 0.82 0.00 0.10 0.00 0.00 66.02 64.26 3i5t s SER 195 CO 0.27 -1.71 1.91 1.56 0.98 0.00 0.00 173.24 176.25 3i5t h GLN 196 N 0.12 0.66 -0.51 4.02 1.08 -1.95 0.17 115.11 118.70 3i5t h GLN 196 Ca -0.47 -0.04 -0.12 0.00 -1.45 0.00 0.00 58.65 56.57 3i5t h GLN 196 Cb 1.26 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 28.52 3i5t h GLN 196 CO 0.53 0.44 -0.13 0.93 -0.95 0.00 0.00 178.83 179.65 3i5t h GLU 197 N 0.68 0.98 -0.06 1.46 3.07 -1.98 -0.64 114.58 118.10 3i5t h GLU 197 Ca 0.39 -0.38 -0.18 0.00 -0.50 0.00 0.00 59.36 58.69 3i5t h GLU 197 Cb 0.56 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 3i5t h GLU 197 CO -0.15 1.06 -0.72 0.00 -1.40 0.00 0.00 179.01 177.79 3i5t h ALA 198 N 0.90 0.65 -0.58 3.43 0.00 -1.71 -1.92 119.26 120.02 3i5t h ALA 198 Ca 0.13 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 3i5t h ALA 198 Cb 0.70 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3i5t h ALA 198 CO 0.05 0.78 0.27 0.35 0.00 0.00 0.00 179.25 180.71 3i5t h PHE 199 N 0.22 0.85 -0.91 0.00 3.57 -0.63 -1.53 116.94 118.50 3i5t h PHE 199 Ca -0.03 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 3i5t h PHE 199 Cb 1.29 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 3i5t h PHE 199 CO 0.04 0.65 0.52 1.25 -2.23 0.00 0.00 178.31 178.54 3i5t h LEU 200 N 0.79 1.13 -0.81 0.59 5.85 -1.06 -0.49 115.31 121.32 3i5t h LEU 200 Ca 0.20 -0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.92 3i5t h LEU 200 Cb 0.13 -0.29 -0.07 0.00 0.37 0.00 0.00 40.66 40.81 3i5t h LEU 200 CO -0.02 0.89 0.45 0.44 -0.34 0.00 0.00 178.44 179.86 3i5t h ASP 201 N 1.27 0.64 0.00 1.25 3.32 -0.85 -1.04 116.42 121.02 3i5t h ASP 201 Ca 0.32 0.05 -0.19 0.00 0.02 0.00 0.00 57.03 57.23 3i5t h ASP 201 Cb -0.00 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3i5t h ASP 201 CO -0.06 0.37 -0.69 0.44 -1.72 0.00 0.00 179.24 177.58 3i5t h ASP 202 N 0.76 0.74 -0.15 6.45 3.45 -0.79 -1.46 116.42 125.42 3i5t h ASP 202 Ca 0.39 -0.46 0.02 0.00 0.43 0.00 0.00 57.03 57.41 3i5t h ASP 202 Cb 0.36 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.89 3i5t h ASP 202 CO -0.25 1.22 0.04 -0.07 -1.57 0.00 0.00 179.24 178.61 3i5t h LEU 203 N 0.45 0.03 -0.58 1.55 4.07 -0.87 -0.67 115.31 119.29 3i5t h LEU 203 Ca -0.03 0.02 -0.05 0.00 0.08 0.00 0.00 57.88 57.90 3i5t h LEU 203 Cb 1.28 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 43.02 3i5t h LEU 203 CO 0.13 0.04 0.17 0.58 -1.08 0.00 0.00 178.44 178.29 3i5t h VAL 204 N 0.11 1.24 -0.59 1.22 2.07 -1.17 -2.67 116.25 116.46 3i5t h VAL 204 Ca 0.07 -0.83 0.01 0.00 0.82 0.00 0.00 66.70 66.77 3i5t h VAL 204 Cb 0.05 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3i5t h VAL 204 CO -0.08 0.31 0.38 -0.61 0.02 0.00 0.00 177.57 177.59 3i5t h GLN 205 N 0.82 0.75 -0.85 1.57 4.15 -1.18 -2.07 115.11 118.30 3i5t h GLN 205 Ca 0.19 -0.05 0.05 0.00 0.77 0.00 0.00 58.65 59.61 3i5t h GLN 205 Cb 0.30 -0.17 -0.06 0.00 0.21 0.00 0.00 27.48 27.76 3i5t h GLN 205 CO -0.00 0.50 0.53 1.49 -1.93 0.00 0.00 178.83 179.42 3i5t h GLU 206 N 0.77 0.97 0.02 1.69 4.81 -0.91 0.69 114.58 122.62 3i5t h GLU 206 Ca 0.22 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3i5t h GLU 206 Cb -0.06 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.10 3i5t h GLU 206 CO -0.06 0.64 -0.01 0.35 -0.73 0.00 0.00 179.01 179.20 3i5t h PHE 207 N 1.00 -0.02 -0.01 0.92 3.57 -1.20 -0.81 116.94 120.39 3i5t h PHE 207 Ca 0.36 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.79 3i5t h PHE 207 Cb 0.10 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3i5t h PHE 207 CO -0.03 0.23 -0.32 1.05 -2.23 0.00 0.00 178.31 177.01 3i5t h GLU 208 N -0.27 0.02 -0.36 1.11 4.11 -1.12 -0.63 114.58 117.43 3i5t h GLU 208 Ca -0.00 -0.01 -0.12 0.00 0.07 0.00 0.00 59.36 59.31 3i5t h GLU 208 Cb 0.26 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3i5t h GLU 208 CO 0.00 0.33 -0.24 -0.44 0.07 0.00 0.00 179.01 178.73 3i5t h ASP 209 N 0.02 0.75 -0.49 3.06 3.45 -0.77 -1.69 116.42 120.74 3i5t h ASP 209 Ca -0.00 -0.27 -0.08 0.00 0.43 0.00 0.00 57.03 57.11 3i5t h ASP 209 Cb 0.57 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 39.12 3i5t h ASP 209 CO 0.04 0.96 -0.00 -0.09 -1.57 0.00 0.00 179.24 178.58 3i5t h ARG 210 N 0.64 0.87 -0.44 3.56 9.65 -0.57 -1.41 114.38 126.68 3i5t h ARG 210 Ca 0.09 -0.28 0.02 0.00 -1.10 0.00 0.00 59.98 58.70 3i5t h ARG 210 Cb 0.75 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 29.22 3i5t h ARG 210 CO 0.06 0.91 0.26 0.82 2.80 0.00 0.00 179.97 184.82 3i5t h ILE 211 N 0.73 1.05 -0.24 1.20 2.04 -1.03 -0.63 117.51 120.64 3i5t h ILE 211 Ca 0.14 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.82 3i5t h ILE 211 Cb 0.52 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3i5t h ILE 211 CO 0.03 0.10 0.16 -0.08 0.00 0.00 0.00 178.15 178.35 3i5t h GLU 212 N 0.53 0.33 -0.03 2.37 4.81 -1.17 0.23 114.58 121.63 3i5t h GLU 212 Ca 0.18 -0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 59.18 3i5t h GLU 212 Cb 0.01 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3i5t h GLU 212 CO -0.08 0.24 -0.83 0.66 -0.73 0.00 0.00 179.01 178.26 3i5t h SER 213 N 0.32 0.46 0.91 1.04 4.64 -1.08 -3.19 113.55 116.65 3i5t h SER 213 Ca 0.09 -0.34 -0.23 0.00 -0.47 0.00 0.00 61.79 60.85 3i5t h SER 213 Cb -0.01 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 3i5t h SER 213 CO -0.02 1.11 -1.07 -0.07 -0.87 0.00 0.00 176.83 175.91 3i5t h LEU 214 N 0.23 0.08 -0.22 5.97 3.38 -1.12 -3.50 115.31 120.13 3i5t h LEU 214 Ca -0.05 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3i5t h LEU 214 Cb 1.44 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3i5t h LEU 214 CO 0.14 1.07 0.00 0.61 0.09 0.00 0.00 178.44 180.35 3i5t n GLY 215 N 1.39 0.01 0.33 0.83 0.00 0.79 -4.65 105.19 103.89 3i5t n GLY 215 Ca -0.02 -1.12 0.07 0.00 0.00 0.00 0.00 46.02 44.95 3i5t n GLY 215 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i5t h PRO 216 N 0.00 0.49 0.00 1.61 0.13 -1.83 -1.35 132.00 131.05 3i5t h PRO 216 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 3i5t h PRO 216 Cb 0.00 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.02 3i5t h PRO 216 CO 0.00 0.33 0.00 -0.25 -0.23 0.00 0.00 178.00 177.85 3i5t n ASP 217 N -4.47 0.00 -0.00 1.44 9.92 -1.26 -1.39 116.55 120.79 3i5t n ASP 217 Ca 0.06 0.39 0.09 0.00 -0.53 0.00 0.00 54.79 54.81 3i5t n ASP 217 Cb 0.20 -0.44 -0.11 0.00 -0.64 0.00 0.00 41.12 40.12 3i5t n ASP 217 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3i5t n THR 218 N -1.44 0.00 -3.64 -3.53 -2.24 -0.51 -2.88 114.28 100.05 3i5t n THR 218 Ca 0.03 -0.05 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 3i5t n THR 218 Cb 0.11 0.96 -0.11 0.00 -2.10 0.00 0.00 70.33 69.19 3i5t n THR 218 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3i5t s ILE 219 N -2.89 5.10 -0.13 2.28 1.01 -0.48 -0.18 121.20 125.89 3i5t s ILE 219 Ca 0.07 0.10 -0.16 0.00 0.00 0.00 0.00 60.65 60.65 3i5t s ILE 219 Cb 0.15 -3.41 -0.25 0.00 0.01 0.00 0.00 42.46 38.95 3i5t s ILE 219 CO 0.81 0.28 0.46 0.00 0.00 0.00 0.00 174.94 176.49 3i5t h ALA 220 N 8.25 0.23 -2.83 9.38 0.00 -0.25 -3.44 119.26 130.61 3i5t h ALA 220 Ca -0.36 -1.14 -0.15 0.00 0.00 0.00 0.00 54.91 53.26 3i5t h ALA 220 Cb 1.18 0.55 -0.21 0.00 0.00 0.00 0.00 17.79 19.32 3i5t h ALA 220 CO 0.57 0.84 -0.52 0.00 0.00 0.00 0.00 179.25 180.13 3i5t s ALA 221 N -2.45 -0.28 -0.22 0.00 0.00 -0.92 -1.47 121.76 116.42 3i5t s ALA 221 Ca -0.22 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.55 3i5t s ALA 221 Cb 0.05 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 3i5t s ALA 221 CO 0.72 -0.19 -0.04 0.12 0.00 0.00 0.00 175.76 176.37 3i5t s PHE 222 N -1.29 2.97 -0.20 0.00 2.19 0.28 -0.78 117.98 121.16 3i5t s PHE 222 Ca -0.14 -0.89 -0.02 0.00 0.33 0.00 0.00 56.93 56.21 3i5t s PHE 222 Cb -0.07 -2.11 -0.00 0.00 -1.31 0.00 0.00 43.02 39.52 3i5t s PHE 222 CO 0.01 -0.52 -0.09 -1.17 1.83 0.00 0.00 175.22 175.28 3i5t s LEU 223 N 1.45 2.72 -0.20 6.12 2.96 0.11 -1.21 118.68 130.63 3i5t s LEU 223 Ca 0.05 -0.43 -0.08 0.00 -0.22 0.00 0.00 54.13 53.45 3i5t s LEU 223 Cb -0.14 -1.67 0.08 0.00 0.50 0.00 0.00 46.19 44.96 3i5t s LEU 223 CO -0.03 0.02 0.44 0.00 -1.32 0.00 0.00 176.35 175.46 3i5t s ALA 224 N 1.23 -1.19 0.35 5.97 0.00 -0.72 -4.50 121.76 122.91 3i5t s ALA 224 Ca 0.03 1.60 -0.28 0.00 0.00 0.00 0.00 51.96 53.30 3i5t s ALA 224 Cb -0.14 -1.19 -0.11 0.00 0.00 0.00 0.00 23.12 21.68 3i5t s ALA 224 CO -0.04 -0.55 1.44 -1.21 0.00 0.00 0.00 175.76 175.41 3i5t s GLU 225 N 2.09 4.18 0.19 0.00 2.02 -1.26 -0.94 118.70 124.99 3i5t s GLU 225 Ca -0.05 2.46 -0.10 0.00 0.02 0.00 0.00 54.97 57.29 3i5t s GLU 225 Cb -0.10 -3.01 0.12 0.00 0.10 0.00 0.00 34.13 31.24 3i5t s GLU 225 CO -0.13 -0.44 1.79 -1.35 0.02 0.00 0.00 175.26 175.15 3i5t h PRO 226 N 3.36 1.00 -5.89 0.39 0.11 -1.95 -3.41 132.00 125.61 3i5t h PRO 226 Ca -0.50 -0.13 -0.53 0.00 0.11 0.00 0.00 66.00 64.95 3i5t h PRO 226 Cb 1.23 -0.19 -0.24 0.00 0.11 0.00 0.00 31.00 31.92 3i5t h PRO 226 CO 0.66 0.77 -0.82 0.96 -0.21 0.00 0.00 178.00 179.36 3i5t s ILE 227 N -5.76 1.52 -0.83 4.15 -5.25 -1.26 -4.58 121.20 109.19 3i5t s ILE 227 Ca -0.13 -1.29 -0.19 0.00 -0.99 0.00 0.00 60.65 58.05 3i5t s ILE 227 Cb 0.14 -1.36 0.12 0.00 2.95 0.00 0.00 42.46 44.31 3i5t s ILE 227 CO 0.80 0.03 1.01 -0.76 -1.79 0.00 0.00 174.94 174.23 3i5t s LEU 228 N -1.48 5.14 -0.01 0.37 1.02 0.08 -4.87 118.68 118.94 3i5t s LEU 228 Ca 0.05 -1.83 -0.18 0.00 0.02 0.00 0.00 54.13 52.18 3i5t s LEU 228 Cb -0.09 -2.37 -0.10 0.00 0.02 0.00 0.00 46.19 43.64 3i5t s LEU 228 CO 0.03 -1.09 0.86 0.00 0.02 0.00 0.00 176.35 176.16 3i5t h ALA 229 N 8.92 -0.76 0.00 4.21 0.00 -1.89 0.15 119.26 129.88 3i5t h ALA 229 Ca 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3i5t h ALA 229 Cb 1.04 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3i5t h ALA 229 CO 1.09 -0.71 -0.09 0.77 0.00 0.00 0.00 179.25 180.31 3i5t h SER 230 N -1.01 0.00 0.54 0.00 0.02 -1.90 -0.64 113.55 110.55 3i5t h SER 230 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3i5t h SER 230 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 3i5t h SER 230 CO 0.11 0.09 0.00 1.23 -1.14 0.00 0.00 176.83 177.12 3i5t h GLY 231 N 0.49 0.00 0.00 -3.77 0.00 -1.59 -3.46 103.07 94.74 3i5t h GLY 231 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3i5t h GLY 231 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 3i5t n GLY 232 N -0.41 1.12 3.53 4.60 0.00 -0.34 -4.80 105.19 108.89 3i5t n GLY 232 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 3i5t n GLY 232 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i5t n VAL 233 N -0.00 -6.88 -3.31 1.61 0.31 -0.67 -4.95 118.33 104.43 3i5t n VAL 233 Ca 0.00 -0.93 -0.40 0.00 -0.01 0.00 0.00 64.34 63.00 3i5t n VAL 233 Cb 0.00 -5.00 -0.08 0.00 -0.91 0.00 0.00 33.84 27.84 3i5t n VAL 233 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3i5t s ILE 234 N -3.37 5.10 -0.35 2.52 1.01 -0.03 -4.89 121.20 121.19 3i5t s ILE 234 Ca 0.40 0.55 -0.10 0.00 0.00 0.00 0.00 60.65 61.51 3i5t s ILE 234 Cb -0.12 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.56 3i5t s ILE 234 CO 0.83 0.02 0.17 -0.63 0.00 0.00 0.00 174.94 175.33 3i5t s ILE 235 N 2.22 4.37 0.59 2.92 1.01 -1.26 -0.74 121.20 130.31 3i5t s ILE 235 Ca 0.17 -0.84 -0.20 0.00 0.00 0.00 0.00 60.65 59.78 3i5t s ILE 235 Cb -0.16 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 3i5t s ILE 235 CO 0.11 -0.16 1.28 -2.65 0.00 0.00 0.00 174.94 173.52 3i5t n PRO 236 N 4.95 1.36 -1.64 2.79 -0.02 -1.26 -4.53 135.00 136.64 3i5t n PRO 236 Ca -0.12 0.51 -0.44 0.00 -2.02 0.00 0.00 63.50 61.43 3i5t n PRO 236 Cb 0.46 -2.51 -0.02 0.00 -0.02 0.00 0.00 33.50 31.42 3i5t n PRO 236 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3i5t n PRO 237 N -1.38 1.75 -1.66 0.52 -0.02 -1.26 -4.83 135.00 128.13 3i5t n PRO 237 Ca 0.13 0.62 -0.47 0.00 -2.02 0.00 0.00 63.50 61.76 3i5t n PRO 237 Cb 0.46 -2.14 -0.04 0.00 -0.02 0.00 0.00 33.50 31.77 3i5t n PRO 237 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i5t n ALA 238 N 0.79 0.91 0.00 3.55 0.00 -1.26 -2.05 120.51 122.44 3i5t n ALA 238 Ca 0.09 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.98 3i5t n ALA 238 Cb 0.32 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.49 3i5t n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i5t n GLY 239 N 2.97 1.85 0.21 0.00 0.00 -1.26 -4.98 105.19 103.98 3i5t n GLY 239 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 3i5t n GLY 239 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3i5t h TYR 240 N 0.00 -0.36 -0.42 1.61 3.20 -1.74 -1.83 116.97 117.42 3i5t h TYR 240 Ca 0.00 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 3i5t h TYR 240 Cb 0.00 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 3i5t h TYR 240 CO 0.00 -0.23 -0.07 0.45 -1.64 0.00 0.00 178.16 176.67 3i5t h HIS 241 N -0.07 0.87 -0.45 -3.82 3.86 -1.85 -1.30 115.15 112.39 3i5t h HIS 241 Ca 0.19 -0.18 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3i5t h HIS 241 Cb 0.37 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 3i5t h HIS 241 CO -0.39 0.89 0.04 0.00 0.86 0.00 0.00 177.93 179.32 3i5t h ALA 242 N 0.87 0.60 -0.59 2.45 0.00 -1.73 -0.60 119.26 120.25 3i5t h ALA 242 Ca 0.11 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 3i5t h ALA 242 Cb 0.58 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3i5t h ALA 242 CO 0.03 0.36 0.03 0.00 0.00 0.00 0.00 179.25 179.67 3i5t h ARG 243 N 0.62 1.03 -0.36 0.00 2.47 -1.16 -1.83 114.38 115.16 3i5t h ARG 243 Ca 0.13 -0.31 -0.17 0.00 -1.26 0.00 0.00 59.98 58.37 3i5t h ARG 243 Cb 0.44 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.66 3i5t h ARG 243 CO 0.02 1.00 -0.44 0.74 0.56 0.00 0.00 179.97 181.85 3i5t h PHE 244 N 0.93 1.13 -0.50 3.04 -1.00 -1.20 -2.88 116.94 116.47 3i5t h PHE 244 Ca 0.17 -0.36 0.03 0.00 2.81 0.00 0.00 57.97 60.63 3i5t h PHE 244 Cb 0.52 -0.23 -0.04 0.00 3.61 0.00 0.00 35.95 39.81 3i5t h PHE 244 CO 0.04 1.19 0.28 -0.22 -1.61 0.00 0.00 178.31 177.99 3i5t h LYS 245 N 0.74 0.53 -0.91 1.51 1.63 -0.96 -0.28 116.57 118.83 3i5t h LYS 245 Ca 0.05 -0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.87 3i5t h LYS 245 Cb 1.04 -0.12 -0.06 0.00 -0.60 0.00 0.00 32.23 32.49 3i5t h LYS 245 CO 0.10 0.35 0.58 0.00 -3.45 0.00 0.00 179.45 177.03 3i5t h ALA 246 N 1.24 1.24 -0.42 5.00 0.00 -1.29 -1.01 119.26 124.03 3i5t h ALA 246 Ca 0.21 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3i5t h ALA 246 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3i5t h ALA 246 CO -0.12 0.37 -0.06 0.82 0.00 0.00 0.00 179.25 180.26 3i5t h ILE 247 N 1.07 1.27 -0.65 0.00 2.04 -1.23 -2.66 117.51 117.35 3i5t h ILE 247 Ca 0.38 -1.14 0.07 0.00 1.00 0.00 0.00 64.86 65.18 3i5t h ILE 247 Cb 0.12 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 3i5t h ILE 247 CO -0.16 0.39 0.34 0.00 0.00 0.00 0.00 178.15 178.72 3i5t h GLU 249 N 0.61 0.34 -0.71 0.00 5.08 -1.12 0.43 114.58 119.21 3i5t h GLU 249 Ca 0.30 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3i5t h GLU 249 Cb 0.25 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3i5t h GLU 249 CO -0.22 0.55 0.41 -0.22 -1.00 0.00 0.00 179.01 178.54 3i5t h LYS 250 N 0.31 0.98 -0.56 2.33 3.64 -1.13 -3.14 116.57 118.99 3i5t h LYS 250 Ca 0.05 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3i5t h LYS 250 Cb 0.57 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3i5t h LYS 250 CO 0.04 0.71 0.00 0.72 -2.27 0.00 0.00 179.45 178.65 3i5t n HIS 251 N -4.51 0.86 -3.57 1.91 8.25 -1.05 -4.97 115.22 112.13 3i5t n HIS 251 Ca 0.06 -0.53 -0.20 0.00 -0.26 0.00 0.00 57.72 56.79 3i5t n HIS 251 Cb 0.07 -0.05 0.05 0.00 1.12 0.00 0.00 29.99 31.18 3i5t n HIS 251 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3i5t n ASP 252 N 1.08 -2.39 -4.56 0.41 2.03 -0.25 -4.89 116.55 107.99 3i5t n ASP 252 Ca 0.20 -0.77 -0.35 0.00 0.52 0.00 0.00 54.79 54.39 3i5t n ASP 252 Cb 0.60 -4.41 -0.11 0.00 -0.72 0.00 0.00 41.12 36.47 3i5t n ASP 252 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3i5t s ILE 253 N -3.54 4.40 0.12 5.18 1.01 0.14 -4.94 121.20 123.56 3i5t s ILE 253 Ca 0.10 -0.17 -0.31 0.00 0.00 0.00 0.00 60.65 60.27 3i5t s ILE 253 Cb -0.02 -2.98 -0.08 0.00 0.01 0.00 0.00 42.46 39.39 3i5t s ILE 253 CO 0.79 0.45 1.42 -0.76 0.00 0.00 0.00 174.94 176.84 3i5t s LEU 254 N 0.58 4.37 -0.39 2.97 1.43 -0.54 -4.44 118.68 122.65 3i5t s LEU 254 Ca 0.01 2.36 -0.16 0.00 -1.03 0.00 0.00 54.13 55.32 3i5t s LEU 254 Cb -0.13 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.51 3i5t s LEU 254 CO 0.02 -0.68 0.35 -0.47 0.23 0.00 0.00 176.35 175.80 3i5t s TYR 255 N 1.19 3.21 -0.38 0.29 6.14 -1.26 -0.55 117.35 125.98 3i5t s TYR 255 Ca 0.66 -0.37 -0.11 0.00 0.64 0.00 0.00 57.07 57.88 3i5t s TYR 255 Cb -0.38 -2.70 0.03 0.00 0.42 0.00 0.00 41.96 39.33 3i5t s TYR 255 CO 0.30 -0.58 0.22 0.42 0.64 0.00 0.00 175.55 176.56 3i5t s ILE 256 N 1.91 4.66 -0.32 3.14 1.01 -0.35 -0.01 121.20 131.23 3i5t s ILE 256 Ca 0.09 -0.87 -0.17 0.00 0.00 0.00 0.00 60.65 59.70 3i5t s ILE 256 Cb -0.18 -3.61 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 3i5t s ILE 256 CO 0.12 -0.27 0.45 -0.55 0.00 0.00 0.00 174.94 174.69 3i5t s SER 257 N 1.59 6.28 -0.69 3.58 0.15 0.16 -1.75 113.70 123.03 3i5t s SER 257 Ca 0.02 0.03 -0.22 0.00 0.70 0.00 0.00 55.95 56.48 3i5t s SER 257 Cb -0.19 -2.24 0.07 0.00 -1.71 0.00 0.00 66.02 61.95 3i5t s SER 257 CO 0.07 -0.37 1.00 -0.62 1.20 0.00 0.00 173.24 174.51 3i5t s ASP 258 N 1.71 6.22 -0.42 5.45 -1.08 -0.11 -2.29 116.67 126.14 3i5t s ASP 258 Ca 0.16 -1.08 0.05 0.00 -0.52 0.00 0.00 52.55 51.17 3i5t s ASP 258 Cb -0.16 -2.42 0.64 0.00 -1.46 0.00 0.00 42.92 39.52 3i5t s ASP 258 CO 0.12 -1.42 1.83 -0.62 0.52 0.00 0.00 175.17 175.60 3i5t n GLU 259 N 7.68 2.17 -0.33 4.34 1.02 -0.03 -4.20 120.64 131.30 3i5t n GLU 259 Ca -0.01 -3.05 0.05 0.00 -0.02 0.00 0.00 57.16 54.14 3i5t n GLU 259 Cb 0.46 -2.11 0.24 0.00 -0.02 0.00 0.00 31.44 30.01 3i5t n GLU 259 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i5t h VAL 260 N 1.00 1.01 0.02 2.62 2.07 -1.86 -0.37 116.25 120.74 3i5t h VAL 260 Ca 0.56 -0.35 -0.33 0.00 0.82 0.00 0.00 66.70 67.41 3i5t h VAL 260 Cb 2.65 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 3i5t h VAL 260 CO 0.97 0.19 -1.81 0.52 0.02 0.00 0.00 177.57 177.46 3i5t n VAL 261 N -4.53 1.58 0.25 2.57 0.31 -1.26 -4.16 118.33 113.09 3i5t n VAL 261 Ca 0.16 -0.28 0.14 0.00 -0.01 0.00 0.00 64.34 64.35 3i5t n VAL 261 Cb 0.26 -1.89 0.57 0.00 -0.91 0.00 0.00 33.84 31.86 3i5t n VAL 261 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3i5t h THR 262 N -0.71 0.24 -4.36 2.52 1.35 -1.84 -3.43 112.91 106.67 3i5t h THR 262 Ca -0.47 -0.79 -0.49 0.00 -0.55 0.00 0.00 66.41 64.11 3i5t h THR 262 Cb 1.57 1.64 0.09 0.00 -1.73 0.00 0.00 68.15 69.72 3i5t h THR 262 CO -0.19 0.09 0.37 -0.83 -0.25 0.00 0.00 175.52 174.71 3i5t s GLY 263 N -4.22 1.64 -1.19 5.82 0.00 -0.15 -3.52 107.32 105.68 3i5t s GLY 263 Ca 0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 44.72 44.53 3i5t s GLY 263 CO 0.59 0.18 0.98 0.69 0.00 0.00 0.00 173.10 175.54 3i5t n PHE 264 N -3.19 -2.20 0.00 1.90 3.72 0.21 -3.90 117.46 113.99 3i5t n PHE 264 Ca 0.07 0.93 0.00 0.00 -0.05 0.00 0.00 57.45 58.40 3i5t n PHE 264 Cb 0.56 -4.98 0.00 0.00 -0.94 0.00 0.00 39.48 34.12 3i5t n PHE 264 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i5t n GLY 265 N -1.16 3.12 0.37 1.37 0.00 -0.10 -4.90 105.19 103.89 3i5t n GLY 265 Ca -0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.86 3i5t n GLY 265 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3i5t h ARG 266 N 2.02 0.78 -0.64 1.61 9.65 -1.68 -0.73 114.38 125.39 3i5t h ARG 266 Ca 0.00 -0.05 -0.36 0.00 -1.10 0.00 0.00 59.98 58.48 3i5t h ARG 266 Cb 0.00 -0.17 -0.21 0.00 -1.39 0.00 0.00 29.97 28.20 3i5t h ARG 266 CO 0.00 0.51 0.18 0.00 2.80 0.00 0.00 179.97 183.47 3i5t n GLY 268 N -1.09 0.78 3.12 0.00 0.00 -0.28 -4.63 105.19 103.10 3i5t n GLY 268 Ca 0.45 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.39 3i5t n GLY 268 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i5t s GLU 269 N -0.01 0.71 0.20 1.61 0.41 -1.26 -4.45 118.70 115.92 3i5t s GLU 269 Ca 0.00 -1.28 -0.10 0.00 -0.41 0.00 0.00 54.97 53.18 3i5t s GLU 269 Cb 0.00 0.05 0.14 0.00 -1.78 0.00 0.00 34.13 32.54 3i5t s GLU 269 CO 0.00 -0.08 1.83 -1.49 -0.49 0.00 0.00 175.26 175.03 3i5t h TRP 270 N 3.06 0.98 -3.44 1.61 4.06 -1.92 -0.23 115.95 120.07 3i5t h TRP 270 Ca -0.35 -0.01 -0.39 0.00 2.06 0.00 0.00 58.89 60.20 3i5t h TRP 270 Cb 1.15 -0.32 -0.35 0.00 -1.00 0.00 0.00 29.16 28.65 3i5t h TRP 270 CO 0.55 0.67 -0.76 -0.06 -3.56 0.00 0.00 178.44 175.27 3i5t s PHE 271 N -5.93 0.58 -0.08 0.49 0.40 -1.26 0.64 117.98 112.81 3i5t s PHE 271 Ca -0.13 -0.12 0.21 0.00 -0.60 0.00 0.00 56.93 56.28 3i5t s PHE 271 Cb 0.15 -0.59 0.50 0.00 0.51 0.00 0.00 43.02 43.58 3i5t s PHE 271 CO 0.79 -0.19 1.64 0.00 0.70 0.00 0.00 175.22 178.17 3i5t h ALA 272 N 7.38 0.88 -0.22 5.36 0.00 -1.81 -3.38 119.26 127.47 3i5t h ALA 272 Ca -0.37 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.32 3i5t h ALA 272 Cb 1.14 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 3i5t h ALA 272 CO 0.44 0.36 -0.51 0.77 0.00 0.00 0.00 179.25 180.31 3i5t h SER 273 N 0.00 -1.65 0.00 0.00 0.02 -1.96 -1.19 113.55 108.77 3i5t h SER 273 Ca -0.00 0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 61.03 3i5t h SER 273 Cb 1.03 0.66 -0.02 0.00 0.14 0.00 0.00 62.40 64.21 3i5t h SER 273 CO 0.04 -0.42 -0.66 -0.08 -1.14 0.00 0.00 176.83 174.57 3i5t h GLU 274 N -0.48 0.00 -0.23 3.45 4.81 -1.60 -0.18 114.58 120.35 3i5t h GLU 274 Ca 0.04 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3i5t h GLU 274 Cb 0.60 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 3i5t h GLU 274 CO -0.46 0.99 -0.29 0.87 -0.73 0.00 0.00 179.01 179.39 3i5t h LYS 275 N -1.00 0.46 0.01 1.92 1.57 -1.74 -1.63 116.57 116.15 3i5t h LYS 275 Ca -0.18 -0.18 -0.42 0.00 -1.87 0.00 0.00 60.65 58.00 3i5t h LYS 275 Cb 1.15 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.37 3i5t h LYS 275 CO -0.11 0.71 -2.35 0.28 -0.57 0.00 0.00 179.45 177.41 3i5t n VAL 276 N -4.10 1.53 0.27 0.50 0.31 -0.55 -4.77 118.33 111.53 3i5t n VAL 276 Ca -0.01 -0.39 0.07 0.00 -0.01 0.00 0.00 64.34 64.00 3i5t n VAL 276 Cb 0.43 -1.80 0.11 0.00 -0.91 0.00 0.00 33.84 31.66 3i5t n VAL 276 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3i5t n PHE 277 N -4.03 0.21 -1.32 3.52 3.72 -0.63 -5.00 117.46 113.93 3i5t n PHE 277 Ca -0.49 -0.19 -0.06 0.00 -0.05 0.00 0.00 57.45 56.66 3i5t n PHE 277 Cb 0.89 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 39.40 3i5t n PHE 277 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i5t n GLY 278 N 0.76 0.71 3.16 1.37 0.00 -0.60 -4.36 105.19 106.23 3i5t n GLY 278 Ca 0.10 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 3i5t n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i5t s VAL 279 N -2.23 1.88 -0.55 1.61 0.11 -0.18 -4.35 120.40 116.69 3i5t s VAL 279 Ca 0.00 -0.89 -0.19 0.00 -2.93 0.00 0.00 61.98 57.97 3i5t s VAL 279 Cb 0.00 -1.66 0.08 0.00 -1.53 0.00 0.00 36.38 33.27 3i5t s VAL 279 CO 0.00 0.52 0.66 -0.69 -3.33 0.00 0.00 175.10 172.26 3i5t s VAL 280 N 0.66 4.85 0.98 2.04 1.01 -1.26 -1.92 120.40 126.76 3i5t s VAL 280 Ca -0.12 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 3i5t s VAL 280 Cb -0.16 -4.40 0.18 0.00 0.00 0.00 0.00 36.38 32.00 3i5t s VAL 280 CO 0.03 -0.97 1.17 -2.84 0.00 0.00 0.00 175.10 172.48 3i5t s PRO 281 N 2.66 0.52 -0.06 2.72 0.02 -1.26 -4.99 135.00 134.61 3i5t s PRO 281 Ca 0.13 0.08 0.01 0.00 0.02 0.00 0.00 61.00 61.24 3i5t s PRO 281 Cb -0.22 -1.79 -0.26 0.00 0.02 0.00 0.00 34.50 32.26 3i5t s PRO 281 CO 0.09 -2.58 0.61 -0.44 -0.33 0.00 0.00 177.00 174.36 3i5t h ASP 282 N -1.77 0.27 -3.78 2.53 5.19 -0.81 -3.46 116.42 114.59 3i5t h ASP 282 Ca -0.48 -0.51 -0.28 0.00 -0.62 0.00 0.00 57.03 55.14 3i5t h ASP 282 Cb 1.31 -0.09 -0.29 0.00 0.18 0.00 0.00 39.33 40.44 3i5t h ASP 282 CO 0.51 1.45 -0.74 -0.63 -3.12 0.00 0.00 179.24 176.72 3i5t s ILE 283 N -2.59 0.19 -0.12 0.35 1.01 -0.86 -1.57 121.20 117.62 3i5t s ILE 283 Ca -0.12 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.47 3i5t s ILE 283 Cb 0.07 -0.18 -0.00 0.00 0.01 0.00 0.00 42.46 42.36 3i5t s ILE 283 CO 0.81 0.06 -0.20 -0.63 0.00 0.00 0.00 174.94 174.99 3i5t s ILE 284 N 0.06 2.40 0.04 2.92 1.01 -0.57 -0.66 121.20 126.39 3i5t s ILE 284 Ca -0.00 -0.89 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 3i5t s ILE 284 Cb -0.02 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 3i5t s ILE 284 CO -0.00 0.55 0.18 0.42 0.00 0.00 0.00 174.94 176.09 3i5t s THR 285 N 0.40 5.29 0.11 2.92 -4.23 -0.97 0.02 115.64 119.19 3i5t s THR 285 Ca -0.15 -0.36 -0.10 0.00 -1.18 0.00 0.00 61.69 59.90 3i5t s THR 285 Cb -0.17 -3.54 0.00 0.00 1.34 0.00 0.00 72.50 70.13 3i5t s THR 285 CO 0.07 0.20 0.25 0.72 -0.54 0.00 0.00 174.62 175.32 3i5t s PHE 286 N -1.43 0.16 0.00 3.99 -0.71 -0.26 -0.85 117.98 118.87 3i5t s PHE 286 Ca 0.32 -0.55 0.00 0.00 -1.04 0.00 0.00 56.93 55.65 3i5t s PHE 286 Cb -0.13 -0.01 0.00 0.00 -1.21 0.00 0.00 43.02 41.68 3i5t s PHE 286 CO 0.24 -0.61 0.00 0.00 -1.34 0.00 0.00 175.22 173.51 3i5t n ALA 287 N -0.13 0.00 -0.37 1.99 0.00 -1.26 -1.45 120.51 119.29 3i5t n ALA 287 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3i5t n ALA 287 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 3i5t n ALA 287 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i5t n LYS 288 N 0.00 0.00 0.28 0.00 5.02 -1.25 -1.49 118.16 120.72 3i5t n LYS 288 Ca 0.00 0.00 0.17 0.00 -2.02 0.00 0.00 58.31 56.46 3i5t n LYS 288 Cb 0.00 0.00 0.82 0.00 -0.02 0.00 0.00 35.03 35.83 3i5t n LYS 288 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3i5t h GLY 289 N 0.00 0.00 0.75 0.72 0.00 -1.77 -2.42 103.07 100.35 3i5t h GLY 289 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.47 3i5t h GLY 289 CO 0.00 0.00 0.49 -0.24 0.00 0.00 0.00 176.54 176.79 3i5t h VAL 290 N 0.00 0.83 -0.00 4.60 3.04 -1.59 -2.13 116.25 120.99 3i5t h VAL 290 Ca 0.04 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 3i5t h VAL 290 Cb 0.72 0.33 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 3i5t h VAL 290 CO -0.00 0.08 0.00 0.35 -1.01 0.00 0.00 177.57 176.99 3i5t n THR 291 N -4.48 0.96 -2.52 3.17 -2.24 -1.06 -4.41 114.28 103.70 3i5t n THR 291 Ca 0.14 -0.98 -0.17 0.00 -2.27 0.00 0.00 64.05 60.77 3i5t n THR 291 Cb 0.48 0.52 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 3i5t n THR 291 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3i5t n SER 292 N -0.47 -4.83 -0.09 3.42 7.64 -0.80 -2.09 113.62 116.40 3i5t n SER 292 Ca 0.00 0.04 -0.01 0.00 1.01 0.00 0.00 58.87 59.92 3i5t n SER 292 Cb 0.24 -4.04 -0.00 0.00 -1.01 0.00 0.00 64.21 59.40 3i5t n SER 292 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i5t n GLY 293 N -0.96 0.31 0.21 0.23 0.00 -0.94 -3.84 105.19 100.20 3i5t n GLY 293 Ca -0.18 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 3i5t n GLY 293 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3i5t h TYR 294 N 0.00 0.84 -3.79 1.61 -1.99 -1.73 -3.46 116.97 108.45 3i5t h TYR 294 Ca -0.02 -0.35 -0.14 0.00 2.00 0.00 0.00 58.73 60.21 3i5t h TYR 294 Cb 0.61 -0.14 -0.19 0.00 2.00 0.00 0.00 36.73 39.02 3i5t h TYR 294 CO 0.37 1.14 -0.56 0.14 -0.00 0.00 0.00 178.16 179.25 3i5t s VAL 295 N -3.77 0.12 0.03 -2.88 -7.23 -1.26 -5.13 120.40 100.27 3i5t s VAL 295 Ca -0.08 -0.99 -0.30 0.00 -1.81 0.00 0.00 61.98 58.80 3i5t s VAL 295 Cb 0.10 -0.67 -0.08 0.00 0.56 0.00 0.00 36.38 36.28 3i5t s VAL 295 CO 0.87 -0.55 1.87 -2.84 -0.31 0.00 0.00 175.10 174.14 3i5t s PRO 296 N -2.12 4.15 -0.07 4.82 0.02 -1.26 -4.77 135.00 135.76 3i5t s PRO 296 Ca -0.09 2.50 -0.10 0.00 0.02 0.00 0.00 61.00 63.33 3i5t s PRO 296 Cb -0.04 -4.04 0.02 0.00 0.02 0.00 0.00 34.50 30.46 3i5t s PRO 296 CO -0.02 -0.91 0.26 -1.17 -0.33 0.00 0.00 177.00 174.83 3i5t s LEU 297 N 4.11 1.01 0.30 -5.54 2.96 -1.22 -4.81 118.68 115.49 3i5t s LEU 297 Ca 0.83 0.38 0.03 0.00 -0.22 0.00 0.00 54.13 55.15 3i5t s LEU 297 Cb -0.41 0.96 -0.02 0.00 0.50 0.00 0.00 46.19 47.22 3i5t s LEU 297 CO 0.38 -0.19 0.29 -0.83 -1.32 0.00 0.00 176.35 174.69 3i5t s GLY 298 N -0.28 1.90 0.00 7.98 0.00 -0.31 -3.93 107.32 112.66 3i5t s GLY 298 Ca -0.04 -1.83 0.00 0.00 0.00 0.00 0.00 44.72 42.85 3i5t s GLY 298 CO 0.01 -1.33 0.00 0.61 0.00 0.00 0.00 173.10 172.40 3i5t n GLY 299 N -0.52 -1.67 2.88 0.20 0.00 -0.53 -0.73 105.19 104.82 3i5t n GLY 299 Ca 0.05 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 3i5t n GLY 299 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3i5t s LEU 300 N 0.00 1.46 -0.24 0.99 2.34 -0.21 -1.11 118.68 121.91 3i5t s LEU 300 Ca 0.00 0.11 -0.12 0.00 0.06 0.00 0.00 54.13 54.18 3i5t s LEU 300 Cb 0.00 0.13 -0.05 0.00 -0.56 0.00 0.00 46.19 45.71 3i5t s LEU 300 CO 0.00 -0.07 0.22 0.00 -1.06 0.00 0.00 176.35 175.44 3i5t s ALA 301 N 0.47 3.58 -0.11 1.48 0.00 0.10 -1.57 121.76 125.72 3i5t s ALA 301 Ca -0.04 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.06 3i5t s ALA 301 Cb -0.05 -2.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.62 3i5t s ALA 301 CO -0.02 -0.32 -0.13 0.42 0.00 0.00 0.00 175.76 175.71 3i5t s ILE 302 N 1.31 3.06 0.14 0.00 1.01 0.12 -1.52 121.20 125.32 3i5t s ILE 302 Ca 0.10 -0.68 -0.34 0.00 0.00 0.00 0.00 60.65 59.73 3i5t s ILE 302 Cb -0.14 -2.26 -0.15 0.00 0.01 0.00 0.00 42.46 39.92 3i5t s ILE 302 CO 0.07 0.54 1.45 -0.24 0.00 0.00 0.00 174.94 176.76 3i5t n SER 303 N 3.24 2.43 -0.25 3.58 2.88 -0.61 -3.06 113.62 121.83 3i5t n SER 303 Ca -0.18 1.11 -0.03 0.00 -1.33 0.00 0.00 58.87 58.43 3i5t n SER 303 Cb 0.53 -1.33 0.08 0.00 -0.75 0.00 0.00 64.21 62.73 3i5t n SER 303 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3i5t h GLU 304 N 5.08 0.82 -0.38 -1.46 4.81 -1.46 -2.31 114.58 119.69 3i5t h GLU 304 Ca -0.46 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 58.66 3i5t h GLU 304 Cb 1.29 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 3i5t h GLU 304 CO 0.82 0.54 -0.05 0.00 -0.73 0.00 0.00 179.01 179.60 3i5t h ALA 305 N 1.30 1.21 0.00 2.92 0.00 -1.91 -0.75 119.26 122.03 3i5t h ALA 305 Ca 0.28 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3i5t h ALA 305 Cb 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3i5t h ALA 305 CO -0.11 0.52 -0.00 0.28 0.00 0.00 0.00 179.25 179.94 3i5t h VAL 306 N 0.59 1.10 -0.19 0.00 2.07 -1.89 -3.17 116.25 114.76 3i5t h VAL 306 Ca 0.12 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 3i5t h VAL 306 Cb 0.44 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 3i5t h VAL 306 CO 0.02 0.08 -0.16 -0.07 0.02 0.00 0.00 177.57 177.46 3i5t h LEU 307 N -0.13 0.30 -1.75 2.57 3.38 -1.08 -2.85 115.31 115.75 3i5t h LEU 307 Ca -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3i5t h LEU 307 Cb 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3i5t h LEU 307 CO 0.00 0.49 0.08 0.00 0.09 0.00 0.00 178.44 179.09 3i5t h ALA 308 N 1.55 1.81 0.00 1.53 0.00 -1.11 -2.29 119.26 120.74 3i5t h ALA 308 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3i5t h ALA 308 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3i5t h ALA 308 CO 0.03 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.44 3i5t h ARG 309 N 0.24 0.00 0.00 0.00 3.08 -1.51 -3.14 114.38 113.05 3i5t h ARG 309 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3i5t h ARG 309 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3i5t h ARG 309 CO -0.01 0.00 -0.17 0.44 -1.07 0.00 0.00 179.97 179.17 3i5t n ILE 310 N -2.65 1.21 -4.19 2.04 -5.35 -0.88 -4.82 119.36 104.73 3i5t n ILE 310 Ca 0.01 -1.45 -0.11 0.00 -0.27 0.00 0.00 62.75 60.93 3i5t n ILE 310 Cb 0.24 0.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.08 3i5t n ILE 310 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3i5t s SER 311 N -2.16 0.29 1.52 7.28 1.04 -1.07 -3.98 113.70 116.63 3i5t s SER 311 Ca 0.20 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.32 3i5t s SER 311 Cb 0.17 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.62 3i5t s SER 311 CO 0.02 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.06 3i5t n GLY 312 N -0.21 2.99 0.02 7.32 0.00 -1.26 -1.69 105.19 112.36 3i5t n GLY 312 Ca -0.01 -0.21 0.09 0.00 0.00 0.00 0.00 46.02 45.89 3i5t n GLY 312 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i5t n GLU 313 N 13.04 0.04 -0.30 1.61 1.02 -1.26 -2.90 120.64 131.89 3i5t n GLU 313 Ca 0.00 0.23 0.10 0.00 -0.02 0.00 0.00 57.16 57.46 3i5t n GLU 313 Cb 0.00 -1.57 0.26 0.00 -0.02 0.00 0.00 31.44 30.11 3i5t n GLU 313 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3i5t n ASN 314 N -1.65 3.60 0.04 1.62 3.02 -0.68 -4.69 115.26 116.52 3i5t n ASN 314 Ca 0.04 -2.00 -0.06 0.00 -0.03 0.00 0.00 54.58 52.53 3i5t n ASN 314 Cb 0.22 -0.40 0.12 0.00 -0.61 0.00 0.00 39.78 39.11 3i5t n ASN 314 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i5t h ALA 315 N 3.57 0.85 -5.18 5.41 0.00 -1.61 -3.34 119.26 118.96 3i5t h ALA 315 Ca 0.00 -0.48 -0.41 0.00 0.00 0.00 0.00 54.91 54.02 3i5t h ALA 315 Cb 0.91 -0.09 0.06 0.00 0.00 0.00 0.00 17.79 18.66 3i5t h ALA 315 CO 0.00 0.67 -0.64 1.63 0.00 0.00 0.00 179.25 180.91 3i5t n LYS 316 N -3.97 -5.73 -2.70 0.00 4.76 -1.26 -2.58 118.16 106.69 3i5t n LYS 316 Ca -0.02 0.81 -0.21 0.00 -2.87 0.00 0.00 58.31 56.02 3i5t n LYS 316 Cb 0.56 -5.72 0.01 0.00 -1.84 0.00 0.00 35.03 28.05 3i5t n LYS 316 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i5t n GLY 317 N -1.65 -0.48 3.93 0.72 0.00 -1.26 -4.99 105.19 101.45 3i5t n GLY 317 Ca -0.05 0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3i5t n GLY 317 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i5t s SER 318 N -2.40 6.38 -0.04 1.61 1.04 -1.06 -5.10 113.70 114.12 3i5t s SER 318 Ca 0.15 0.46 0.00 0.00 0.48 0.00 0.00 55.95 57.04 3i5t s SER 318 Cb -0.07 -2.03 0.02 0.00 0.10 0.00 0.00 66.02 64.05 3i5t s SER 318 CO 0.18 -0.12 -0.02 0.26 0.98 0.00 0.00 173.24 174.53 3i5t s TRP 319 N -1.99 0.59 -1.38 5.02 0.52 -1.26 -5.06 118.94 115.37 3i5t s TRP 319 Ca 0.40 -0.13 -0.15 0.00 0.02 0.00 0.00 56.10 56.24 3i5t s TRP 319 Cb -0.11 -0.61 0.06 0.00 -1.15 0.00 0.00 33.47 31.67 3i5t s TRP 319 CO 0.30 -0.20 1.99 0.34 0.02 0.00 0.00 176.95 179.40 3i5t n PHE 320 N 4.31 4.00 -1.01 -1.98 -0.00 -1.26 -4.84 117.46 116.68 3i5t n PHE 320 Ca -0.22 -2.93 -0.25 0.00 -0.00 0.00 0.00 57.45 54.05 3i5t n PHE 320 Cb 0.50 -2.54 -0.06 0.00 -0.00 0.00 0.00 39.48 37.38 3i5t n PHE 320 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 3i5t n THR 321 N 5.49 3.27 -4.62 -2.13 -2.24 -1.26 -4.74 114.28 108.04 3i5t n THR 321 Ca 0.50 -1.87 -0.23 0.00 -2.27 0.00 0.00 64.05 60.18 3i5t n THR 321 Cb 0.42 -2.27 -0.15 0.00 -2.10 0.00 0.00 70.33 66.22 3i5t n THR 321 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3i5t s ASN 322 N 2.48 1.64 0.00 3.42 2.47 -1.26 -5.14 114.94 118.55 3i5t s ASN 322 Ca 0.58 -0.26 0.00 0.00 0.42 0.00 0.00 52.86 53.60 3i5t s ASN 322 Cb 0.19 -0.30 0.00 0.00 -1.45 0.00 0.00 41.25 39.69 3i5t s ASN 322 CO -0.03 0.14 0.00 0.61 -3.72 0.00 0.00 177.10 174.10 3i5t n GLY 323 N 2.95 2.45 3.62 1.21 0.00 -1.26 -5.17 105.19 108.99 3i5t n GLY 323 Ca -0.16 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 3i5t n GLY 323 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i5t s TYR 324 N -2.00 2.71 0.23 1.61 1.51 -1.26 -5.02 117.35 115.12 3i5t s TYR 324 Ca 0.00 -0.20 -0.08 0.00 -1.01 0.00 0.00 57.07 55.78 3i5t s TYR 324 Cb 0.00 -1.27 0.22 0.00 -0.11 0.00 0.00 41.96 40.80 3i5t s TYR 324 CO 0.00 0.56 1.89 1.15 -1.11 0.00 0.00 175.55 178.04 3i5t h THR 325 N 2.34 1.19 -0.52 -0.71 2.02 -2.01 -2.07 112.91 113.15 3i5t h THR 325 Ca -0.46 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.33 3i5t h THR 325 Cb 1.22 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3i5t h THR 325 CO 0.58 0.20 0.01 -1.22 0.37 0.00 0.00 175.52 175.46 3i5t n TYR 326 N -4.51 1.87 -1.92 3.16 4.01 -1.26 -4.70 117.16 113.81 3i5t n TYR 326 Ca 0.10 -0.66 -0.41 0.00 -0.16 0.00 0.00 57.90 56.77 3i5t n TYR 326 Cb 0.04 -0.48 -0.02 0.00 -0.31 0.00 0.00 39.34 38.58 3i5t n TYR 326 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3i5t s SER 327 N -0.69 6.53 -1.88 7.72 0.01 -0.78 -2.83 113.70 121.79 3i5t s SER 327 Ca 0.48 2.83 0.00 0.00 1.31 0.00 0.00 55.95 60.57 3i5t s SER 327 Cb 0.37 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.96 3i5t s SER 327 CO 0.14 -0.77 0.00 0.59 0.41 0.00 0.00 173.24 173.61 3i5t n ASN 328 N 1.63 -5.52 -4.70 2.44 4.13 -1.26 -4.50 115.26 107.48 3i5t n ASN 328 Ca 0.05 0.21 -0.42 0.00 1.68 0.00 0.00 54.58 56.10 3i5t n ASN 328 Cb 0.39 -4.72 -0.03 0.00 -1.54 0.00 0.00 39.78 33.89 3i5t n ASN 328 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 3i5t s GLN 329 N -4.48 4.20 0.34 3.52 0.74 -1.13 -4.68 119.66 118.17 3i5t s GLN 329 Ca 0.00 2.37 0.03 0.00 0.05 0.00 0.00 55.36 57.81 3i5t s GLN 329 Cb 0.00 -3.40 0.60 0.00 1.10 0.00 0.00 33.01 31.32 3i5t s GLN 329 CO 0.00 -0.69 1.93 -1.35 -0.55 0.00 0.00 175.29 174.63 3i5t h PRO 330 N 7.67 0.67 -0.18 1.67 0.11 -1.85 -2.26 132.00 137.82 3i5t h PRO 330 Ca -0.43 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 3i5t h PRO 330 Cb 1.20 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3i5t h PRO 330 CO 0.93 0.57 0.03 0.28 -0.21 0.00 0.00 178.00 179.59 3i5t h VAL 331 N 0.67 1.22 -0.27 3.15 2.07 -1.82 0.60 116.25 121.87 3i5t h VAL 331 Ca 0.16 -0.73 -0.14 0.00 0.82 0.00 0.00 66.70 66.81 3i5t h VAL 331 Cb 0.16 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3i5t h VAL 331 CO -0.01 0.22 -0.42 0.00 0.02 0.00 0.00 177.57 177.38 3i5t h ALA 332 N 0.83 0.76 -0.30 1.67 0.00 -1.86 -2.09 119.26 118.25 3i5t h ALA 332 Ca 0.06 -0.45 -0.13 0.00 0.00 0.00 0.00 54.91 54.38 3i5t h ALA 332 Cb 0.31 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3i5t h ALA 332 CO 0.00 0.66 -0.35 0.00 0.00 0.00 0.00 179.25 179.56 3i5t h ALA 334 N 1.03 0.82 -0.52 0.00 0.00 -0.78 -1.59 119.26 118.22 3i5t h ALA 334 Ca 0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3i5t h ALA 334 Cb 0.87 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3i5t h ALA 334 CO 0.08 0.54 0.22 0.00 0.00 0.00 0.00 179.25 180.09 3i5t h ALA 335 N 1.05 0.68 -0.64 0.00 0.00 -1.29 -1.47 119.26 117.59 3i5t h ALA 335 Ca 0.20 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3i5t h ALA 335 Cb 0.36 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3i5t h ALA 335 CO 0.00 0.28 0.20 0.00 0.00 0.00 0.00 179.25 179.73 3i5t h ALA 336 N 1.07 0.84 -0.53 0.00 0.00 -1.27 0.36 119.26 119.73 3i5t h ALA 336 Ca 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3i5t h ALA 336 Cb 0.18 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3i5t h ALA 336 CO -0.02 0.52 0.30 1.25 0.00 0.00 0.00 179.25 181.30 3i5t h LEU 337 N 0.93 0.66 -0.67 0.00 5.85 -1.12 0.46 115.31 121.41 3i5t h LEU 337 Ca 0.21 -0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3i5t h LEU 337 Cb 0.29 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3i5t h LEU 337 CO -0.01 0.55 0.19 0.00 -0.34 0.00 0.00 178.44 178.83 3i5t h ALA 338 N 1.14 0.88 0.25 1.25 0.00 -1.04 -1.47 119.26 120.27 3i5t h ALA 338 Ca 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3i5t h ALA 338 Cb 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3i5t h ALA 338 CO -0.03 0.58 -0.25 -0.97 0.00 0.00 0.00 179.25 178.58 3i5t h ASN 339 N 0.99 -0.68 -0.77 0.00 -1.24 -0.43 -0.61 115.58 112.85 3i5t h ASN 339 Ca 0.21 0.06 -0.02 0.00 0.71 0.00 0.00 56.30 57.26 3i5t h ASN 339 Cb 0.33 0.23 -0.04 0.00 0.73 0.00 0.00 38.32 39.58 3i5t h ASN 339 CO -0.00 -0.37 0.39 0.40 -1.29 0.00 0.00 177.43 176.56 3i5t h ILE 340 N -0.54 1.24 -0.61 2.57 2.04 -0.87 -0.25 117.51 121.10 3i5t h ILE 340 Ca -0.01 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 3i5t h ILE 340 Cb 0.50 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 3i5t h ILE 340 CO -0.06 0.28 0.26 -0.33 0.00 0.00 0.00 178.15 178.30 3i5t h GLU 341 N 1.07 0.89 -0.28 2.37 3.07 -1.23 0.82 114.58 121.30 3i5t h GLU 341 Ca 0.27 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 3i5t h GLU 341 Cb 0.09 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 3i5t h GLU 341 CO -0.04 0.75 0.18 1.25 -1.40 0.00 0.00 179.01 179.75 3i5t h LEU 342 N 0.84 0.33 -1.33 1.33 5.85 -0.78 0.64 115.31 122.18 3i5t h LEU 342 Ca 0.20 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3i5t h LEU 342 Cb 0.18 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3i5t h LEU 342 CO -0.02 0.26 0.25 0.24 -0.34 0.00 0.00 178.44 178.82 3i5t h MET 343 N 0.36 0.70 0.26 1.25 2.86 -0.81 -1.60 114.93 117.95 3i5t h MET 343 Ca 0.10 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3i5t h MET 343 Cb -0.02 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.51 3i5t h MET 343 CO -0.02 0.54 -0.12 1.49 1.06 0.00 0.00 176.91 179.86 3i5t h GLU 344 N 0.71 -0.33 -0.63 1.72 4.81 -0.62 0.53 114.58 120.77 3i5t h GLU 344 Ca 0.18 0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.56 3i5t h GLU 344 Cb 0.07 0.08 -0.10 0.00 0.63 0.00 0.00 28.75 29.42 3i5t h GLU 344 CO -0.02 0.02 0.03 -0.09 -0.73 0.00 0.00 179.01 178.21 3i5t h ARG 345 N -0.79 0.14 -0.66 1.92 2.43 -0.67 -2.18 114.38 114.57 3i5t h ARG 345 Ca -0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3i5t h ARG 345 Cb 0.51 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3i5t h ARG 345 CO 0.06 0.09 0.00 0.39 -1.51 0.00 0.00 179.97 179.00 3i5t n GLU 346 N -5.26 3.38 -4.12 0.20 1.02 -0.62 -4.96 120.64 110.29 3i5t n GLU 346 Ca 0.10 -2.65 -0.29 0.00 -0.02 0.00 0.00 57.16 54.29 3i5t n GLU 346 Cb 0.36 -1.80 -0.05 0.00 -0.02 0.00 0.00 31.44 29.94 3i5t n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i5t n GLY 347 N 1.20 -0.24 0.22 0.62 0.00 -0.82 -4.85 105.19 101.32 3i5t n GLY 347 Ca 0.24 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.32 3i5t n GLY 347 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3i5t h ILE 348 N -1.73 1.31 -0.45 -0.61 2.04 -1.18 0.21 117.51 117.10 3i5t h ILE 348 Ca -0.63 -1.68 -0.01 0.00 1.00 0.00 0.00 64.86 63.54 3i5t h ILE 348 Cb 1.38 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 3i5t h ILE 348 CO 0.68 0.53 0.25 0.58 0.00 0.00 0.00 178.15 180.20 3i5t h VAL 349 N 0.46 1.16 -0.55 1.67 2.07 -1.91 -0.83 116.25 118.32 3i5t h VAL 349 Ca 0.03 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 3i5t h VAL 349 Cb 1.00 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 3i5t h VAL 349 CO 0.09 0.16 0.34 0.44 0.02 0.00 0.00 177.57 178.63 3i5t h ASP 350 N 0.59 0.65 -0.49 0.57 3.32 -1.72 -1.81 116.42 117.54 3i5t h ASP 350 Ca 0.16 -0.05 0.07 0.00 0.02 0.00 0.00 57.03 57.23 3i5t h ASP 350 Cb 0.04 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.37 3i5t h ASP 350 CO -0.03 0.51 0.17 1.56 -1.72 0.00 0.00 179.24 179.73 3i5t h GLN 351 N 0.74 0.33 -0.78 3.56 4.20 -0.22 -0.22 115.11 122.72 3i5t h GLN 351 Ca 0.20 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 3i5t h GLN 351 Cb -0.04 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.63 3i5t h GLN 351 CO -0.04 0.22 0.42 0.00 -0.67 0.00 0.00 178.83 178.76 3i5t h ALA 352 N 1.33 1.01 -0.52 3.87 0.00 -0.92 -1.57 119.26 122.46 3i5t h ALA 352 Ca 0.24 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3i5t h ALA 352 Cb 0.25 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3i5t h ALA 352 CO -0.25 0.53 0.03 -0.09 0.00 0.00 0.00 179.25 179.47 3i5t h ARG 353 N 1.09 0.86 0.00 0.00 2.43 -0.83 -2.47 114.38 115.46 3i5t h ARG 353 Ca 0.27 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3i5t h ARG 353 Cb 0.05 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3i5t h ARG 353 CO -0.04 0.84 0.00 0.93 -1.51 0.00 0.00 179.97 180.19 3i5t h GLU 354 N 0.81 0.00 0.00 0.20 4.39 -0.70 -3.23 114.58 116.05 3i5t h GLU 354 Ca 0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.86 3i5t h GLU 354 Cb 0.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 3i5t h GLU 354 CO 0.02 0.00 -1.12 -0.12 -1.16 0.00 0.00 179.01 176.63 3i5t n MET 355 N -2.94 0.21 -0.10 2.33 1.56 -0.62 -4.58 117.12 112.98 3i5t n MET 355 Ca 0.04 -0.03 -0.05 0.00 -0.27 0.00 0.00 57.70 57.38 3i5t n MET 355 Cb 0.47 -1.54 0.01 0.00 2.15 0.00 0.00 33.22 34.31 3i5t n MET 355 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3i5t h ALA 356 N 2.67 0.30 -0.66 -5.12 0.00 -1.46 -0.47 119.26 114.52 3i5t h ALA 356 Ca 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3i5t h ALA 356 Cb 0.67 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3i5t h ALA 356 CO 0.00 -0.42 0.11 -0.44 0.00 0.00 0.00 179.25 178.50 3i5t h ASP 357 N 0.07 1.04 -0.45 0.00 3.45 -1.81 -0.42 116.42 118.30 3i5t h ASP 357 Ca 0.18 -0.26 -0.06 0.00 0.43 0.00 0.00 57.03 57.32 3i5t h ASP 357 Cb 0.25 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 3i5t h ASP 357 CO -0.32 1.03 0.08 0.22 -1.57 0.00 0.00 179.24 178.68 3i5t h TYR 358 N 1.00 0.85 0.10 4.55 3.20 -1.76 -1.41 116.97 123.51 3i5t h TYR 358 Ca 0.20 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 3i5t h TYR 358 Cb 0.43 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.46 3i5t h TYR 358 CO 0.03 0.75 -0.05 0.35 -1.64 0.00 0.00 178.16 177.60 3i5t h PHE 359 N 0.78 -0.13 -0.55 -3.82 3.57 -0.73 -0.88 116.94 115.17 3i5t h PHE 359 Ca 0.16 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.72 3i5t h PHE 359 Cb 0.36 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 3i5t h PHE 359 CO 0.02 0.11 0.26 0.00 -2.23 0.00 0.00 178.31 176.47 3i5t h ALA 360 N 0.52 0.71 -0.23 2.41 0.00 -1.02 -1.71 119.26 119.96 3i5t h ALA 360 Ca -0.01 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 3i5t h ALA 360 Cb 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3i5t h ALA 360 CO 0.02 -0.10 -0.46 0.00 0.00 0.00 0.00 179.25 178.71 3i5t h ALA 361 N 1.32 0.77 -0.52 0.00 0.00 -1.25 -1.46 119.26 118.12 3i5t h ALA 361 Ca 0.26 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3i5t h ALA 361 Cb 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3i5t h ALA 361 CO -0.20 0.66 0.09 0.00 0.00 0.00 0.00 179.25 179.80 3i5t h ALA 362 N 1.03 0.70 -0.71 0.00 0.00 -0.97 -2.74 119.26 116.56 3i5t h ALA 362 Ca 0.03 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3i5t h ALA 362 Cb 0.98 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3i5t h ALA 362 CO 0.09 0.43 0.32 -0.07 0.00 0.00 0.00 179.25 180.02 3i5t h LEU 363 N 0.75 0.94 -2.61 0.00 3.38 -1.25 -2.95 115.31 113.58 3i5t h LEU 363 Ca 0.16 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3i5t h LEU 363 Cb 0.40 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3i5t h LEU 363 CO 0.01 0.83 -0.01 0.00 0.09 0.00 0.00 178.44 179.36 3i5t h ALA 364 N 1.15 1.09 0.00 1.53 0.00 -1.11 -1.89 119.26 120.03 3i5t h ALA 364 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3i5t h ALA 364 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3i5t h ALA 364 CO -0.03 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.11 3i5t n SER 365 N -3.23 0.00 0.06 0.00 3.41 -1.05 -2.12 113.62 110.69 3i5t n SER 365 Ca -0.02 0.32 0.13 0.00 -0.26 0.00 0.00 58.87 59.04 3i5t n SER 365 Cb 0.12 -0.42 0.30 0.00 -0.26 0.00 0.00 64.21 63.95 3i5t n SER 365 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3i5t n LEU 366 N -1.42 0.63 0.14 1.04 4.77 -0.71 -3.97 117.00 117.48 3i5t n LEU 366 Ca 0.06 0.34 0.12 0.00 -0.03 0.00 0.00 56.01 56.50 3i5t n LEU 366 Cb 0.20 -0.27 0.52 0.00 -2.33 0.00 0.00 43.42 41.54 3i5t n LEU 366 CO 0.17 -0.06 0.85 0.54 -1.33 0.00 0.00 177.39 177.56 3i5t n ARG 367 N -2.01 0.19 -0.17 3.23 1.74 -0.90 -1.63 116.66 117.11 3i5t n ARG 367 Ca 0.05 0.47 0.16 0.00 -0.77 0.00 0.00 57.85 57.76 3i5t n ARG 367 Cb 0.41 -1.90 0.52 0.00 -1.02 0.00 0.00 32.46 30.47 3i5t n ARG 367 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 3i5t h ASP 368 N 0.00 0.36 -3.63 0.55 -0.00 -1.78 -3.45 116.42 108.48 3i5t h ASP 368 Ca 0.00 0.02 -0.51 0.00 -0.00 0.00 0.00 57.03 56.55 3i5t h ASP 368 Cb 0.29 -0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 39.55 3i5t h ASP 368 CO 0.00 0.18 0.36 -0.76 -0.00 0.00 0.00 179.24 179.03 3i5t s LEU 369 N -9.32 4.55 0.58 2.28 1.43 -0.64 -4.95 118.68 112.61 3i5t s LEU 369 Ca -0.08 1.86 0.28 0.00 -1.03 0.00 0.00 54.13 55.17 3i5t s LEU 369 Cb 0.21 -3.60 1.68 0.00 0.03 0.00 0.00 46.19 44.52 3i5t s LEU 369 CO 0.77 0.00 2.16 1.55 0.23 0.00 0.00 176.35 181.06 3i5t h PRO 370 N 5.05 0.00 0.00 1.29 0.13 -1.87 -2.24 132.00 134.36 3i5t h PRO 370 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3i5t h PRO 370 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3i5t h PRO 370 CO 0.70 0.00 -0.02 0.41 -0.23 0.00 0.00 178.00 178.86 3i5t n GLY 371 N -1.39 -1.64 3.58 1.56 0.00 -1.26 -4.79 105.19 101.25 3i5t n GLY 371 Ca -0.00 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 3i5t n GLY 371 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i5t s VAL 372 N -3.08 5.30 -0.08 1.61 1.01 -0.84 -2.00 120.40 122.32 3i5t s VAL 372 Ca 0.11 0.14 -0.19 0.00 0.00 0.00 0.00 61.98 62.05 3i5t s VAL 372 Cb 0.14 -3.56 -0.29 0.00 0.00 0.00 0.00 36.38 32.67 3i5t s VAL 372 CO 0.58 0.21 0.69 0.00 0.00 0.00 0.00 175.10 176.59 3i5t h ALA 373 N 8.38 0.06 -2.07 5.51 0.00 -0.70 -3.46 119.26 126.98 3i5t h ALA 373 Ca -0.34 -0.92 -0.07 0.00 0.00 0.00 0.00 54.91 53.58 3i5t h ALA 373 Cb 1.18 0.32 -0.19 0.00 0.00 0.00 0.00 17.79 19.11 3i5t h ALA 373 CO 0.57 0.63 0.14 -2.00 0.00 0.00 0.00 179.25 178.58 3i5t s GLU 374 N -2.45 1.02 -0.02 0.00 2.12 -1.15 -5.02 118.70 113.20 3i5t s GLU 374 Ca -0.17 0.20 0.03 0.00 0.36 0.00 0.00 54.97 55.39 3i5t s GLU 374 Cb 0.03 0.48 -0.00 0.00 0.26 0.00 0.00 34.13 34.90 3i5t s GLU 374 CO 0.79 -0.32 -0.11 0.95 -0.54 0.00 0.00 175.26 176.03 3i5t s THR 375 N -1.25 0.92 0.14 -1.70 -4.23 -1.26 0.09 115.64 108.35 3i5t s THR 375 Ca -0.11 -0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 59.94 3i5t s THR 375 Cb -0.01 -0.80 -0.04 0.00 1.34 0.00 0.00 72.50 72.99 3i5t s THR 375 CO 0.09 0.27 0.05 0.00 -0.54 0.00 0.00 174.62 174.50 3i5t s ARG 376 N 0.02 0.95 -0.14 3.99 1.70 -0.75 -4.95 118.95 119.78 3i5t s ARG 376 Ca -0.01 -1.46 -0.30 0.00 -0.47 0.00 0.00 55.73 53.49 3i5t s ARG 376 Cb -0.08 0.18 0.13 0.00 -0.57 0.00 0.00 34.95 34.62 3i5t s ARG 376 CO 0.00 -0.25 1.04 -1.54 -1.08 0.00 0.00 175.30 173.47 3i5t s SER 377 N -3.07 -0.31 -0.02 -2.89 1.04 -1.26 -1.07 113.70 106.13 3i5t s SER 377 Ca 0.24 0.23 -0.02 0.00 0.48 0.00 0.00 55.95 56.88 3i5t s SER 377 Cb 0.07 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.47 3i5t s SER 377 CO 0.02 -0.36 0.05 0.54 0.98 0.00 0.00 173.24 174.47 3i5t s VAL 378 N -1.72 -0.00 0.00 5.02 0.11 -0.72 -5.02 120.40 118.08 3i5t s VAL 378 Ca 0.02 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 3i5t s VAL 378 Cb -0.01 -0.07 0.00 0.00 -1.53 0.00 0.00 36.38 34.77 3i5t s VAL 378 CO -0.02 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.36 3i5t n GLY 379 N 3.11 3.36 2.22 6.54 0.00 -1.26 -1.46 105.19 117.70 3i5t n GLY 379 Ca -0.13 0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 3i5t n GLY 379 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i5t n LEU 380 N 0.00 5.50 -4.11 0.99 4.77 -0.41 -4.47 117.00 119.27 3i5t n LEU 380 Ca 0.00 -4.77 -0.30 0.00 -0.03 0.00 0.00 56.01 50.90 3i5t n LEU 380 Cb 0.00 -0.51 -0.17 0.00 -2.33 0.00 0.00 43.42 40.41 3i5t n LEU 380 CO 0.00 2.01 -0.52 0.54 -1.33 0.00 0.00 177.39 178.09 3i5t s VAL 381 N -4.86 1.76 0.24 4.08 0.11 -0.54 -3.91 120.40 117.28 3i5t s VAL 381 Ca 0.53 -0.80 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 3i5t s VAL 381 Cb 0.43 -1.57 -0.04 0.00 -1.53 0.00 0.00 36.38 33.67 3i5t s VAL 381 CO -0.04 0.49 0.16 -0.83 -3.33 0.00 0.00 175.10 171.55 3i5t s GLY 382 N 0.84 1.68 -0.24 6.54 0.00 0.68 -1.75 107.32 115.08 3i5t s GLY 382 Ca -0.08 -1.79 -0.15 0.00 0.00 0.00 0.00 44.72 42.70 3i5t s GLY 382 CO -0.00 -1.43 0.60 0.00 0.00 0.00 0.00 173.10 172.26 3i5t s VAL 384 N 1.38 2.20 -0.21 0.00 1.01 -0.06 -1.82 120.40 122.90 3i5t s VAL 384 Ca -0.08 -1.25 -0.18 0.00 0.00 0.00 0.00 61.98 60.47 3i5t s VAL 384 Cb -0.06 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3i5t s VAL 384 CO -0.15 0.26 0.49 -1.58 0.00 0.00 0.00 175.10 174.12 3i5t s GLN 385 N 1.21 4.17 -0.16 2.72 0.74 0.11 -0.51 119.66 127.94 3i5t s GLN 385 Ca -0.02 0.35 0.00 0.00 0.05 0.00 0.00 55.36 55.74 3i5t s GLN 385 Cb -0.16 -3.57 -0.00 0.00 1.10 0.00 0.00 33.01 30.38 3i5t s GLN 385 CO -0.09 -0.15 -0.15 0.00 -0.55 0.00 0.00 175.29 174.35 3i5t s LEU 387 N 0.87 2.23 0.08 0.00 1.43 -0.85 -4.81 118.68 117.63 3i5t s LEU 387 Ca -0.04 -0.55 -0.01 0.00 -1.03 0.00 0.00 54.13 52.50 3i5t s LEU 387 Cb -0.15 -0.64 -0.26 0.00 0.03 0.00 0.00 46.19 45.17 3i5t s LEU 387 CO -0.01 0.01 1.14 -0.07 0.23 0.00 0.00 176.35 177.65 3i5t h LEU 388 N 4.57 0.30 -2.08 1.79 3.38 -1.93 -3.43 115.31 117.91 3i5t h LEU 388 Ca -0.41 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.24 3i5t h LEU 388 Cb 1.18 -0.10 -0.12 0.00 0.09 0.00 0.00 40.66 41.71 3i5t h LEU 388 CO 0.42 1.26 -1.49 -0.67 0.09 0.00 0.00 178.44 178.05 3i5t n ASP 389 N -3.47 -0.68 -4.39 -0.43 -0.08 -1.26 -5.06 116.55 101.18 3i5t n ASP 389 Ca -0.07 1.27 -0.45 0.00 -1.51 0.00 0.00 54.79 54.03 3i5t n ASP 389 Cb 1.00 -5.01 -0.04 0.00 2.34 0.00 0.00 41.12 39.42 3i5t n ASP 389 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 3i5t s GLY 395 N -0.67 1.92 0.95 0.27 0.00 -1.26 -5.27 107.32 103.26 3i5t s GLY 395 Ca -0.26 -2.49 -0.14 0.00 0.00 0.00 0.00 44.72 41.83 3i5t s GLY 395 CO 0.75 1.65 1.29 -1.30 0.00 0.00 0.00 173.10 175.49 3i5t n THR 396 N 5.31 0.00 0.11 0.90 -2.24 -1.26 -4.95 114.28 112.14 3i5t n THR 396 Ca 0.01 -1.11 -0.03 0.00 -2.27 0.00 0.00 64.05 60.65 3i5t n THR 396 Cb 0.45 -1.39 0.15 0.00 -2.10 0.00 0.00 70.33 67.44 3i5t n THR 396 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i5t h ALA 397 N -1.57 0.92 -0.89 6.98 0.00 -2.03 -3.03 119.26 119.63 3i5t h ALA 397 Ca -0.42 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 53.96 3i5t h ALA 397 Cb 1.21 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 3i5t h ALA 397 CO 0.32 0.73 0.57 0.93 0.00 0.00 0.00 179.25 181.79 3i5t h GLU 398 N 0.11 1.19 -0.22 0.00 3.07 -2.00 -2.91 114.58 113.82 3i5t h GLU 398 Ca -0.01 -0.09 -0.16 0.00 -0.50 0.00 0.00 59.36 58.61 3i5t h GLU 398 Cb 1.08 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 3i5t h GLU 398 CO 0.09 0.81 -0.50 -0.44 -1.40 0.00 0.00 179.01 177.57 3i5t h ASP 399 N 1.22 0.68 -0.40 1.42 3.45 -1.89 -2.00 116.42 118.90 3i5t h ASP 399 Ca 0.32 -0.34 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 3i5t h ASP 399 Cb -0.10 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.46 3i5t h ASP 399 CO -0.07 1.06 0.17 0.50 -1.57 0.00 0.00 179.24 179.34 3i5t h LYS 400 N 0.49 0.58 -0.38 3.56 3.64 -1.42 -0.25 116.57 122.79 3i5t h LYS 400 Ca 0.02 -0.10 -0.11 0.00 -1.27 0.00 0.00 60.65 59.19 3i5t h LYS 400 Cb 1.04 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 3i5t h LYS 400 CO 0.10 0.53 -0.21 0.00 -2.27 0.00 0.00 179.45 177.60 3i5t h ALA 401 N 1.02 0.92 -0.38 5.00 0.00 -1.52 -1.26 119.26 123.05 3i5t h ALA 401 Ca 0.13 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3i5t h ALA 401 Cb 0.16 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3i5t h ALA 401 CO -0.01 0.62 0.17 0.35 0.00 0.00 0.00 179.25 180.37 3i5t h PHE 402 N 0.65 0.55 -0.59 0.00 -0.00 -1.19 -2.19 116.94 114.17 3i5t h PHE 402 Ca 0.09 -0.03 -0.10 0.00 -0.00 0.00 0.00 57.97 57.93 3i5t h PHE 402 Cb 0.71 -0.17 -0.02 0.00 -0.00 0.00 0.00 35.95 36.47 3i5t h PHE 402 CO 0.03 0.48 -0.03 1.15 -0.00 0.00 0.00 178.31 179.94 3i5t h THR 403 N 0.47 1.27 -0.90 4.41 2.02 -0.95 -2.20 112.91 117.02 3i5t h THR 403 Ca 0.13 -1.19 0.07 0.00 0.77 0.00 0.00 66.41 66.19 3i5t h THR 403 Cb 0.14 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 3i5t h THR 403 CO -0.01 0.43 0.58 -0.07 0.37 0.00 0.00 175.52 176.82 3i5t h LEU 404 N 0.95 0.88 -0.78 2.58 3.38 -1.14 0.38 115.31 121.57 3i5t h LEU 404 Ca 0.16 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 3i5t h LEU 404 Cb 0.59 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3i5t h LEU 404 CO 0.04 0.56 -0.43 0.11 0.09 0.00 0.00 178.44 178.80 3i5t h LYS 405 N 1.00 0.39 -0.03 1.13 1.57 -1.12 -1.66 116.57 117.85 3i5t h LYS 405 Ca 0.39 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3i5t h LYS 405 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 3i5t h LYS 405 CO -0.15 0.76 0.00 0.82 -0.57 0.00 0.00 179.45 180.31 3i5t h ILE 406 N 0.32 1.22 -0.72 1.86 2.04 -0.71 -2.10 117.51 119.41 3i5t h ILE 406 Ca 0.02 -0.65 0.14 0.00 1.00 0.00 0.00 64.86 65.37 3i5t h ILE 406 Cb 0.90 1.60 -0.09 0.00 -0.74 0.00 0.00 36.82 38.49 3i5t h ILE 406 CO 0.07 0.17 0.27 -0.78 0.00 0.00 0.00 178.15 177.89 3i5t h ASP 407 N -0.22 0.23 -0.54 1.72 -0.00 -0.87 -0.46 116.42 116.29 3i5t h ASP 407 Ca 0.01 0.11 -0.05 0.00 -0.00 0.00 0.00 57.03 57.10 3i5t h ASP 407 Cb 0.28 0.10 -0.02 0.00 -0.00 0.00 0.00 39.33 39.68 3i5t h ASP 407 CO 0.00 0.09 0.15 -0.08 -0.00 0.00 0.00 179.24 179.40 3i5t h GLU 408 N 0.41 0.85 -0.25 0.28 4.81 -1.27 -2.13 114.58 117.29 3i5t h GLU 408 Ca 0.39 -0.19 -0.10 0.00 -0.13 0.00 0.00 59.36 59.33 3i5t h GLU 408 Cb 0.59 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3i5t h GLU 408 CO -0.40 0.79 -0.28 -0.09 -0.73 0.00 0.00 179.01 178.29 3i5t h ARG 409 N 0.75 0.50 -0.33 1.92 9.65 -0.70 -2.10 114.38 124.08 3i5t h ARG 409 Ca 0.17 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3i5t h ARG 409 Cb 0.30 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 3i5t h ARG 409 CO -0.00 0.74 0.19 0.00 2.80 0.00 0.00 179.97 183.69 3i5t h PHE 411 N 0.41 0.69 -0.19 0.00 3.57 -0.66 0.25 116.94 121.02 3i5t h PHE 411 Ca 0.12 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 3i5t h PHE 411 Cb 0.04 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3i5t h PHE 411 CO -0.03 0.34 -0.18 0.93 -2.23 0.00 0.00 178.31 177.14 3i5t h GLU 412 N 0.70 0.33 -0.01 1.11 5.08 -1.07 -2.47 114.58 118.25 3i5t h GLU 412 Ca 0.30 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3i5t h GLU 412 Cb 0.18 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3i5t h GLU 412 CO -0.18 0.50 -0.05 1.28 -1.00 0.00 0.00 179.01 179.57 3i5t n LEU 413 N -4.21 1.20 0.00 1.33 4.77 -0.59 -4.94 117.00 114.56 3i5t n LEU 413 Ca -0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 3i5t n LEU 413 Cb 0.32 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3i5t n LEU 413 CO 0.39 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3i5t n GLY 414 N 1.19 1.97 2.82 -0.72 0.00 -0.41 -5.02 105.19 105.02 3i5t n GLY 414 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3i5t n GLY 414 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i5t s LEU 415 N 0.00 0.72 -0.22 0.99 2.96 0.76 -1.55 118.68 122.34 3i5t s LEU 415 Ca 0.00 0.17 -0.22 0.00 -0.22 0.00 0.00 54.13 53.86 3i5t s LEU 415 Cb 0.00 0.12 -0.02 0.00 0.50 0.00 0.00 46.19 46.80 3i5t s LEU 415 CO 0.00 -0.16 0.71 -0.63 -1.32 0.00 0.00 176.35 174.95 3i5t s ILE 416 N 1.36 4.95 0.22 6.68 1.01 -0.61 -1.75 121.20 133.06 3i5t s ILE 416 Ca -0.06 1.33 0.10 0.00 0.00 0.00 0.00 60.65 62.01 3i5t s ILE 416 Cb -0.12 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 3i5t s ILE 416 CO -0.04 0.03 -0.08 0.68 0.00 0.00 0.00 174.94 175.53 3i5t s VAL 417 N 2.31 3.16 -0.30 2.92 -7.23 -1.26 -2.48 120.40 117.52 3i5t s VAL 417 Ca 0.31 -1.86 -0.18 0.00 -1.81 0.00 0.00 61.98 58.44 3i5t s VAL 417 Cb -0.16 -2.62 -0.02 0.00 0.56 0.00 0.00 36.38 34.15 3i5t s VAL 417 CO 0.09 -0.24 0.52 -0.60 -0.31 0.00 0.00 175.10 174.57 3i5t s ARG 418 N -3.22 3.87 -0.33 4.82 3.52 -0.58 -4.92 118.95 122.12 3i5t s ARG 418 Ca 0.28 0.11 -0.26 0.00 -0.13 0.00 0.00 55.73 55.73 3i5t s ARG 418 Cb -0.07 -3.72 0.01 0.00 -1.56 0.00 0.00 34.95 29.60 3i5t s ARG 418 CO 0.17 -0.50 0.94 -1.25 -0.81 0.00 0.00 175.30 173.85 3i5t s PRO 419 N 2.38 3.97 -0.56 5.12 0.04 -1.26 -1.30 135.00 143.39 3i5t s PRO 419 Ca 0.20 0.78 0.04 0.00 0.04 0.00 0.00 61.00 62.06 3i5t s PRO 419 Cb -0.15 -3.75 0.15 0.00 0.04 0.00 0.00 34.50 30.79 3i5t s PRO 419 CO 0.11 -0.84 0.36 -0.51 0.04 0.00 0.00 177.00 176.16 3i5t s LEU 420 N 3.37 3.75 0.00 -3.56 1.02 -0.67 -5.01 118.68 117.58 3i5t s LEU 420 Ca 0.39 -3.25 0.00 0.00 0.02 0.00 0.00 54.13 51.29 3i5t s LEU 420 Cb -0.13 -1.34 0.00 0.00 0.02 0.00 0.00 46.19 44.74 3i5t s LEU 420 CO 0.15 -0.17 0.00 0.61 0.02 0.00 0.00 176.35 176.96 3i5t n GLY 421 N 2.74 1.47 1.37 -3.19 0.00 -1.26 -1.59 105.19 104.73 3i5t n GLY 421 Ca 0.15 0.28 0.08 0.00 0.00 0.00 0.00 46.02 46.53 3i5t n GLY 421 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3i5t n ASP 422 N 11.54 4.03 -4.31 1.61 5.75 -1.26 -4.40 116.55 129.51 3i5t n ASP 422 Ca 0.00 -2.33 -0.31 0.00 -0.01 0.00 0.00 54.79 52.14 3i5t n ASP 422 Cb 0.00 -0.52 -0.16 0.00 -1.03 0.00 0.00 41.12 39.41 3i5t n ASP 422 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3i5t s LEU 423 N -1.55 2.12 -0.28 -2.12 1.43 -0.62 -0.74 118.68 116.91 3i5t s LEU 423 Ca 0.43 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 3i5t s LEU 423 Cb 0.27 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 3i5t s LEU 423 CO 0.22 0.29 0.25 0.00 0.23 0.00 0.00 176.35 177.35 3i5t s VAL 425 N 1.86 3.99 -0.01 0.00 1.01 -0.42 -0.88 120.40 125.95 3i5t s VAL 425 Ca 0.09 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.78 3i5t s VAL 425 Cb -0.16 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 3i5t s VAL 425 CO 0.11 0.53 -0.13 0.27 0.00 0.00 0.00 175.10 175.88 3i5t s ILE 426 N -0.05 1.00 -0.47 2.22 -0.00 -0.85 -1.52 121.20 121.54 3i5t s ILE 426 Ca 0.02 -0.56 0.06 0.00 -0.00 0.00 0.00 60.65 60.17 3i5t s ILE 426 Cb -0.13 -0.84 0.22 0.00 -0.00 0.00 0.00 42.46 41.71 3i5t s ILE 426 CO 0.02 0.27 0.72 -1.54 -0.00 0.00 0.00 174.94 174.41 3i5t n SER 427 N 2.73 -2.15 -4.79 4.36 3.41 0.37 -0.23 113.62 117.33 3i5t n SER 427 Ca -0.14 -3.00 -0.30 0.00 -0.26 0.00 0.00 58.87 55.18 3i5t n SER 427 Cb 0.56 1.06 0.11 0.00 -0.26 0.00 0.00 64.21 65.68 3i5t n SER 427 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3i5t s PRO 428 N 0.28 1.69 0.43 4.33 0.04 -0.77 -2.53 135.00 138.47 3i5t s PRO 428 Ca 0.32 0.54 -0.24 0.00 0.04 0.00 0.00 61.00 61.67 3i5t s PRO 428 Cb 0.15 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.70 3i5t s PRO 428 CO -0.17 -1.87 0.96 -2.30 0.04 0.00 0.00 177.00 173.66 3i5t n PRO 429 N -3.59 1.24 0.19 0.56 -0.02 -1.26 -4.77 135.00 127.35 3i5t n PRO 429 Ca 0.07 0.45 0.14 0.00 -2.02 0.00 0.00 63.50 62.14 3i5t n PRO 429 Cb 0.57 -2.00 0.65 0.00 -0.02 0.00 0.00 33.50 32.71 3i5t n PRO 429 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3i5t h LEU 430 N 1.39 0.00 -1.00 2.45 3.38 -0.10 -2.25 115.31 119.19 3i5t h LEU 430 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3i5t h LEU 430 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 3i5t h LEU 430 CO 0.56 0.00 0.00 2.30 0.09 0.00 0.00 178.44 181.39 3i5t n ILE 431 N -2.51 0.13 -1.69 1.22 -6.64 -1.24 -4.17 119.36 104.46 3i5t n ILE 431 Ca 0.00 -0.29 -0.44 0.00 -1.77 0.00 0.00 62.75 60.25 3i5t n ILE 431 Cb 0.17 0.37 -0.03 0.00 -1.44 0.00 0.00 39.64 38.71 3i5t n ILE 431 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3i5t n ILE 432 N 0.20 0.88 -2.18 7.28 3.06 -0.85 -4.99 119.36 122.77 3i5t n ILE 432 Ca 0.17 -0.22 -0.27 0.00 -2.50 0.00 0.00 62.75 59.93 3i5t n ILE 432 Cb 0.32 -1.59 0.06 0.00 0.54 0.00 0.00 39.64 38.97 3i5t n ILE 432 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3i5t s SER 433 N 0.39 5.10 0.20 9.51 1.04 -1.26 -4.93 113.70 123.75 3i5t s SER 433 Ca 0.68 0.66 -0.11 0.00 0.48 0.00 0.00 55.95 57.67 3i5t s SER 433 Cb -0.62 -1.42 0.23 0.00 0.10 0.00 0.00 66.02 64.32 3i5t s SER 433 CO 0.48 -1.44 1.76 0.03 0.98 0.00 0.00 173.24 175.05 3i5t h ARG 434 N -0.53 0.42 -0.81 4.02 3.08 -2.00 -1.61 114.38 116.95 3i5t h ARG 434 Ca -0.45 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.53 3i5t h ARG 434 Cb 1.29 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 31.21 3i5t h ARG 434 CO 0.62 0.28 0.33 0.00 -1.07 0.00 0.00 179.97 180.13 3i5t h ALA 435 N 1.37 1.05 -0.09 0.04 0.00 -2.00 -2.38 119.26 117.26 3i5t h ALA 435 Ca 0.28 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 3i5t h ALA 435 Cb 0.30 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3i5t h ALA 435 CO -0.26 0.67 -0.64 1.96 0.00 0.00 0.00 179.25 180.98 3i5t h GLN 436 N 1.18 0.35 -0.43 0.00 4.20 -1.89 -1.48 115.11 117.04 3i5t h GLN 436 Ca 0.27 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 3i5t h GLN 436 Cb 0.20 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3i5t h GLN 436 CO -0.02 0.87 0.26 0.82 -0.67 0.00 0.00 178.83 180.09 3i5t h ILE 437 N 0.25 1.14 -0.44 2.54 2.04 -1.13 -0.97 117.51 120.95 3i5t h ILE 437 Ca -0.01 -0.33 -0.11 0.00 1.00 0.00 0.00 64.86 65.40 3i5t h ILE 437 Cb 1.18 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3i5t h ILE 437 CO 0.11 0.14 -0.17 0.44 0.00 0.00 0.00 178.15 178.67 3i5t h ASP 438 N 0.57 0.85 -0.37 1.72 3.32 -1.28 -0.60 116.42 120.63 3i5t h ASP 438 Ca 0.16 -0.29 0.04 0.00 0.02 0.00 0.00 57.03 56.95 3i5t h ASP 438 Cb 0.01 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 3i5t h ASP 438 CO -0.03 1.01 0.16 -0.33 -1.72 0.00 0.00 179.24 178.33 3i5t h GLU 439 N 0.75 0.32 -0.29 3.56 5.08 -1.15 0.13 114.58 122.97 3i5t h GLU 439 Ca 0.11 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 3i5t h GLU 439 Cb 0.69 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 3i5t h GLU 439 CO 0.05 0.21 0.12 1.98 -1.00 0.00 0.00 179.01 180.38 3i5t h MET 440 N 0.33 0.26 -0.52 2.33 4.05 -0.91 -2.19 114.93 118.28 3i5t h MET 440 Ca 0.16 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.51 3i5t h MET 440 Cb 0.11 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 3i5t h MET 440 CO -0.14 0.17 0.10 0.28 0.23 0.00 0.00 176.91 177.55 3i5t h VAL 441 N 0.27 1.25 -0.27 -5.77 2.07 -0.87 -2.01 116.25 110.91 3i5t h VAL 441 Ca 0.13 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 3i5t h VAL 441 Cb 0.07 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3i5t h VAL 441 CO -0.11 0.33 0.03 0.00 0.02 0.00 0.00 177.57 177.84 3i5t h ALA 442 N 0.99 1.54 -0.19 1.67 0.00 -0.64 0.22 119.26 122.86 3i5t h ALA 442 Ca 0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3i5t h ALA 442 Cb 0.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3i5t h ALA 442 CO 0.01 0.34 -0.09 0.82 0.00 0.00 0.00 179.25 180.33 3i5t h ILE 443 N 0.39 1.31 -0.33 0.00 2.04 -1.21 -2.18 117.51 117.54 3i5t h ILE 443 Ca 0.09 -1.13 0.03 0.00 1.00 0.00 0.00 64.86 64.84 3i5t h ILE 443 Cb 0.22 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 3i5t h ILE 443 CO 0.00 0.34 0.15 0.24 0.00 0.00 0.00 178.15 178.89 3i5t h MET 444 N 0.09 0.31 -0.51 2.37 2.86 -0.85 -0.63 114.93 118.57 3i5t h MET 444 Ca 0.04 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.71 3i5t h MET 444 Cb 0.57 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.11 3i5t h MET 444 CO 0.03 0.21 0.25 -0.09 1.06 0.00 0.00 176.91 178.36 3i5t h ARG 445 N 0.32 0.47 -0.56 1.72 2.43 -0.58 0.19 114.38 118.37 3i5t h ARG 445 Ca 0.14 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 3i5t h ARG 445 Cb 0.07 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3i5t h ARG 445 CO -0.11 0.31 0.18 0.37 -1.51 0.00 0.00 179.97 179.21 3i5t h GLN 446 N 0.48 0.87 -0.43 0.20 4.15 -1.10 -1.33 115.11 117.95 3i5t h GLN 446 Ca 0.23 -0.19 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 3i5t h GLN 446 Cb 0.16 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 3i5t h GLN 446 CO -0.18 0.79 -0.10 0.00 -1.93 0.00 0.00 178.83 177.42 3i5t h ALA 447 N 1.04 0.59 -0.28 3.38 0.00 -0.53 -2.35 119.26 121.11 3i5t h ALA 447 Ca 0.18 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3i5t h ALA 447 Cb 0.28 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3i5t h ALA 447 CO -0.01 0.47 0.05 0.82 0.00 0.00 0.00 179.25 180.58 3i5t h ILE 448 N 0.65 1.23 -0.36 0.00 2.04 -0.56 -2.76 117.51 117.76 3i5t h ILE 448 Ca 0.11 -0.79 0.02 0.00 1.00 0.00 0.00 64.86 65.19 3i5t h ILE 448 Cb 0.63 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 3i5t h ILE 448 CO 0.04 0.26 0.21 0.71 0.00 0.00 0.00 178.15 179.37 3i5t h THR 449 N 0.28 1.04 -0.17 -0.27 1.35 -1.17 -1.22 112.91 112.74 3i5t h THR 449 Ca 0.09 -0.15 -0.07 0.00 -0.55 0.00 0.00 66.41 65.73 3i5t h THR 449 Cb 0.34 0.57 -0.00 0.00 -1.73 0.00 0.00 68.15 67.32 3i5t h THR 449 CO 0.01 0.08 -0.16 -0.33 -0.25 0.00 0.00 175.52 174.86 3i5t h GLU 450 N 0.43 0.42 -0.40 4.72 5.08 -1.45 -2.13 114.58 121.25 3i5t h GLU 450 Ca 0.14 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 3i5t h GLU 450 Cb 0.01 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3i5t h GLU 450 CO -0.07 0.78 0.07 0.28 -1.00 0.00 0.00 179.01 179.07 3i5t h VAL 451 N 0.07 1.24 -0.78 3.13 2.07 -1.49 -2.72 116.25 117.76 3i5t h VAL 451 Ca 0.03 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.77 3i5t h VAL 451 Cb 0.70 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 3i5t h VAL 451 CO 0.04 0.29 0.51 0.28 0.02 0.00 0.00 177.57 178.72 3i5t h SER 452 N 0.50 0.72 -0.38 0.57 0.02 -1.17 -1.12 113.55 112.69 3i5t h SER 452 Ca 0.12 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 3i5t h SER 452 Cb 0.36 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 3i5t h SER 452 CO 0.01 0.46 0.01 0.00 -1.14 0.00 0.00 176.83 176.16 3i5t h ALA 453 N 1.58 1.15 0.00 3.77 0.00 -1.18 0.86 119.26 125.44 3i5t h ALA 453 Ca 0.34 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3i5t h ALA 453 Cb 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3i5t h ALA 453 CO -0.12 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.68 3i5t n ALA 454 N -2.47 1.94 -0.62 0.00 0.00 -0.48 -2.55 120.51 116.34 3i5t n ALA 454 Ca 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.53 3i5t n ALA 454 Cb 0.29 -1.39 0.22 0.00 0.00 0.00 0.00 19.45 18.57 3i5t n ALA 454 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3i5t n HIS 455 N -1.91 0.79 -1.76 0.00 8.25 -0.88 -4.99 115.22 114.71 3i5t n HIS 455 Ca 0.04 -0.70 -0.10 0.00 -0.26 0.00 0.00 57.72 56.71 3i5t n HIS 455 Cb 0.28 -0.19 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 3i5t n HIS 455 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i5t n GLY 456 N 0.05 0.51 3.72 -1.41 0.00 -0.90 -5.01 105.19 102.15 3i5t n GLY 456 Ca 0.17 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 3i5t n GLY 456 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i5t s LEU 457 N -2.53 4.32 0.00 0.99 1.43 0.25 -5.01 118.68 118.13 3i5t s LEU 457 Ca 0.00 1.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 3i5t s LEU 457 Cb 0.00 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 43.13 3i5t s LEU 457 CO 0.00 -0.12 0.14 1.07 0.23 0.00 0.00 176.35 177.67