#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n5m n GLY 2 N 0.00 2.32 0.00 -1.84 0.00 -1.26 -4.91 105.19 99.51 1n5m n GLY 2 Ca 0.00 -0.66 0.07 0.00 0.00 0.00 0.00 46.02 45.43 1n5m n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n5m n ARG 3 N 0.00 1.91 -2.81 1.61 5.12 -1.26 -5.02 116.66 116.21 1n5m n ARG 3 Ca 0.00 -0.02 -0.21 0.00 -1.93 0.00 0.00 57.85 55.69 1n5m n ARG 3 Cb 0.00 -1.21 0.07 0.00 -1.16 0.00 0.00 32.46 30.16 1n5m n ARG 3 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1n5m s GLU 4 N -2.48 2.17 -0.29 5.56 8.01 -1.26 -5.00 118.70 125.39 1n5m s GLU 4 Ca 0.04 -1.28 -0.28 0.00 0.01 0.00 0.00 54.97 53.46 1n5m s GLU 4 Cb 0.11 -2.52 -0.05 0.00 -4.31 0.00 0.00 34.13 27.35 1n5m s GLU 4 CO 0.60 -0.99 2.23 0.34 0.01 0.00 0.00 175.26 177.45 1n5m s ASP 5 N -4.62 5.24 0.63 -0.19 -1.08 -1.26 -4.86 116.67 110.54 1n5m s ASP 5 Ca 0.62 1.65 0.35 0.00 -0.52 0.00 0.00 52.55 54.64 1n5m s ASP 5 Cb -0.07 -2.51 1.95 0.00 -1.46 0.00 0.00 42.92 40.83 1n5m s ASP 5 CO 0.40 -2.16 2.17 1.55 0.52 0.00 0.00 175.17 177.65 1n5m h PRO 6 N 15.97 0.00 -0.11 4.34 0.13 -1.96 -1.66 132.00 148.71 1n5m h PRO 6 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1n5m h PRO 6 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1n5m h PRO 6 CO 1.01 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.82 1n5m n GLN 7 N -3.35 1.41 -0.10 0.86 6.02 -1.26 -3.62 117.38 117.33 1n5m n GLN 7 Ca -0.01 -0.62 0.04 0.00 -0.01 0.00 0.00 57.00 56.40 1n5m n GLN 7 Cb 0.23 -1.32 0.09 0.00 1.02 0.00 0.00 30.24 30.26 1n5m n GLN 7 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1n5m n LEU 8 N -0.14 2.49 -4.51 1.08 4.77 -0.62 -4.84 117.00 115.23 1n5m n LEU 8 Ca 0.14 -1.86 -0.36 0.00 -0.03 0.00 0.00 56.01 53.91 1n5m n LEU 8 Cb 0.20 -0.14 -0.12 0.00 -2.33 0.00 0.00 43.42 41.04 1n5m n LEU 8 CO 0.11 0.61 -0.28 -0.76 -1.33 0.00 0.00 177.39 175.74 1n5m s LEU 9 N -0.95 3.54 0.02 2.23 1.43 -1.24 -0.76 118.68 122.96 1n5m s LEU 9 Ca 0.15 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1n5m s LEU 9 Cb 0.08 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 1n5m s LEU 9 CO 0.11 0.05 -0.03 -0.69 0.23 0.00 0.00 176.35 176.02 1n5m s VAL 10 N 1.11 0.12 -0.07 -1.59 1.01 -0.72 -5.00 120.40 115.25 1n5m s VAL 10 Ca 0.04 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.07 1n5m s VAL 10 Cb -0.14 -0.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.86 1n5m s VAL 10 CO 0.03 -0.54 -0.18 -0.60 0.00 0.00 0.00 175.10 173.81 1n5m s ARG 11 N -1.66 2.73 0.38 2.72 3.52 -1.26 0.10 118.95 125.49 1n5m s ARG 11 Ca -0.14 -0.78 0.05 0.00 -0.13 0.00 0.00 55.73 54.73 1n5m s ARG 11 Cb -0.09 -2.35 -0.06 0.00 -1.56 0.00 0.00 34.95 30.89 1n5m s ARG 11 CO -0.02 0.43 0.04 0.14 -0.81 0.00 0.00 175.30 175.08 1n5m s VAL 12 N -0.24 1.51 0.40 7.11 -7.23 0.04 -4.86 120.40 117.12 1n5m s VAL 12 Ca 0.00 -2.00 0.23 0.00 -1.81 0.00 0.00 61.98 58.40 1n5m s VAL 12 Cb -0.13 -2.81 0.41 0.00 0.56 0.00 0.00 36.38 34.41 1n5m s VAL 12 CO 0.03 0.00 1.64 -0.09 -0.31 0.00 0.00 175.10 176.37 1n5m h ARG 13 N 1.89 0.17 0.00 4.82 9.65 -1.95 0.95 114.38 129.91 1n5m h ARG 13 Ca -0.42 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.45 1n5m h ARG 13 Cb 1.25 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.79 1n5m h ARG 13 CO 0.74 0.11 -0.31 0.41 2.80 0.00 0.00 179.97 183.72 1n5m n GLY 14 N -1.42 -1.39 0.00 2.80 0.00 -1.26 -4.88 105.19 99.05 1n5m n GLY 14 Ca 0.34 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1n5m n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n5m n GLY 15 N 1.46 0.12 3.82 -0.02 0.00 0.33 -0.19 105.19 110.71 1n5m n GLY 15 Ca 0.06 -1.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 1n5m n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n5m s GLN 16 N -2.00 4.20 0.10 1.61 -0.21 -1.25 -0.78 119.66 121.32 1n5m s GLN 16 Ca 0.00 0.77 0.06 0.00 0.02 0.00 0.00 55.36 56.21 1n5m s GLN 16 Cb 0.00 -2.98 -0.03 0.00 1.00 0.00 0.00 33.01 30.99 1n5m s GLN 16 CO 0.00 0.47 -0.17 -0.51 -2.12 0.00 0.00 175.29 172.97 1n5m s LEU 17 N -1.76 2.32 -0.17 2.90 1.43 0.12 -0.04 118.68 123.48 1n5m s LEU 17 Ca 0.39 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1n5m s LEU 17 Cb -0.17 -0.66 0.03 0.00 0.03 0.00 0.00 46.19 45.42 1n5m s LEU 17 CO 0.21 -0.04 -0.11 -0.60 0.23 0.00 0.00 176.35 176.03 1n5m s ARG 18 N -2.05 2.05 0.00 1.70 3.52 -0.38 -1.76 118.95 122.03 1n5m s ARG 18 Ca 0.04 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 1n5m s ARG 18 Cb -0.09 -2.16 0.00 0.00 -1.56 0.00 0.00 34.95 31.14 1n5m s ARG 18 CO 0.03 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 174.61 1n5m n GLY 19 N 4.77 0.68 3.07 8.12 0.00 0.06 -0.92 105.19 120.97 1n5m n GLY 19 Ca -0.15 -1.93 -0.17 0.00 0.00 0.00 0.00 46.02 43.77 1n5m n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1n5m s ILE 20 N 0.33 0.76 -0.30 -0.61 2.07 0.17 -4.78 121.20 118.85 1n5m s ILE 20 Ca 0.00 -0.84 -0.23 0.00 -1.41 0.00 0.00 60.65 58.17 1n5m s ILE 20 Cb 0.00 -0.72 -0.00 0.00 0.13 0.00 0.00 42.46 41.87 1n5m s ILE 20 CO 0.00 -0.09 0.77 -0.60 -1.91 0.00 0.00 174.94 173.11 1n5m s ARG 21 N -1.04 3.99 0.07 3.50 3.52 -1.26 -0.94 118.95 126.78 1n5m s ARG 21 Ca -0.02 0.60 0.04 0.00 -0.13 0.00 0.00 55.73 56.22 1n5m s ARG 21 Cb -0.07 -3.71 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 1n5m s ARG 21 CO 0.01 -0.63 0.01 -0.51 -0.81 0.00 0.00 175.30 173.36 1n5m s LEU 22 N 2.89 3.53 -0.03 -0.88 1.43 0.63 -4.93 118.68 121.31 1n5m s LEU 22 Ca 0.32 -0.11 -0.22 0.00 -1.03 0.00 0.00 54.13 53.09 1n5m s LEU 22 Cb -0.14 -2.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.83 1n5m s LEU 22 CO 0.12 0.20 0.65 -0.75 0.23 0.00 0.00 176.35 176.80 1n5m s LYS 23 N -2.13 4.39 0.13 1.70 2.20 -1.26 -0.29 119.74 124.48 1n5m s LYS 23 Ca 0.25 0.81 0.09 0.00 -0.36 0.00 0.00 55.97 56.76 1n5m s LYS 23 Cb -0.12 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 1n5m s LYS 23 CO 0.17 0.22 -0.22 0.00 -0.36 0.00 0.00 175.35 175.17 1n5m s ALA 24 N 0.27 2.04 0.31 3.13 0.00 0.07 -4.92 121.76 122.66 1n5m s ALA 24 Ca 0.34 -1.40 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1n5m s ALA 24 Cb -0.18 -0.26 0.79 0.00 0.00 0.00 0.00 23.12 23.47 1n5m s ALA 24 CO 0.18 0.37 1.54 -2.30 0.00 0.00 0.00 175.76 175.55 1n5m n PRO 25 N 0.74 -0.08 -0.21 0.00 -0.02 -1.26 -0.62 135.00 133.55 1n5m n PRO 25 Ca -0.17 1.47 0.10 0.00 -2.02 0.00 0.00 63.50 62.88 1n5m n PRO 25 Cb 0.55 -2.35 0.27 0.00 -0.02 0.00 0.00 33.50 31.94 1n5m n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n5m n GLY 26 N -1.48 1.43 0.00 -1.23 0.00 -1.26 -5.04 105.19 97.61 1n5m n GLY 26 Ca 0.24 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1n5m n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n5m n GLY 27 N 1.39 0.60 3.85 -0.02 0.00 0.20 -5.09 105.19 106.14 1n5m n GLY 27 Ca 0.19 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 1n5m n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n5m s PRO 28 N -1.67 3.66 0.09 1.61 0.04 -1.26 -0.75 135.00 136.72 1n5m s PRO 28 Ca 0.00 0.85 0.02 0.00 0.04 0.00 0.00 61.00 61.91 1n5m s PRO 28 Cb 0.00 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1n5m s PRO 28 CO 0.00 -0.51 -0.06 0.14 0.04 0.00 0.00 177.00 176.60 1n5m s VAL 29 N -2.95 0.63 -0.13 -0.36 -7.23 0.60 -3.57 120.40 107.39 1n5m s VAL 29 Ca 0.57 -1.81 -0.10 0.00 -1.81 0.00 0.00 61.98 58.83 1n5m s VAL 29 Cb -0.11 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 1n5m s VAL 29 CO 0.46 -0.82 0.21 -0.44 -0.31 0.00 0.00 175.10 174.20 1n5m s SER 30 N -2.83 6.41 -0.06 4.85 0.01 0.69 -0.27 113.70 122.50 1n5m s SER 30 Ca 0.08 0.48 0.03 0.00 1.31 0.00 0.00 55.95 57.85 1n5m s SER 30 Cb 0.03 -2.12 0.01 0.00 0.21 0.00 0.00 66.02 64.15 1n5m s SER 30 CO -0.04 0.27 -0.13 0.00 0.41 0.00 0.00 173.24 173.75 1n5m s ALA 31 N -0.34 1.27 -0.33 1.44 0.00 -0.12 -0.98 121.76 122.70 1n5m s ALA 31 Ca 0.15 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.68 1n5m s ALA 31 Cb -0.13 -0.53 0.10 0.00 0.00 0.00 0.00 23.12 22.57 1n5m s ALA 31 CO 0.04 0.15 0.06 -0.06 0.00 0.00 0.00 175.76 175.94 1n5m s PHE 32 N 0.49 3.37 0.01 0.00 0.40 0.82 -0.65 117.98 122.41 1n5m s PHE 32 Ca -0.11 -2.76 0.03 0.00 -0.60 0.00 0.00 56.93 53.48 1n5m s PHE 32 Cb -0.14 -2.69 -0.03 0.00 0.51 0.00 0.00 43.02 40.66 1n5m s PHE 32 CO 0.03 -0.94 -0.03 -0.51 0.70 0.00 0.00 175.22 174.47 1n5m s LEU 33 N 1.04 3.33 -0.56 -0.37 1.43 0.30 -0.48 118.68 123.37 1n5m s LEU 33 Ca 0.11 -0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.11 1n5m s LEU 33 Cb -0.19 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1n5m s LEU 33 CO -0.11 0.28 0.15 0.61 0.23 0.00 0.00 176.35 177.50 1n5m n GLY 34 N 1.44 0.21 3.66 -3.19 0.00 -1.12 -3.83 105.19 102.37 1n5m n GLY 34 Ca -0.15 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 1n5m n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n5m s ILE 35 N -2.64 4.51 0.14 -0.61 1.01 -0.00 -4.76 121.20 118.85 1n5m s ILE 35 Ca 0.07 1.82 -0.30 0.00 0.00 0.00 0.00 60.65 62.24 1n5m s ILE 35 Cb -0.03 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 1n5m s ILE 35 CO 0.09 -0.14 1.24 -2.16 0.00 0.00 0.00 174.94 173.98 1n5m s PRO 36 N 3.15 4.43 0.00 2.79 0.04 -1.26 -0.48 135.00 143.68 1n5m s PRO 36 Ca 0.49 1.91 0.02 0.00 0.04 0.00 0.00 61.00 63.46 1n5m s PRO 36 Cb -0.18 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.11 1n5m s PRO 36 CO 0.11 -0.21 0.61 1.97 0.04 0.00 0.00 177.00 179.52 1n5m n PHE 37 N 3.13 0.01 -3.70 0.56 1.16 -1.06 -4.87 117.46 112.69 1n5m n PHE 37 Ca 0.07 -0.05 -0.10 0.00 -1.87 0.00 0.00 57.45 55.50 1n5m n PHE 37 Cb 0.44 -0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.26 1n5m n PHE 37 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1n5m s ALA 38 N -0.24 -0.71 0.36 1.98 0.00 -1.25 -3.18 121.76 118.71 1n5m s ALA 38 Ca 0.02 -0.23 -0.27 0.00 0.00 0.00 0.00 51.96 51.49 1n5m s ALA 38 Cb 0.02 0.64 -0.09 0.00 0.00 0.00 0.00 23.12 23.68 1n5m s ALA 38 CO 0.02 -0.61 1.18 -1.21 0.00 0.00 0.00 175.76 175.15 1n5m s GLU 39 N -3.82 4.25 -0.04 0.00 0.41 0.12 -4.42 118.70 115.20 1n5m s GLU 39 Ca 0.04 1.91 -0.37 0.00 -0.41 0.00 0.00 54.97 56.14 1n5m s GLU 39 Cb 0.03 -2.87 -0.15 0.00 -1.78 0.00 0.00 34.13 29.36 1n5m s GLU 39 CO -0.11 -0.17 1.59 -2.30 -0.49 0.00 0.00 175.26 173.78 1n5m n PRO 40 N 0.47 1.50 -1.50 0.39 -0.02 -1.26 -4.68 135.00 129.90 1n5m n PRO 40 Ca 0.02 0.55 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 1n5m n PRO 40 Cb 0.45 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 1n5m n PRO 40 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1n5m n PRO 41 N 4.22 3.51 -3.53 0.52 -0.04 -1.26 -4.91 135.00 133.51 1n5m n PRO 41 Ca 0.21 -2.42 -0.20 0.00 -0.04 0.00 0.00 63.50 61.05 1n5m n PRO 41 Cb 0.21 -2.51 -0.02 0.00 -0.04 0.00 0.00 33.50 31.13 1n5m n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1n5m s VAL 42 N 0.26 3.15 0.00 0.52 -7.23 -1.26 -3.38 120.40 112.45 1n5m s VAL 42 Ca 0.63 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.55 1n5m s VAL 42 Cb 0.24 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 34.07 1n5m s VAL 42 CO -0.08 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 1n5m n GLY 43 N -1.56 4.07 0.00 2.32 0.00 -1.26 -0.43 105.19 108.33 1n5m n GLY 43 Ca 0.02 0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.30 1n5m n GLY 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n5m n SER 44 N 7.89 0.00 -0.18 1.61 3.41 -1.26 -2.42 113.62 122.68 1n5m n SER 44 Ca 0.00 0.07 0.12 0.00 -0.26 0.00 0.00 58.87 58.80 1n5m n SER 44 Cb 0.00 -0.29 0.28 0.00 -0.26 0.00 0.00 64.21 63.93 1n5m n SER 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1n5m n ARG 45 N -1.29 0.56 -1.74 4.33 5.12 0.43 -4.84 116.66 119.23 1n5m n ARG 45 Ca 0.08 -0.35 -0.42 0.00 -1.93 0.00 0.00 57.85 55.23 1n5m n ARG 45 Cb 0.13 -1.49 -0.02 0.00 -1.16 0.00 0.00 32.46 29.92 1n5m n ARG 45 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1n5m n ARG 46 N -0.91 2.75 -0.40 5.56 0.63 -1.01 -1.45 116.66 121.83 1n5m n ARG 46 Ca 0.09 0.98 0.00 0.00 -0.92 0.00 0.00 57.85 58.01 1n5m n ARG 46 Cb 0.35 -2.80 0.00 0.00 0.45 0.00 0.00 32.46 30.47 1n5m n ARG 46 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1n5m n PHE 47 N 2.88 0.00 -3.43 -0.14 3.72 -1.26 -4.95 117.46 114.27 1n5m n PHE 47 Ca 0.11 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.22 1n5m n PHE 47 Cb 0.36 -0.07 -0.04 0.00 -0.94 0.00 0.00 39.48 38.79 1n5m n PHE 47 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1n5m s MET 48 N -0.03 3.65 0.60 -1.08 -1.94 -0.53 -4.27 119.30 115.70 1n5m s MET 48 Ca 0.00 0.00 -0.19 0.00 -1.71 0.00 0.00 55.69 53.79 1n5m s MET 48 Cb 0.00 -2.69 -0.03 0.00 2.01 0.00 0.00 34.83 34.11 1n5m s MET 48 CO 0.00 0.28 1.24 -2.30 -0.01 0.00 0.00 175.02 174.23 1n5m n PRO 49 N -0.64 1.26 -2.44 2.03 -0.02 -1.26 -4.93 135.00 129.00 1n5m n PRO 49 Ca -0.02 0.48 -0.34 0.00 -2.02 0.00 0.00 63.50 61.60 1n5m n PRO 49 Cb 0.53 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 1n5m n PRO 49 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1n5m s PRO 50 N -3.05 3.64 -0.03 0.52 0.04 -1.26 -5.05 135.00 129.81 1n5m s PRO 50 Ca 0.77 1.44 0.01 0.00 0.04 0.00 0.00 61.00 63.26 1n5m s PRO 50 Cb -0.40 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.04 1n5m s PRO 50 CO 0.45 -0.58 -0.03 -1.21 0.04 0.00 0.00 177.00 175.67 1n5m s GLU 51 N -3.28 2.75 0.46 4.56 2.02 -1.26 -5.02 118.70 118.93 1n5m s GLU 51 Ca 0.69 -0.59 -0.24 0.00 0.02 0.00 0.00 54.97 54.85 1n5m s GLU 51 Cb -0.19 -2.63 -0.09 0.00 0.10 0.00 0.00 34.13 31.33 1n5m s GLU 51 CO 0.23 0.64 1.26 -2.30 0.02 0.00 0.00 175.26 175.11 1n5m n PRO 52 N 1.79 1.80 -1.93 0.39 -0.02 -1.26 -0.71 135.00 135.06 1n5m n PRO 52 Ca -0.16 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.55 1n5m n PRO 52 Cb 0.53 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.59 1n5m n PRO 52 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1n5m s LYS 53 N -2.36 4.22 0.29 -0.52 2.47 -1.19 -4.04 119.74 118.60 1n5m s LYS 53 Ca 0.64 2.39 -0.28 0.00 -1.56 0.00 0.00 55.97 57.16 1n5m s LYS 53 Cb -0.48 -3.10 -0.09 0.00 -1.46 0.00 0.00 37.83 32.69 1n5m s LYS 53 CO 0.56 -0.53 0.97 1.03 0.16 0.00 0.00 175.35 177.53 1n5m s ARG 54 N 0.13 4.68 0.55 4.03 0.52 -1.26 -4.92 118.95 122.68 1n5m s ARG 54 Ca 0.64 1.46 -0.19 0.00 -0.52 0.00 0.00 55.73 57.12 1n5m s ARG 54 Cb -0.44 -3.03 -0.08 0.00 0.52 0.00 0.00 34.95 31.92 1n5m s ARG 54 CO 0.40 0.35 0.76 -2.30 0.02 0.00 0.00 175.30 174.53 1n5m n PRO 55 N 0.99 0.78 -4.37 3.54 -0.02 -1.26 -5.00 135.00 129.66 1n5m n PRO 55 Ca 0.00 0.30 -0.25 0.00 -2.02 0.00 0.00 63.50 61.53 1n5m n PRO 55 Cb 0.48 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 31.97 1n5m n PRO 55 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 1n5m s TRP 56 N -1.56 2.52 0.18 6.00 -2.14 0.74 -5.03 118.94 119.65 1n5m s TRP 56 Ca 0.70 -0.42 0.05 0.00 2.66 0.00 0.00 56.10 59.09 1n5m s TRP 56 Cb -0.46 -1.42 -0.04 0.00 -3.10 0.00 0.00 33.47 28.44 1n5m s TRP 56 CO 0.52 0.52 0.17 -1.54 -2.66 0.00 0.00 176.95 173.96 1n5m s SER 57 N -3.69 5.63 0.06 -2.66 1.04 -1.26 -4.58 113.70 108.23 1n5m s SER 57 Ca 0.34 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.66 1n5m s SER 57 Cb -0.01 -1.50 0.00 0.00 0.10 0.00 0.00 66.02 64.62 1n5m s SER 57 CO 0.19 0.05 0.00 0.61 0.98 0.00 0.00 173.24 175.06 1n5m n GLY 58 N -0.53 -2.09 3.55 7.32 0.00 -1.26 -4.76 105.19 107.42 1n5m n GLY 58 Ca -0.08 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 1n5m n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n5m s VAL 59 N -0.27 5.28 0.07 1.61 1.01 -1.26 -3.86 120.40 122.98 1n5m s VAL 59 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 1n5m s VAL 59 Cb 0.00 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1n5m s VAL 59 CO 0.00 0.05 1.16 -0.22 0.00 0.00 0.00 175.10 176.08 1n5m s LEU 60 N 1.75 4.38 -0.32 3.92 0.20 0.95 -4.87 118.68 124.71 1n5m s LEU 60 Ca 0.07 1.98 -0.29 0.00 0.69 0.00 0.00 54.13 56.58 1n5m s LEU 60 Cb -0.17 -3.58 0.01 0.00 -0.43 0.00 0.00 46.19 42.02 1n5m s LEU 60 CO 0.11 -0.41 1.15 -0.62 -0.29 0.00 0.00 176.35 176.29 1n5m s ASP 61 N 0.90 6.84 -0.48 3.68 -1.08 -1.26 -1.25 116.67 124.02 1n5m s ASP 61 Ca 0.57 1.09 0.05 0.00 -0.52 0.00 0.00 52.55 53.74 1n5m s ASP 61 Cb -0.28 -2.54 0.41 0.00 -1.46 0.00 0.00 42.92 39.04 1n5m s ASP 61 CO 0.30 -0.95 1.15 0.00 0.52 0.00 0.00 175.17 176.19 1n5m n ALA 62 N 7.13 5.13 0.64 3.66 0.00 -0.10 -4.73 120.51 132.24 1n5m n ALA 62 Ca 0.13 -4.35 0.07 0.00 0.00 0.00 0.00 53.44 49.29 1n5m n ALA 62 Cb 0.47 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1n5m n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1n5m n THR 63 N -0.47 0.00 -4.01 0.00 -2.24 -1.25 -0.54 114.28 105.78 1n5m n THR 63 Ca 0.39 -0.37 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 1n5m n THR 63 Cb 0.61 1.18 -0.10 0.00 -2.10 0.00 0.00 70.33 69.93 1n5m n THR 63 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1n5m s THR 64 N -1.70 0.15 0.60 4.28 -4.23 -1.26 -4.86 115.64 108.62 1n5m s THR 64 Ca 0.13 -1.22 -0.19 0.00 -1.18 0.00 0.00 61.69 59.22 1n5m s THR 64 Cb 0.12 -0.76 -0.03 0.00 1.34 0.00 0.00 72.50 73.16 1n5m s THR 64 CO 0.34 -0.67 1.24 -0.36 -0.54 0.00 0.00 174.62 174.63 1n5m s PHE 65 N -2.42 2.32 0.46 3.99 0.08 -1.26 -3.39 117.98 117.76 1n5m s PHE 65 Ca -0.07 1.50 0.03 0.00 0.12 0.00 0.00 56.93 58.51 1n5m s PHE 65 Cb -0.03 -3.56 0.09 0.00 -0.57 0.00 0.00 43.02 38.95 1n5m s PHE 65 CO -0.04 -2.42 0.64 1.04 -0.10 0.00 0.00 175.22 174.33 1n5m n GLN 66 N -1.57 0.41 -1.11 0.44 1.13 -1.26 -4.87 117.38 110.55 1n5m n GLN 66 Ca 0.14 -2.06 -0.34 0.00 -1.94 0.00 0.00 57.00 52.79 1n5m n GLN 66 Cb 0.49 -0.32 0.11 0.00 0.11 0.00 0.00 30.24 30.63 1n5m n GLN 66 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1n5m n ASN 67 N -2.73 -0.15 -4.87 1.08 3.02 -1.26 -4.82 115.26 105.53 1n5m n ASN 67 Ca 0.12 0.55 -0.35 0.00 -0.03 0.00 0.00 54.58 54.87 1n5m n ASN 67 Cb 0.42 -1.37 -0.05 0.00 -0.61 0.00 0.00 39.78 38.17 1n5m n ASN 67 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1n5m s VAL 68 N -2.09 5.13 0.34 2.41 1.01 0.30 -4.72 120.40 122.78 1n5m s VAL 68 Ca 0.68 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.77 1n5m s VAL 68 Cb -0.30 -3.63 -0.11 0.00 0.00 0.00 0.00 36.38 32.34 1n5m s VAL 68 CO 0.56 0.29 1.42 0.00 0.00 0.00 0.00 175.10 177.36 1n5m n TYR 70 N 0.86 1.88 -3.58 0.00 9.36 -0.84 -4.68 117.16 120.16 1n5m n TYR 70 Ca 0.01 0.47 -0.10 0.00 3.32 0.00 0.00 57.90 61.60 1n5m n TYR 70 Cb 0.40 -2.44 -0.02 0.00 -0.63 0.00 0.00 39.34 36.65 1n5m n TYR 70 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 1n5m s GLN 71 N 1.77 1.40 0.29 2.98 -2.07 -1.26 -4.71 119.66 118.07 1n5m s GLN 71 Ca 0.88 -0.66 -0.29 0.00 -1.82 0.00 0.00 55.36 53.47 1n5m s GLN 71 Cb -0.91 0.58 -0.10 0.00 -1.09 0.00 0.00 33.01 31.49 1n5m s GLN 71 CO 0.51 -0.62 1.38 -0.47 -1.32 0.00 0.00 175.29 174.77 1n5m s TYR 72 N -3.81 3.00 -0.14 9.60 6.14 -1.26 -5.01 117.35 125.87 1n5m s TYR 72 Ca 0.05 1.21 -0.04 0.00 0.64 0.00 0.00 57.07 58.92 1n5m s TYR 72 Cb -0.02 -3.77 -0.03 0.00 0.42 0.00 0.00 41.96 38.55 1n5m s TYR 72 CO -0.07 -2.32 0.02 0.08 0.64 0.00 0.00 175.55 173.90 1n5m s VAL 73 N -0.59 4.42 0.03 3.14 1.01 -1.26 -4.90 120.40 122.25 1n5m s VAL 73 Ca 0.54 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 1n5m s VAL 73 Cb -0.41 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1n5m s VAL 73 CO 0.49 0.53 1.13 -0.62 0.00 0.00 0.00 175.10 176.63 1n5m s ASP 74 N -0.13 7.16 0.00 3.32 2.15 -1.26 -4.93 116.67 122.98 1n5m s ASP 74 Ca 0.05 1.89 0.07 0.00 0.43 0.00 0.00 52.55 54.99 1n5m s ASP 74 Cb -0.12 -2.57 -0.02 0.00 -0.30 0.00 0.00 42.92 39.90 1n5m s ASP 74 CO 0.02 -0.42 0.45 0.41 -0.17 0.00 0.00 175.17 175.46 1n5m n THR 75 N 3.97 0.00 -0.31 1.71 -1.04 -1.26 -4.79 114.28 112.56 1n5m n THR 75 Ca 0.08 -0.41 0.03 0.00 -2.04 0.00 0.00 64.05 61.72 1n5m n THR 75 Cb 0.48 1.06 0.09 0.00 -1.82 0.00 0.00 70.33 70.14 1n5m n THR 75 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1n5m n LEU 76 N -0.56 -0.38 -3.44 -4.42 7.94 -1.26 -3.11 117.00 111.77 1n5m n LEU 76 Ca 0.02 1.47 -0.26 0.00 -1.11 0.00 0.00 56.01 56.13 1n5m n LEU 76 Cb 0.13 -0.41 -0.09 0.00 0.53 0.00 0.00 43.42 43.57 1n5m n LEU 76 CO 0.10 -1.38 -0.21 -1.22 -1.11 0.00 0.00 177.39 173.56 1n5m n TYR 77 N -5.35 0.54 -1.67 1.96 4.01 -1.26 -5.12 117.16 110.27 1n5m n TYR 77 Ca 0.12 -3.66 -0.58 0.00 -0.16 0.00 0.00 57.90 53.62 1n5m n TYR 77 Cb 0.40 -0.15 -0.07 0.00 -0.31 0.00 0.00 39.34 39.20 1n5m n TYR 77 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1n5m n PRO 78 N 2.08 0.89 -0.92 -0.72 -0.02 -1.18 -1.58 135.00 133.56 1n5m n PRO 78 Ca 0.26 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1n5m n PRO 78 Cb 0.46 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1n5m n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n5m n GLY 79 N 3.52 1.13 3.67 -1.23 0.00 -1.26 -5.00 105.19 106.02 1n5m n GLY 79 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1n5m n GLY 79 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n5m s PHE 80 N -3.89 3.40 0.28 1.61 5.36 -0.61 -4.94 117.98 119.19 1n5m s PHE 80 Ca 0.00 1.32 0.02 0.00 -0.96 0.00 0.00 56.93 57.31 1n5m s PHE 80 Cb 0.00 -3.09 0.68 0.00 -0.34 0.00 0.00 43.02 40.27 1n5m s PHE 80 CO 0.00 -0.31 1.68 1.49 -1.46 0.00 0.00 175.22 176.62 1n5m h GLU 81 N 7.38 0.31 -0.95 10.12 4.81 -1.95 0.14 114.58 134.45 1n5m h GLU 81 Ca -0.26 -0.02 0.17 0.00 -0.13 0.00 0.00 59.36 59.11 1n5m h GLU 81 Cb 1.11 -0.07 -0.08 0.00 0.63 0.00 0.00 28.75 30.34 1n5m h GLU 81 CO 0.87 0.21 0.60 0.78 -0.73 0.00 0.00 179.01 180.74 1n5m h GLY 82 N 0.32 1.40 0.00 1.92 0.00 -1.92 -1.48 103.07 103.31 1n5m h GLY 82 Ca 0.53 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.46 1n5m h GLY 82 CO -0.56 0.03 -1.97 -1.30 0.00 0.00 0.00 176.54 172.74 1n5m n THR 83 N -4.62 0.33 0.09 4.70 -2.24 -0.65 -4.53 114.28 107.36 1n5m n THR 83 Ca 0.20 -0.52 -0.06 0.00 -2.27 0.00 0.00 64.05 61.40 1n5m n THR 83 Cb 0.53 -0.10 0.08 0.00 -2.10 0.00 0.00 70.33 68.74 1n5m n THR 83 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1n5m h GLU 84 N 0.00 0.20 0.00 -0.78 4.39 -0.33 -2.99 114.58 115.06 1n5m h GLU 84 Ca -0.13 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1n5m h GLU 84 Cb 1.21 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1n5m h GLU 84 CO 0.01 0.82 0.00 0.00 -1.16 0.00 0.00 179.01 178.68 1n5m h MET 85 N 0.13 0.00 -0.00 2.33 -0.00 -1.52 -0.79 114.93 115.08 1n5m h MET 85 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.68 1n5m h MET 85 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.86 1n5m h MET 85 CO 0.11 0.00 -0.81 0.91 -0.00 0.00 0.00 176.91 177.12 1n5m n TRP 86 N -2.29 0.00 -2.67 -0.10 7.02 -1.13 -4.75 117.44 113.52 1n5m n TRP 86 Ca -0.01 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 56.15 1n5m n TRP 86 Cb 0.05 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 28.89 1n5m n TRP 86 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1n5m s ASN 87 N -2.64 6.75 0.17 -0.99 0.01 -0.31 -4.65 114.94 113.28 1n5m s ASN 87 Ca 0.07 1.55 -0.33 0.00 -0.71 0.00 0.00 52.86 53.44 1n5m s ASN 87 Cb 0.13 -2.49 -0.16 0.00 0.41 0.00 0.00 41.25 39.14 1n5m s ASN 87 CO 0.71 -0.45 1.06 -2.65 -1.51 0.00 0.00 177.10 174.26 1n5m n PRO 88 N -1.08 0.91 -0.10 -0.60 -0.02 -1.26 -4.88 135.00 127.97 1n5m n PRO 88 Ca 0.06 0.32 0.07 0.00 -2.02 0.00 0.00 63.50 61.93 1n5m n PRO 88 Cb 0.54 -1.75 0.11 0.00 -0.02 0.00 0.00 33.50 32.38 1n5m n PRO 88 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1n5m n ASN 89 N 1.89 2.45 -3.91 2.55 6.94 -1.26 -4.99 115.26 118.93 1n5m n ASN 89 Ca 0.15 -2.72 -0.09 0.00 -0.02 0.00 0.00 54.58 51.90 1n5m n ASN 89 Cb 0.23 -0.31 -0.06 0.00 -2.36 0.00 0.00 39.78 37.28 1n5m n ASN 89 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1n5m s ARG 90 N -2.25 1.16 0.31 -3.83 1.81 -1.26 -5.08 118.95 109.82 1n5m s ARG 90 Ca 0.24 -1.10 -0.28 0.00 -1.72 0.00 0.00 55.73 52.86 1n5m s ARG 90 Cb 0.20 0.40 -0.13 0.00 -0.45 0.00 0.00 34.95 34.97 1n5m s ARG 90 CO 0.03 -0.43 1.23 -1.91 -0.68 0.00 0.00 175.30 173.54 1n5m n GLU 91 N -0.22 1.90 -2.85 3.54 2.13 -1.26 -4.36 120.64 119.53 1n5m n GLU 91 Ca -0.08 0.67 -0.40 0.00 0.66 0.00 0.00 57.16 58.00 1n5m n GLU 91 Cb 0.63 -2.20 -0.05 0.00 0.27 0.00 0.00 31.44 30.09 1n5m n GLU 91 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1n5m s LEU 92 N -0.49 4.49 -0.02 4.31 1.43 -1.26 -0.54 118.68 126.60 1n5m s LEU 92 Ca 0.58 1.65 -0.29 0.00 -1.03 0.00 0.00 54.13 55.04 1n5m s LEU 92 Cb -0.62 -3.43 0.08 0.00 0.03 0.00 0.00 46.19 42.26 1n5m s LEU 92 CO 0.60 -0.00 0.73 -0.55 0.23 0.00 0.00 176.35 177.35 1n5m s SER 93 N -0.16 -0.57 0.32 2.29 0.15 -0.33 -4.89 113.70 110.51 1n5m s SER 93 Ca 0.43 0.46 0.26 0.00 0.70 0.00 0.00 55.95 57.79 1n5m s SER 93 Cb -0.22 0.51 0.74 0.00 -1.71 0.00 0.00 66.02 65.33 1n5m s SER 93 CO 0.27 -0.65 1.74 -0.33 1.20 0.00 0.00 173.24 175.47 1n5m h GLU 94 N 2.64 0.00 -4.90 5.44 5.08 -1.95 -2.22 114.58 118.68 1n5m h GLU 94 Ca -0.27 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.39 1n5m h GLU 94 Cb 1.19 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.26 1n5m h GLU 94 CO 0.37 0.00 0.86 0.34 -1.00 0.00 0.00 179.01 179.58 1n5m s ASP 95 N -5.12 6.71 0.00 1.42 -1.08 -1.26 -4.21 116.67 113.13 1n5m s ASP 95 Ca 0.08 -2.24 0.00 0.00 -0.52 0.00 0.00 52.55 49.87 1n5m s ASP 95 Cb 0.09 -2.39 0.00 0.00 -1.46 0.00 0.00 42.92 39.17 1n5m s ASP 95 CO 0.59 -0.98 0.23 0.00 0.52 0.00 0.00 175.17 175.53 1n5m n LEU 97 N -0.00 5.04 -4.27 0.00 4.77 -1.26 -4.60 117.00 116.68 1n5m n LEU 97 Ca 0.00 -3.92 -0.16 0.00 -0.03 0.00 0.00 56.01 51.89 1n5m n LEU 97 Cb 0.36 -1.74 -0.10 0.00 -2.33 0.00 0.00 43.42 39.60 1n5m n LEU 97 CO 0.00 0.19 -0.43 -0.31 -1.33 0.00 0.00 177.39 175.51 1n5m s TYR 98 N 4.26 1.41 0.22 -1.77 2.02 -1.26 -2.56 117.35 119.68 1n5m s TYR 98 Ca 0.54 -0.64 0.02 0.00 -0.37 0.00 0.00 57.07 56.61 1n5m s TYR 98 Cb 0.05 -0.71 -0.05 0.00 -0.40 0.00 0.00 41.96 40.85 1n5m s TYR 98 CO 0.07 0.17 0.04 -0.48 -1.57 0.00 0.00 175.55 173.78 1n5m s LEU 99 N -2.94 1.93 0.05 -1.29 0.05 0.37 -1.28 118.68 115.58 1n5m s LEU 99 Ca 0.15 -1.28 0.06 0.00 0.05 0.00 0.00 54.13 53.11 1n5m s LEU 99 Cb -0.01 -0.07 -0.03 0.00 -2.05 0.00 0.00 46.19 44.03 1n5m s LEU 99 CO 0.03 -0.63 -0.16 0.20 -0.55 0.00 0.00 176.35 175.24 1n5m s ASN 100 N -3.27 1.92 -0.06 1.48 0.01 0.12 -0.82 114.94 114.32 1n5m s ASN 100 Ca 0.31 -0.53 0.02 0.00 -0.71 0.00 0.00 52.86 51.95 1n5m s ASN 100 Cb 0.07 -0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.63 1n5m s ASN 100 CO 0.09 0.04 -0.09 -0.69 -1.51 0.00 0.00 177.10 174.94 1n5m s VAL 101 N -0.96 0.89 -0.05 1.60 1.01 0.37 -1.55 120.40 121.71 1n5m s VAL 101 Ca 0.03 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.73 1n5m s VAL 101 Cb -0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 1n5m s VAL 101 CO 0.02 0.30 -0.21 0.26 0.00 0.00 0.00 175.10 175.47 1n5m s TRP 102 N 0.77 2.52 0.12 5.22 0.51 -0.07 -0.12 118.94 127.89 1n5m s TRP 102 Ca -0.13 -0.46 -0.08 0.00 -2.12 0.00 0.00 56.10 53.32 1n5m s TRP 102 Cb -0.15 -1.60 -0.01 0.00 -0.81 0.00 0.00 33.47 30.90 1n5m s TRP 102 CO 0.02 -0.04 0.20 0.95 -0.51 0.00 0.00 176.95 177.57 1n5m s THR 103 N -0.43 0.12 0.96 2.01 -4.23 -0.15 -1.12 115.64 112.80 1n5m s THR 103 Ca 0.04 -1.35 -0.10 0.00 -1.18 0.00 0.00 61.69 59.10 1n5m s THR 103 Cb -0.12 -1.59 0.17 0.00 1.34 0.00 0.00 72.50 72.31 1n5m s THR 103 CO 0.01 -0.53 1.13 -2.84 -0.54 0.00 0.00 174.62 171.86 1n5m s PRO 104 N -3.92 0.61 -0.12 3.99 0.02 -1.26 -0.23 135.00 134.10 1n5m s PRO 104 Ca 0.11 1.45 -0.01 0.00 0.02 0.00 0.00 61.00 62.58 1n5m s PRO 104 Cb 0.05 -1.69 0.03 0.00 0.02 0.00 0.00 34.50 32.91 1n5m s PRO 104 CO -0.06 -2.88 -0.07 -0.47 -0.33 0.00 0.00 177.00 173.20 1n5m s TYR 105 N -2.60 1.43 0.91 6.54 5.04 -1.23 -2.91 117.35 124.52 1n5m s TYR 105 Ca 0.67 -0.73 -0.12 0.00 -2.44 0.00 0.00 57.07 54.46 1n5m s TYR 105 Cb -0.23 -1.20 0.14 0.00 0.35 0.00 0.00 41.96 41.01 1n5m s TYR 105 CO 0.59 -0.51 1.10 -1.25 -1.34 0.00 0.00 175.55 174.14 1n5m s PRO 106 N 1.73 1.15 0.53 4.97 0.04 -1.26 -4.77 135.00 137.39 1n5m s PRO 106 Ca 0.05 0.70 -0.21 0.00 0.04 0.00 0.00 61.00 61.57 1n5m s PRO 106 Cb -0.13 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 1n5m s PRO 106 CO -0.08 -2.28 1.12 0.54 0.04 0.00 0.00 177.00 176.34 1n5m n ARG 107 N -3.89 1.33 -1.59 4.56 1.74 -1.15 -4.88 116.66 112.79 1n5m n ARG 107 Ca 0.07 0.49 -0.44 0.00 -0.77 0.00 0.00 57.85 57.20 1n5m n ARG 107 Cb 0.56 -2.29 -0.01 0.00 -1.02 0.00 0.00 32.46 29.70 1n5m n ARG 107 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1n5m n PRO 108 N -0.66 1.34 0.01 5.56 -0.04 -1.26 -4.95 135.00 134.99 1n5m n PRO 108 Ca 0.11 0.47 -0.13 0.00 -0.04 0.00 0.00 63.50 63.91 1n5m n PRO 108 Cb 0.44 -1.87 -0.10 0.00 -0.04 0.00 0.00 33.50 31.94 1n5m n PRO 108 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n5m h ALA 109 N 1.89 -0.05 -2.66 0.55 0.00 -1.92 -3.45 119.26 113.62 1n5m h ALA 109 Ca -0.40 -0.23 -0.60 0.00 0.00 0.00 0.00 54.91 53.68 1n5m h ALA 109 Cb 1.34 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 19.03 1n5m h ALA 109 CO 0.60 -0.29 -0.68 -1.54 0.00 0.00 0.00 179.25 177.33 1n5m s SER 110 N -5.61 4.45 -0.30 0.00 1.04 -1.26 -5.06 113.70 106.96 1n5m s SER 110 Ca -0.15 -0.58 -0.41 0.00 0.48 0.00 0.00 55.95 55.29 1n5m s SER 110 Cb 0.02 -0.82 -0.16 0.00 0.10 0.00 0.00 66.02 65.16 1n5m s SER 110 CO 0.65 0.06 1.71 -2.65 0.98 0.00 0.00 173.24 173.99 1n5m n PRO 111 N -0.35 0.97 -4.28 4.02 -0.02 -1.26 -4.89 135.00 129.18 1n5m n PRO 111 Ca -0.09 0.35 -0.35 0.00 -2.02 0.00 0.00 63.50 61.39 1n5m n PRO 111 Cb 0.57 -2.01 -0.09 0.00 -0.02 0.00 0.00 33.50 31.95 1n5m n PRO 111 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1n5m s THR 112 N 3.35 4.53 0.30 3.45 2.01 0.01 -4.67 115.64 124.63 1n5m s THR 112 Ca 0.99 -0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.54 1n5m s THR 112 Cb -1.14 -2.92 -0.13 0.00 0.01 0.00 0.00 72.50 68.32 1n5m s THR 112 CO 0.68 0.61 1.29 -2.65 -0.69 0.00 0.00 174.62 173.85 1n5m n PRO 113 N 2.14 2.00 -4.01 4.92 -0.02 -1.26 -0.36 135.00 138.40 1n5m n PRO 113 Ca -0.19 0.70 -0.36 0.00 -2.02 0.00 0.00 63.50 61.64 1n5m n PRO 113 Cb 0.54 -2.28 -0.08 0.00 -0.02 0.00 0.00 33.50 31.66 1n5m n PRO 113 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n5m s VAL 114 N -0.77 5.02 -0.17 -1.45 1.01 0.10 -3.31 120.40 120.83 1n5m s VAL 114 Ca 0.60 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.57 1n5m s VAL 114 Cb -0.61 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 1n5m s VAL 114 CO 0.58 0.55 -0.03 -0.76 0.00 0.00 0.00 175.10 175.44 1n5m s LEU 115 N -0.41 3.20 -0.24 3.92 1.43 -0.22 -0.66 118.68 125.71 1n5m s LEU 115 Ca 0.10 -0.18 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 1n5m s LEU 115 Cb -0.12 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.33 1n5m s LEU 115 CO 0.02 0.12 -0.06 -0.63 0.23 0.00 0.00 176.35 176.02 1n5m s ILE 116 N 0.67 2.96 -0.03 -0.59 1.01 0.68 -0.79 121.20 125.11 1n5m s ILE 116 Ca -0.02 -0.90 -0.21 0.00 0.00 0.00 0.00 60.65 59.53 1n5m s ILE 116 Cb -0.14 -2.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.82 1n5m s ILE 116 CO 0.02 0.26 0.60 0.86 0.00 0.00 0.00 174.94 176.69 1n5m s TRP 117 N 1.36 3.65 -0.26 3.97 -0.11 0.64 -1.02 118.94 127.17 1n5m s TRP 117 Ca 0.02 1.18 0.02 0.00 1.22 0.00 0.00 56.10 58.54 1n5m s TRP 117 Cb -0.16 -2.64 0.07 0.00 -1.50 0.00 0.00 33.47 29.23 1n5m s TRP 117 CO -0.05 0.28 -0.07 0.42 -4.62 0.00 0.00 176.95 172.91 1n5m s ILE 118 N 0.09 1.99 0.76 5.86 1.01 -0.05 -3.89 121.20 126.97 1n5m s ILE 118 Ca 0.32 -1.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.23 1n5m s ILE 118 Cb -0.18 -2.19 0.05 0.00 0.01 0.00 0.00 42.46 40.15 1n5m s ILE 118 CO 0.17 -0.13 1.14 -0.72 0.00 0.00 0.00 174.94 175.39 1n5m s TYR 119 N 1.16 2.27 0.00 3.97 -0.85 -1.26 -3.41 117.35 119.23 1n5m s TYR 119 Ca -0.05 1.61 0.00 0.00 -0.52 0.00 0.00 57.07 58.11 1n5m s TYR 119 Cb -0.20 -3.24 0.00 0.00 0.38 0.00 0.00 41.96 38.90 1n5m s TYR 119 CO -0.06 -2.16 0.00 0.41 -1.52 0.00 0.00 175.55 172.22 1n5m n GLY 120 N -0.35 1.89 0.00 5.49 0.00 -1.13 -3.14 105.19 107.95 1n5m n GLY 120 Ca 0.11 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1n5m n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n5m n GLY 121 N 5.00 0.67 2.44 -0.02 0.00 -1.26 -4.24 105.19 107.78 1n5m n GLY 121 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1n5m n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n5m n GLY 122 N 0.00 1.62 3.01 -0.02 0.00 -1.26 -1.37 105.19 107.17 1n5m n GLY 122 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1n5m n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1n5m n PHE 123 N -2.37 0.00 -0.01 1.61 3.72 -1.26 -4.78 117.46 114.37 1n5m n PHE 123 Ca -0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1n5m n PHE 123 Cb 0.62 -0.97 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 1n5m n PHE 123 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1n5m n TYR 124 N -2.24 0.00 -3.82 1.38 0.18 -0.66 0.23 117.16 112.23 1n5m n TYR 124 Ca 0.00 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.68 1n5m n TYR 124 Cb 0.15 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.13 1n5m n TYR 124 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1n5m n SER 125 N -0.07 -2.08 0.00 9.48 3.41 -0.47 -4.06 113.62 119.84 1n5m n SER 125 Ca 0.00 -2.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.00 1n5m n SER 125 Cb 0.00 3.51 0.00 0.00 -0.26 0.00 0.00 64.21 67.46 1n5m n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n5m n GLY 126 N -0.53 2.63 3.58 5.00 0.00 -1.26 -4.13 105.19 110.48 1n5m n GLY 126 Ca -0.07 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.77 1n5m n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5m s ALA 127 N -2.38 -1.91 -1.29 4.61 0.00 -1.26 -4.65 121.76 114.88 1n5m s ALA 127 Ca 0.00 1.61 0.29 0.00 0.00 0.00 0.00 51.96 53.86 1n5m s ALA 127 Cb 0.00 -0.74 1.30 0.00 0.00 0.00 0.00 23.12 23.68 1n5m s ALA 127 CO 0.00 -0.31 1.93 0.00 0.00 0.00 0.00 175.76 177.39 1n5m n ALA 128 N 1.03 2.55 1.30 0.00 0.00 -1.26 -3.67 120.51 120.47 1n5m n ALA 128 Ca -0.12 -0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.29 1n5m n ALA 128 Cb 0.57 -1.43 0.41 0.00 0.00 0.00 0.00 19.45 19.01 1n5m n ALA 128 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1n5m n SER 129 N -1.32 1.85 -4.75 0.00 3.41 -1.26 -4.84 113.62 106.71 1n5m n SER 129 Ca 0.11 -1.65 -0.36 0.00 -0.26 0.00 0.00 58.87 56.71 1n5m n SER 129 Cb 0.29 -0.04 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1n5m n SER 129 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n5m s LEU 130 N -1.87 3.72 0.33 1.04 1.43 -1.24 -4.92 118.68 117.17 1n5m s LEU 130 Ca 0.35 2.43 0.02 0.00 -1.03 0.00 0.00 54.13 55.90 1n5m s LEU 130 Cb 0.20 -4.53 0.60 0.00 0.03 0.00 0.00 46.19 42.50 1n5m s LEU 130 CO 0.31 -1.53 1.97 0.44 0.23 0.00 0.00 176.35 177.77 1n5m h ASP 131 N 1.06 0.79 0.26 2.29 3.32 -1.93 -1.60 116.42 120.61 1n5m h ASP 131 Ca -0.50 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1n5m h ASP 131 Cb 1.29 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1n5m h ASP 131 CO 0.56 0.54 0.00 1.33 -1.72 0.00 0.00 179.24 179.95 1n5m n VAL 132 N -4.45 1.42 -0.58 -1.35 0.24 -1.26 -1.92 118.33 110.42 1n5m n VAL 132 Ca 0.10 0.40 0.08 0.00 -2.04 0.00 0.00 64.34 62.88 1n5m n VAL 132 Cb 0.12 -1.30 0.24 0.00 -1.47 0.00 0.00 33.84 31.42 1n5m n VAL 132 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1n5m n TYR 133 N -1.64 0.86 -1.63 6.34 4.01 -0.60 -4.54 117.16 119.96 1n5m n TYR 133 Ca 0.01 -0.66 -0.44 0.00 -0.16 0.00 0.00 57.90 56.65 1n5m n TYR 133 Cb 0.09 -0.18 -0.03 0.00 -0.31 0.00 0.00 39.34 38.90 1n5m n TYR 133 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1n5m n ASP 134 N 0.26 3.64 -0.15 7.72 -0.08 -0.81 -4.88 116.55 122.26 1n5m n ASP 134 Ca 0.18 0.62 0.11 0.00 -1.51 0.00 0.00 54.79 54.19 1n5m n ASP 134 Cb 0.70 -1.51 0.58 0.00 2.34 0.00 0.00 41.12 43.23 1n5m n ASP 134 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1n5m n GLY 135 N 5.10 -0.66 0.31 0.27 0.00 -1.26 -4.29 105.19 104.66 1n5m n GLY 135 Ca 0.25 -0.22 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 1n5m n GLY 135 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1n5m h ARG 136 N 0.63 0.77 -0.11 1.61 0.11 -1.90 -1.72 114.38 113.77 1n5m h ARG 136 Ca 0.00 -0.10 -0.06 0.00 0.10 0.00 0.00 59.98 59.92 1n5m h ARG 136 Cb 0.14 -0.14 -0.00 0.00 1.11 0.00 0.00 29.97 31.07 1n5m h ARG 136 CO 0.00 0.62 -0.16 0.74 0.10 0.00 0.00 179.97 181.27 1n5m h PHE 137 N 0.77 0.37 -0.79 4.08 0.04 -1.78 0.25 116.94 119.88 1n5m h PHE 137 Ca 0.19 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 60.79 1n5m h PHE 137 Cb 0.12 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 1n5m h PHE 137 CO 0.01 0.76 0.34 -0.07 -0.60 0.00 0.00 178.31 178.76 1n5m h LEU 138 N -0.13 1.07 -0.01 1.54 3.38 -1.70 0.41 115.31 119.87 1n5m h LEU 138 Ca 0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1n5m h LEU 138 Cb 0.73 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1n5m h LEU 138 CO 0.04 0.93 0.01 0.00 0.09 0.00 0.00 178.44 179.50 1n5m h ALA 139 N 1.23 0.02 0.09 1.53 0.00 -1.22 -1.71 119.26 119.19 1n5m h ALA 139 Ca 0.27 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1n5m h ALA 139 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1n5m h ALA 139 CO -0.03 -0.43 -0.04 0.37 0.00 0.00 0.00 179.25 179.12 1n5m h GLN 140 N -0.09 -0.11 0.01 0.00 -0.00 -0.81 -1.48 115.11 112.63 1n5m h GLN 140 Ca 0.00 0.01 -0.20 0.00 -0.00 0.00 0.00 58.65 58.46 1n5m h GLN 140 Cb 0.11 0.03 0.02 0.00 0.00 0.00 0.00 27.48 27.63 1n5m h GLN 140 CO -0.00 0.39 -0.80 0.28 0.00 0.00 0.00 178.83 178.70 1n5m h VAL 141 N -0.70 1.37 -0.03 2.39 2.07 -1.02 -3.33 116.25 116.99 1n5m h VAL 141 Ca -0.01 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 65.33 1n5m h VAL 141 Cb 0.56 2.55 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1n5m h VAL 141 CO 0.02 0.65 -0.03 -0.62 0.02 0.00 0.00 177.57 177.61 1n5m n GLU 142 N -4.06 2.22 -1.48 1.57 -0.58 -0.66 -4.96 120.64 112.68 1n5m n GLU 142 Ca -0.11 -1.86 -0.14 0.00 -0.42 0.00 0.00 57.16 54.64 1n5m n GLU 142 Cb 0.77 -1.45 -0.05 0.00 -0.57 0.00 0.00 31.44 30.13 1n5m n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n5m n GLY 143 N 1.34 1.27 3.81 0.62 0.00 -0.56 -4.98 105.19 106.68 1n5m n GLY 143 Ca 0.14 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1n5m n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5m s ALA 144 N -2.52 2.80 -0.31 4.61 0.00 -1.10 -4.75 121.76 120.49 1n5m s ALA 144 Ca 0.00 0.41 -0.10 0.00 0.00 0.00 0.00 51.96 52.27 1n5m s ALA 144 Cb 0.00 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 1n5m s ALA 144 CO 0.00 -0.66 0.16 0.08 0.00 0.00 0.00 175.76 175.33 1n5m s VAL 145 N -2.39 4.61 -0.10 0.00 1.01 -1.21 -4.22 120.40 118.10 1n5m s VAL 145 Ca 0.64 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1n5m s VAL 145 Cb -0.15 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1n5m s VAL 145 CO 0.33 0.05 -0.10 -0.22 0.00 0.00 0.00 175.10 175.17 1n5m s LEU 146 N 1.61 2.94 -0.03 3.92 0.20 -0.27 -1.05 118.68 126.00 1n5m s LEU 146 Ca 0.04 -0.18 0.05 0.00 0.69 0.00 0.00 54.13 54.74 1n5m s LEU 146 Cb -0.17 -1.65 -0.01 0.00 -0.43 0.00 0.00 46.19 43.93 1n5m s LEU 146 CO 0.06 0.26 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.52 1n5m s VAL 147 N -0.23 1.43 -0.01 1.68 1.01 0.03 -0.89 120.40 123.43 1n5m s VAL 147 Ca 0.02 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1n5m s VAL 147 Cb -0.13 -1.21 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1n5m s VAL 147 CO 0.03 0.41 -0.01 -0.94 0.00 0.00 0.00 175.10 174.59 1n5m s SER 148 N -0.13 0.23 0.19 3.32 1.04 -0.60 -0.26 113.70 117.50 1n5m s SER 148 Ca 0.00 -0.03 0.10 0.00 0.48 0.00 0.00 55.95 56.51 1n5m s SER 148 Cb -0.10 -0.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 1n5m s SER 148 CO 0.01 -0.01 -0.21 0.00 0.98 0.00 0.00 173.24 174.01 1n5m s MET 149 N 0.22 1.45 0.23 4.02 0.23 -1.25 0.11 119.30 124.30 1n5m s MET 149 Ca -0.02 -1.51 -0.14 0.00 -1.03 0.00 0.00 55.69 52.99 1n5m s MET 149 Cb -0.04 -1.64 -0.08 0.00 -1.53 0.00 0.00 34.83 31.54 1n5m s MET 149 CO -0.01 0.34 0.62 -0.80 -2.03 0.00 0.00 175.02 173.15 1n5m s ASN 150 N -2.77 6.79 0.01 -1.18 0.01 -0.40 -4.49 114.94 112.90 1n5m s ASN 150 Ca 0.20 1.14 -0.02 0.00 -0.71 0.00 0.00 52.86 53.47 1n5m s ASN 150 Cb -0.07 -2.31 -0.01 0.00 0.41 0.00 0.00 41.25 39.27 1n5m s ASN 150 CO 0.09 -0.04 0.01 -0.72 -1.51 0.00 0.00 177.10 174.94 1n5m s TYR 151 N -1.71 0.19 0.34 2.20 1.13 -1.26 -4.52 117.35 113.71 1n5m s TYR 151 Ca 0.46 -0.39 -0.29 0.00 -1.41 0.00 0.00 57.07 55.44 1n5m s TYR 151 Cb -0.13 -0.14 -0.11 0.00 -1.10 0.00 0.00 41.96 40.48 1n5m s TYR 151 CO 0.20 -0.20 1.38 1.03 -2.51 0.00 0.00 175.55 175.44 1n5m s ARG 152 N -1.34 4.27 0.41 -3.49 0.52 -1.26 -4.85 118.95 113.21 1n5m s ARG 152 Ca -0.15 2.34 0.04 0.00 -0.52 0.00 0.00 55.73 57.45 1n5m s ARG 152 Cb -0.09 -3.04 -0.05 0.00 0.52 0.00 0.00 34.95 32.30 1n5m s ARG 152 CO -0.00 -0.32 0.04 0.14 0.02 0.00 0.00 175.30 175.18 1n5m s VAL 153 N -1.03 1.29 0.00 3.52 -7.23 -1.26 -4.20 120.40 111.48 1n5m s VAL 153 Ca 0.51 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.68 1n5m s VAL 153 Cb -0.42 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 33.92 1n5m s VAL 153 CO 0.55 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.95 1n5m n GLY 154 N -0.96 1.67 0.27 2.32 0.00 0.14 -2.33 105.19 106.29 1n5m n GLY 154 Ca -0.08 -0.53 -0.06 0.00 0.00 0.00 0.00 46.02 45.35 1n5m n GLY 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1n5m h THR 155 N 0.00 1.18 -0.52 2.61 1.35 -1.89 0.15 112.91 115.79 1n5m h THR 155 Ca 0.00 -0.39 0.10 0.00 -0.55 0.00 0.00 66.41 65.58 1n5m h THR 155 Cb 0.00 0.25 -0.03 0.00 -1.73 0.00 0.00 68.15 66.64 1n5m h THR 155 CO 0.00 0.19 0.36 -0.26 -0.25 0.00 0.00 175.52 175.55 1n5m h PHE 156 N 0.90 0.27 0.00 4.73 0.04 -1.89 -0.37 116.94 120.62 1n5m h PHE 156 Ca 0.24 0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.02 1n5m h PHE 156 Cb -0.05 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.01 1n5m h PHE 156 CO -0.02 0.13 -1.55 0.41 -0.60 0.00 0.00 178.31 176.68 1n5m n GLY 157 N -1.56 -0.75 0.00 -1.45 0.00 -0.98 -4.18 105.19 96.28 1n5m n GLY 157 Ca 0.08 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1n5m n GLY 157 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1n5m n PHE 158 N -1.93 0.00 -1.97 1.61 3.72 0.01 -0.87 117.46 118.03 1n5m n PHE 158 Ca -0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.97 1n5m n PHE 158 Cb 0.41 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.92 1n5m n PHE 158 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1n5m s LEU 159 N -0.07 4.38 -0.01 4.37 0.20 -0.17 -4.48 118.68 122.90 1n5m s LEU 159 Ca 0.00 2.68 -0.05 0.00 0.69 0.00 0.00 54.13 57.45 1n5m s LEU 159 Cb 0.00 -3.62 -0.00 0.00 -0.43 0.00 0.00 46.19 42.14 1n5m s LEU 159 CO 0.00 -0.75 0.09 0.00 -0.29 0.00 0.00 176.35 175.40 1n5m s ALA 160 N 0.25 -0.21 -0.57 5.97 0.00 -1.26 -4.28 121.76 121.65 1n5m s ALA 160 Ca 0.62 -0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.51 1n5m s ALA 160 Cb -0.43 0.04 0.15 0.00 0.00 0.00 0.00 23.12 22.88 1n5m s ALA 160 CO 0.41 -0.15 0.36 -0.51 0.00 0.00 0.00 175.76 175.87 1n5m s LEU 161 N -1.00 3.90 0.02 0.00 1.43 -0.09 -3.78 118.68 119.15 1n5m s LEU 161 Ca -0.11 -3.30 -0.38 0.00 -1.03 0.00 0.00 54.13 49.31 1n5m s LEU 161 Cb -0.06 -1.39 -0.18 0.00 0.03 0.00 0.00 46.19 44.59 1n5m s LEU 161 CO 0.01 -0.17 1.29 -2.65 0.23 0.00 0.00 176.35 175.06 1n5m n PRO 162 N 2.69 0.75 0.00 1.29 -0.02 -1.26 -1.16 135.00 137.29 1n5m n PRO 162 Ca 0.14 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1n5m n PRO 162 Cb 0.35 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1n5m n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n5m n GLY 163 N 2.36 3.19 3.73 -1.23 0.00 -1.26 -5.05 105.19 106.93 1n5m n GLY 163 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1n5m n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n5m s SER 164 N -0.22 3.55 -0.12 1.61 1.04 -0.31 -4.98 113.70 114.26 1n5m s SER 164 Ca 0.00 1.41 0.12 0.00 0.48 0.00 0.00 55.95 57.96 1n5m s SER 164 Cb 0.00 -2.10 -0.24 0.00 0.10 0.00 0.00 66.02 63.79 1n5m s SER 164 CO 0.00 -2.58 0.37 -1.14 0.98 0.00 0.00 173.24 170.87 1n5m n ARG 165 N -3.84 0.66 0.06 4.02 0.63 -1.26 -4.06 116.66 112.87 1n5m n ARG 165 Ca 0.07 0.18 0.13 0.00 -0.92 0.00 0.00 57.85 57.30 1n5m n ARG 165 Cb 0.56 -1.67 0.33 0.00 0.45 0.00 0.00 32.46 32.13 1n5m n ARG 165 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1n5m n GLU 166 N -3.00 0.19 -2.87 -0.14 4.71 -1.26 -4.43 120.64 113.85 1n5m n GLU 166 Ca -0.26 0.10 -0.12 0.00 -0.01 0.00 0.00 57.16 56.87 1n5m n GLU 166 Cb 1.09 -1.67 0.02 0.00 -1.01 0.00 0.00 31.44 29.87 1n5m n GLU 166 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1n5m n ALA 167 N -1.71 -0.37 0.31 0.62 0.00 -1.26 -4.27 120.51 113.82 1n5m n ALA 167 Ca 0.05 -1.94 0.16 0.00 0.00 0.00 0.00 53.44 51.72 1n5m n ALA 167 Cb 0.41 -1.19 0.67 0.00 0.00 0.00 0.00 19.45 19.33 1n5m n ALA 167 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1n5m h PRO 168 N 3.93 0.00 0.00 0.00 0.13 -1.74 -0.22 132.00 134.09 1n5m h PRO 168 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1n5m h PRO 168 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1n5m h PRO 168 CO 0.35 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.53 1n5m n GLY 169 N -0.08 0.86 2.29 1.56 0.00 -1.26 -4.69 105.19 103.86 1n5m n GLY 169 Ca 0.01 -1.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.05 1n5m n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n5m n ASN 170 N -0.55 -4.42 0.26 1.61 3.02 -1.26 -4.86 115.26 109.06 1n5m n ASN 170 Ca 0.00 0.39 0.12 0.00 -0.03 0.00 0.00 54.58 55.06 1n5m n ASN 170 Cb 0.00 -3.99 0.70 0.00 -0.61 0.00 0.00 39.78 35.88 1n5m n ASN 170 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1n5m h VAL 171 N 0.00 0.63 -0.25 2.41 -1.51 -1.83 -0.97 116.25 114.74 1n5m h VAL 171 Ca -0.34 -0.55 -0.09 0.00 -1.23 0.00 0.00 66.70 64.49 1n5m h VAL 171 Cb 1.10 1.35 -0.01 0.00 -2.13 0.00 0.00 31.29 31.59 1n5m h VAL 171 CO 0.50 0.13 -0.22 1.23 -1.23 0.00 0.00 177.57 177.97 1n5m h GLY 172 N 0.83 0.49 1.62 5.19 0.00 -1.21 0.26 103.07 110.25 1n5m h GLY 172 Ca -0.00 -0.38 -0.15 0.00 0.00 0.00 0.00 47.33 46.80 1n5m h GLY 172 CO 0.02 0.35 -0.55 1.41 0.00 0.00 0.00 176.54 177.77 1n5m h LEU 173 N 0.41 0.44 -0.89 3.11 3.38 -1.47 -2.46 115.31 117.83 1n5m h LEU 173 Ca 0.06 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 1n5m h LEU 173 Cb 0.62 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1n5m h LEU 173 CO 0.04 0.90 -0.45 -0.07 0.09 0.00 0.00 178.44 178.96 1n5m h LEU 174 N 0.31 0.25 -0.37 1.67 3.38 -0.48 -0.78 115.31 119.29 1n5m h LEU 174 Ca 0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1n5m h LEU 174 Cb 1.06 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1n5m h LEU 174 CO 0.09 0.67 0.20 0.44 0.09 0.00 0.00 178.44 179.93 1n5m h ASP 175 N 0.19 0.47 -0.54 -0.43 3.32 -0.25 -0.03 116.42 119.15 1n5m h ASP 175 Ca 0.01 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1n5m h ASP 175 Cb 0.87 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 1n5m h ASP 175 CO 0.07 0.43 0.25 1.56 -1.72 0.00 0.00 179.24 179.83 1n5m h GLN 176 N 0.47 0.78 -0.89 3.56 4.20 -1.06 -2.24 115.11 119.93 1n5m h GLN 176 Ca 0.13 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1n5m h GLN 176 Cb 0.07 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 1n5m h GLN 176 CO -0.02 0.65 0.50 -0.09 -0.67 0.00 0.00 178.83 179.21 1n5m h ARG 177 N 0.73 1.22 -0.66 1.46 2.43 -0.79 -0.72 114.38 118.05 1n5m h ARG 177 Ca 0.18 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1n5m h ARG 177 Cb 0.13 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1n5m h ARG 177 CO -0.02 0.88 0.27 1.25 -1.51 0.00 0.00 179.97 180.84 1n5m h LEU 178 N 1.23 0.89 -0.81 3.80 5.85 -0.68 -0.79 115.31 124.80 1n5m h LEU 178 Ca 0.31 -0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.79 1n5m h LEU 178 Cb -0.00 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1n5m h LEU 178 CO -0.05 0.80 -0.39 0.00 -0.34 0.00 0.00 178.44 178.45 1n5m h ALA 179 N 1.33 0.98 -0.48 1.25 0.00 -0.78 0.95 119.26 122.52 1n5m h ALA 179 Ca 0.22 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1n5m h ALA 179 Cb 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1n5m h ALA 179 CO -0.02 0.61 -0.00 -0.07 0.00 0.00 0.00 179.25 179.77 1n5m h LEU 180 N 0.35 0.77 -0.45 0.00 3.38 -0.24 -0.60 115.31 118.51 1n5m h LEU 180 Ca 0.03 -0.19 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 1n5m h LEU 180 Cb 0.84 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1n5m h LEU 180 CO 0.07 0.83 -0.49 1.56 0.09 0.00 0.00 178.44 180.51 1n5m h GLN 181 N 0.75 0.74 -0.98 1.13 4.20 -0.66 -1.91 115.11 118.38 1n5m h GLN 181 Ca 0.14 -0.43 0.03 0.00 0.06 0.00 0.00 58.65 58.45 1n5m h GLN 181 Cb 0.45 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 1n5m h GLN 181 CO 0.02 1.06 0.64 2.35 -0.67 0.00 0.00 178.83 182.23 1n5m h TRP 182 N 0.58 1.21 -0.47 2.96 7.01 -0.39 -1.09 115.95 125.77 1n5m h TRP 182 Ca 0.03 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.00 1n5m h TRP 182 Cb 1.05 -0.41 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 1n5m h TRP 182 CO 0.06 0.72 0.06 0.28 -2.79 0.00 0.00 178.44 176.76 1n5m h VAL 183 N 1.27 1.25 -0.47 2.65 2.07 -0.72 0.58 116.25 122.88 1n5m h VAL 183 Ca 0.38 -0.94 0.06 0.00 0.82 0.00 0.00 66.70 67.02 1n5m h VAL 183 Cb -0.05 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1n5m h VAL 183 CO -0.11 0.33 0.18 1.56 0.02 0.00 0.00 177.57 179.55 1n5m h GLN 184 N 0.65 0.35 0.00 1.57 1.08 -0.55 -0.61 115.11 117.61 1n5m h GLN 184 Ca 0.14 -0.02 -0.20 0.00 -1.45 0.00 0.00 58.65 57.12 1n5m h GLN 184 Cb 0.41 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.75 1n5m h GLN 184 CO 0.01 0.23 -0.87 1.49 -0.95 0.00 0.00 178.83 178.74 1n5m h GLU 185 N 0.36 0.19 0.00 1.46 4.81 -1.02 -3.41 114.58 116.98 1n5m h GLU 185 Ca 0.22 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1n5m h GLU 185 Cb 0.20 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1n5m h GLU 185 CO -0.21 0.95 -0.79 0.09 -0.73 0.00 0.00 179.01 178.32 1n5m n ASN 186 N -3.65 1.84 0.25 1.04 3.02 0.18 -4.72 115.26 113.20 1n5m n ASN 186 Ca -0.03 -0.34 0.09 0.00 -0.03 0.00 0.00 54.58 54.27 1n5m n ASN 186 Cb 0.81 1.15 0.63 0.00 -0.61 0.00 0.00 39.78 41.76 1n5m n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1n5m h ILE 187 N 0.00 0.88 -0.10 2.41 6.09 -1.28 -1.56 117.51 123.95 1n5m h ILE 187 Ca 0.00 -0.48 -0.00 0.00 -1.37 0.00 0.00 64.86 63.01 1n5m h ILE 187 Cb 0.23 1.28 -0.01 0.00 0.47 0.00 0.00 36.82 38.79 1n5m h ILE 187 CO 0.00 0.13 0.05 0.00 -3.07 0.00 0.00 178.15 175.26 1n5m h ALA 188 N 1.87 1.91 0.00 0.18 0.00 -1.79 0.11 119.26 121.54 1n5m h ALA 188 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1n5m h ALA 188 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1n5m h ALA 188 CO 0.02 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.35 1n5m h ALA 189 N 1.92 1.00 -0.02 0.00 0.00 -1.58 -0.87 119.26 119.72 1n5m h ALA 189 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n5m h ALA 189 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1n5m h ALA 189 CO -0.01 0.00 -0.06 1.19 0.00 0.00 0.00 179.25 180.38 1n5m n PHE 190 N -2.63 0.00 -0.16 0.00 3.01 0.27 -4.88 117.46 113.06 1n5m n PHE 190 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1n5m n PHE 190 Cb 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.59 1n5m n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1n5m n GLY 191 N 1.02 0.84 3.88 1.37 0.00 -0.33 -4.46 105.19 107.51 1n5m n GLY 191 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1n5m n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n5m s GLY 192 N -1.80 2.01 -0.43 -0.02 0.00 -0.52 -0.81 107.32 105.76 1n5m s GLY 192 Ca 0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 44.72 44.33 1n5m s GLY 192 CO 0.00 -0.06 0.34 -0.35 0.00 0.00 0.00 173.10 173.02 1n5m s ASP 193 N -2.96 6.13 0.19 1.64 -1.08 0.51 -3.20 116.67 117.90 1n5m s ASP 193 Ca 0.50 -1.01 0.19 0.00 -0.52 0.00 0.00 52.55 51.71 1n5m s ASP 193 Cb -0.10 -2.17 0.84 0.00 -1.46 0.00 0.00 42.92 40.03 1n5m s ASP 193 CO 0.28 -0.52 1.57 -0.81 0.52 0.00 0.00 175.17 176.21 1n5m n PRO 194 N 5.21 0.12 0.00 4.34 -0.04 -1.26 -1.40 135.00 141.97 1n5m n PRO 194 Ca -0.11 0.45 0.14 0.00 -0.04 0.00 0.00 63.50 63.94 1n5m n PRO 194 Cb 0.46 -1.78 0.59 0.00 -0.04 0.00 0.00 33.50 32.73 1n5m n PRO 194 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1n5m n MET 195 N -2.02 0.43 -3.51 0.54 2.81 -1.26 -4.41 117.12 109.70 1n5m n MET 195 Ca 0.01 -0.12 -0.28 0.00 -1.81 0.00 0.00 57.70 55.50 1n5m n MET 195 Cb 0.14 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.04 1n5m n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1n5m s SER 196 N -2.66 2.54 -0.15 7.83 0.15 -0.49 -4.92 113.70 116.00 1n5m s SER 196 Ca 0.24 -2.82 0.01 0.00 0.70 0.00 0.00 55.95 54.08 1n5m s SER 196 Cb 0.20 -0.63 0.01 0.00 -1.71 0.00 0.00 66.02 63.88 1n5m s SER 196 CO 0.51 -0.22 -0.19 -0.69 1.20 0.00 0.00 173.24 173.85 1n5m s VAL 197 N 0.25 2.25 -0.15 4.45 1.01 -1.26 0.01 120.40 126.96 1n5m s VAL 197 Ca 0.25 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 1n5m s VAL 197 Cb -0.09 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1n5m s VAL 197 CO -0.10 0.54 -0.13 -0.89 0.00 0.00 0.00 175.10 174.51 1n5m s THR 198 N 0.91 2.88 0.01 3.92 2.01 0.17 -0.35 115.64 125.20 1n5m s THR 198 Ca -0.04 -0.70 -0.19 0.00 0.31 0.00 0.00 61.69 61.07 1n5m s THR 198 Cb -0.15 -2.23 -0.06 0.00 0.01 0.00 0.00 72.50 70.08 1n5m s THR 198 CO -0.03 0.51 0.55 -0.76 -0.69 0.00 0.00 174.62 174.20 1n5m s LEU 199 N 0.72 4.45 -0.01 4.42 1.43 -0.46 -0.23 118.68 129.01 1n5m s LEU 199 Ca -0.06 1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 54.15 1n5m s LEU 199 Cb -0.15 -2.85 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1n5m s LEU 199 CO 0.02 0.18 0.07 0.72 0.23 0.00 0.00 176.35 177.57 1n5m s PHE 200 N -0.57 0.02 0.18 0.29 -0.71 -0.19 -0.06 117.98 116.94 1n5m s PHE 200 Ca 0.29 -0.04 -0.24 0.00 -1.04 0.00 0.00 56.93 55.90 1n5m s PHE 200 Cb -0.18 -0.04 0.05 0.00 -1.21 0.00 0.00 43.02 41.64 1n5m s PHE 200 CO 0.17 -0.14 0.80 0.20 -1.34 0.00 0.00 175.22 174.90 1n5m s GLY 201 N -0.68 -0.29 0.05 1.99 0.00 -1.07 -0.87 107.32 106.45 1n5m s GLY 201 Ca -0.08 0.16 0.06 0.00 0.00 0.00 0.00 44.72 44.86 1n5m s GLY 201 CO 0.00 0.04 -0.17 1.85 0.00 0.00 0.00 173.10 174.83 1n5m s GLU 202 N -3.58 1.09 6.66 2.90 -6.30 -1.22 -1.47 118.70 116.78 1n5m s GLU 202 Ca 0.09 -0.88 0.00 0.00 -2.50 0.00 0.00 54.97 51.68 1n5m s GLU 202 Cb -0.03 -1.16 0.00 0.00 0.00 0.00 0.00 34.13 32.94 1n5m s GLU 202 CO -0.00 0.29 0.00 0.45 0.02 0.00 0.00 175.26 176.01 1n5m n SER 203 N 1.74 0.00 0.18 -1.70 2.88 -0.04 -0.33 113.62 116.34 1n5m n SER 203 Ca -0.18 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.50 1n5m n SER 203 Cb 0.54 0.00 0.73 0.00 -0.75 0.00 0.00 64.21 64.73 1n5m n SER 203 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n5m h ALA 204 N -0.83 2.04 -0.50 -1.46 0.00 -1.86 -0.03 119.26 116.62 1n5m h ALA 204 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1n5m h ALA 204 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1n5m h ALA 204 CO 0.00 -0.25 0.00 0.78 0.00 0.00 0.00 179.25 179.78 1n5m h GLY 205 N 0.00 0.95 0.96 0.00 0.00 -0.63 0.46 103.07 104.81 1n5m h GLY 205 Ca 0.09 -0.70 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 1n5m h GLY 205 CO -0.00 0.64 -0.09 0.00 0.00 0.00 0.00 176.54 177.09 1n5m h ALA 206 N 0.93 0.51 -0.95 3.60 0.00 -1.18 -0.53 119.26 121.64 1n5m h ALA 206 Ca 0.14 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1n5m h ALA 206 Cb 0.51 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1n5m h ALA 206 CO 0.03 0.37 0.63 0.00 0.00 0.00 0.00 179.25 180.28 1n5m h ALA 207 N 0.83 1.21 -0.14 0.00 0.00 -0.86 -0.51 119.26 119.79 1n5m h ALA 207 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n5m h ALA 207 Cb 0.61 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1n5m h ALA 207 CO 0.04 0.59 0.09 0.77 0.00 0.00 0.00 179.25 180.74 1n5m h SER 208 N 1.28 0.16 -0.68 0.00 0.02 -0.52 -0.05 113.55 113.76 1n5m h SER 208 Ca 0.35 -0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.38 1n5m h SER 208 Cb -0.13 -0.04 -0.06 0.00 0.14 0.00 0.00 62.40 62.30 1n5m h SER 208 CO -0.08 0.12 0.35 0.58 -1.14 0.00 0.00 176.83 176.65 1n5m h VAL 209 N 0.19 0.89 -0.54 2.27 2.07 -0.63 -0.96 116.25 119.54 1n5m h VAL 209 Ca 0.05 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 1n5m h VAL 209 Cb -0.02 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 29.94 1n5m h VAL 209 CO -0.01 0.11 0.21 1.23 0.02 0.00 0.00 177.57 179.13 1n5m h GLY 210 N 0.61 0.84 2.00 2.17 0.00 -0.39 -1.62 103.07 106.68 1n5m h GLY 210 Ca 0.32 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 1n5m h GLY 210 CO -0.24 0.40 -0.49 -0.33 0.00 0.00 0.00 176.54 175.89 1n5m h MET 211 N 0.77 0.00 -0.05 4.80 2.86 0.18 -1.67 114.93 121.83 1n5m h MET 211 Ca 0.18 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.71 1n5m h MET 211 Cb 0.17 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1n5m h MET 211 CO -0.02 0.49 -0.51 0.45 1.06 0.00 0.00 176.91 178.38 1n5m h HIS 212 N 0.00 0.15 -0.25 -0.22 3.86 -0.33 -1.26 115.15 117.10 1n5m h HIS 212 Ca -0.00 -0.05 -0.10 0.00 -1.16 0.00 0.00 60.37 59.06 1n5m h HIS 212 Cb 0.93 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.36 1n5m h HIS 212 CO 0.00 0.61 -0.25 0.82 0.86 0.00 0.00 177.93 179.97 1n5m h ILE 213 N 0.10 1.27 -0.01 2.45 2.04 -0.82 -2.97 117.51 119.56 1n5m h ILE 213 Ca 0.00 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.59 1n5m h ILE 213 Cb 0.94 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1n5m h ILE 213 CO 0.07 0.40 -0.04 0.18 0.00 0.00 0.00 178.15 178.77 1n5m n LEU 214 N -4.12 1.53 -4.26 1.44 4.77 -0.68 -4.78 117.00 110.91 1n5m n LEU 214 Ca -0.00 -0.50 -0.36 0.00 -0.03 0.00 0.00 56.01 55.12 1n5m n LEU 214 Cb 0.41 -0.02 -0.14 0.00 -2.33 0.00 0.00 43.42 41.34 1n5m n LEU 214 CO 0.42 0.26 -0.35 -0.55 -1.33 0.00 0.00 177.39 175.84 1n5m s SER 215 N -2.08 4.68 0.18 -1.43 0.15 -0.52 -4.80 113.70 109.88 1n5m s SER 215 Ca 0.35 -0.83 -0.24 0.00 0.70 0.00 0.00 55.95 55.94 1n5m s SER 215 Cb 0.21 -1.75 0.07 0.00 -1.71 0.00 0.00 66.02 62.84 1n5m s SER 215 CO 0.36 -0.16 1.57 -0.07 1.20 0.00 0.00 173.24 176.14 1n5m h LEU 216 N 8.10 -1.46 -2.08 3.45 -0.00 -1.86 -0.84 115.31 120.63 1n5m h LEU 216 Ca -0.31 0.25 0.10 0.00 -0.00 0.00 0.00 57.88 57.92 1n5m h LEU 216 Cb 1.11 0.68 -0.01 0.00 -0.00 0.00 0.00 40.66 42.44 1n5m h LEU 216 CO 0.58 -0.32 0.33 -0.65 -0.00 0.00 0.00 178.44 178.38 1n5m h PRO 217 N -0.17 0.00 0.00 1.13 0.11 -1.96 -0.59 132.00 130.52 1n5m h PRO 217 Ca 0.21 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.18 1n5m h PRO 217 Cb 0.56 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 1n5m h PRO 217 CO -0.74 0.00 -0.76 0.77 -0.21 0.00 0.00 178.00 177.06 1n5m h SER 218 N 0.00 0.00 -0.65 -2.05 0.02 -1.39 -3.36 113.55 106.12 1n5m h SER 218 Ca 0.17 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 61.26 1n5m h SER 218 Cb 0.82 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.32 1n5m h SER 218 CO -0.00 0.60 0.45 0.03 -1.14 0.00 0.00 176.83 176.76 1n5m h ARG 219 N 0.00 0.24 -0.01 3.45 2.47 -0.89 0.11 114.38 119.75 1n5m h ARG 219 Ca -0.04 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 1n5m h ARG 219 Cb 1.49 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.75 1n5m h ARG 219 CO 0.07 0.16 0.00 -1.13 0.56 0.00 0.00 179.97 179.63 1n5m n SER 220 N -4.44 0.22 -0.76 7.04 3.41 -1.25 -3.71 113.62 114.12 1n5m n SER 220 Ca 0.12 -1.26 0.10 0.00 -0.26 0.00 0.00 58.87 57.57 1n5m n SER 220 Cb 0.54 -0.01 0.07 0.00 -0.26 0.00 0.00 64.21 64.56 1n5m n SER 220 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n5m n LEU 221 N -0.74 2.58 -3.81 1.04 4.77 0.38 -5.00 117.00 116.22 1n5m n LEU 221 Ca 0.19 -0.97 -0.09 0.00 -0.03 0.00 0.00 56.01 55.12 1n5m n LEU 221 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 1n5m n LEU 221 CO 0.14 0.45 0.33 0.72 -1.33 0.00 0.00 177.39 177.70 1n5m s PHE 222 N -1.78 -0.08 -0.01 -1.77 -0.71 -1.24 -4.90 117.98 107.50 1n5m s PHE 222 Ca 0.23 -0.30 0.01 0.00 -1.04 0.00 0.00 56.93 55.82 1n5m s PHE 222 Cb 0.17 0.47 -0.01 0.00 -1.21 0.00 0.00 43.02 42.44 1n5m s PHE 222 CO 0.29 -1.04 0.00 0.72 -1.34 0.00 0.00 175.22 173.86 1n5m n HIS 223 N -0.39 0.00 -4.04 3.49 8.25 0.53 -4.93 115.22 118.12 1n5m n HIS 223 Ca -0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.31 1n5m n HIS 223 Cb 0.61 -0.03 -0.09 0.00 1.12 0.00 0.00 29.99 31.60 1n5m n HIS 223 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1n5m s ARG 224 N -2.02 0.74 -0.02 -0.41 0.52 -1.13 -4.39 118.95 112.24 1n5m s ARG 224 Ca -0.00 -1.19 -0.06 0.00 -0.52 0.00 0.00 55.73 53.96 1n5m s ARG 224 Cb 0.00 0.25 0.01 0.00 0.52 0.00 0.00 34.95 35.73 1n5m s ARG 224 CO 0.03 -0.18 0.13 0.00 0.02 0.00 0.00 175.30 175.29 1n5m s ALA 225 N -3.93 -0.30 -0.14 2.13 0.00 -0.98 -1.35 121.76 117.18 1n5m s ALA 225 Ca 0.10 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1n5m s ALA 225 Cb 0.07 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1n5m s ALA 225 CO -0.08 -0.14 -0.16 0.08 0.00 0.00 0.00 175.76 175.46 1n5m s VAL 226 N -0.71 1.69 -0.32 0.00 1.01 0.91 -1.23 120.40 121.75 1n5m s VAL 226 Ca -0.08 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1n5m s VAL 226 Cb -0.05 -1.55 0.07 0.00 0.00 0.00 0.00 36.38 34.85 1n5m s VAL 226 CO 0.01 0.48 0.04 -0.76 0.00 0.00 0.00 175.10 174.86 1n5m s LEU 227 N 1.22 4.21 -0.34 3.92 1.02 0.35 -2.61 118.68 126.45 1n5m s LEU 227 Ca -0.00 -1.49 -0.13 0.00 0.02 0.00 0.00 54.13 52.53 1n5m s LEU 227 Cb -0.14 -1.72 -0.02 0.00 0.02 0.00 0.00 46.19 44.33 1n5m s LEU 227 CO -0.07 -0.32 0.27 -1.10 0.02 0.00 0.00 176.35 175.15 1n5m s GLN 228 N 1.20 3.52 -1.45 1.70 -0.21 -0.54 -2.38 119.66 121.50 1n5m s GLN 228 Ca -0.02 -0.57 -0.05 0.00 0.02 0.00 0.00 55.36 54.74 1n5m s GLN 228 Cb -0.20 -3.80 0.04 0.00 1.00 0.00 0.00 33.01 30.04 1n5m s GLN 228 CO -0.02 -0.46 0.60 0.43 -2.12 0.00 0.00 175.29 173.72 1n5m n SER 229 N 5.18 -1.50 -3.60 5.90 7.64 0.21 -0.86 113.62 126.58 1n5m n SER 229 Ca -0.12 -0.94 -0.05 0.00 1.01 0.00 0.00 58.87 58.77 1n5m n SER 229 Cb 0.50 -3.31 -0.03 0.00 -1.01 0.00 0.00 64.21 60.35 1n5m n SER 229 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1n5m s GLY 230 N -4.07 -0.18 0.06 0.23 0.00 -1.26 -3.10 107.32 99.00 1n5m s GLY 230 Ca 0.20 2.05 -0.17 0.00 0.00 0.00 0.00 44.72 46.80 1n5m s GLY 230 CO 0.87 0.81 0.40 -0.51 0.00 0.00 0.00 173.10 174.68 1n5m s THR 231 N -1.72 0.06 0.17 0.90 -4.23 -1.26 -4.31 115.64 105.25 1n5m s THR 231 Ca 0.06 -0.50 0.14 0.00 -1.18 0.00 0.00 61.69 60.21 1n5m s THR 231 Cb -0.01 -1.00 0.02 0.00 1.34 0.00 0.00 72.50 72.85 1n5m s THR 231 CO -0.04 -0.28 1.60 1.55 -0.54 0.00 0.00 174.62 176.91 1n5m h PRO 232 N 2.87 0.00 -7.40 3.99 0.13 -1.82 -3.40 132.00 126.37 1n5m h PRO 232 Ca -0.32 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.36 1n5m h PRO 232 Cb 1.22 0.00 0.11 0.00 0.13 0.00 0.00 31.00 32.45 1n5m h PRO 232 CO 0.44 0.56 0.25 0.54 -0.23 0.00 0.00 178.00 179.56 1n5m s ASN 233 N -6.63 4.16 0.00 1.44 4.22 -1.26 -4.55 114.94 112.32 1n5m s ASN 233 Ca 0.00 0.15 0.00 0.00 -2.14 0.00 0.00 52.86 50.87 1n5m s ASN 233 Cb 0.11 -0.53 0.00 0.00 1.28 0.00 0.00 41.25 42.11 1n5m s ASN 233 CO 0.74 -2.02 0.00 0.61 -2.04 0.00 0.00 177.10 174.39 1n5m n GLY 234 N -3.14 1.74 0.02 0.45 0.00 -1.26 -4.73 105.19 98.27 1n5m n GLY 234 Ca 0.12 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.14 1n5m n GLY 234 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n5m n PRO 235 N 0.09 0.04 0.00 1.61 -0.04 -1.26 -4.31 135.00 131.12 1n5m n PRO 235 Ca 0.00 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1n5m n PRO 235 Cb 0.00 -1.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1n5m n PRO 235 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1n5m n TRP 236 N -1.62 0.00 0.26 0.54 4.27 -1.26 -4.80 117.44 114.82 1n5m n TRP 236 Ca 0.05 0.00 0.15 0.00 -3.89 0.00 0.00 57.50 53.82 1n5m n TRP 236 Cb 0.29 0.00 0.57 0.00 -1.36 0.00 0.00 31.31 30.81 1n5m n TRP 236 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1n5m h ALA 237 N 0.00 1.00 -2.35 -1.67 0.00 -1.84 -3.43 119.26 110.97 1n5m h ALA 237 Ca 0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1n5m h ALA 237 Cb 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 17.64 1n5m h ALA 237 CO 0.00 0.06 -0.56 0.95 0.00 0.00 0.00 179.25 179.70 1n5m s THR 238 N -3.60 0.19 0.12 0.00 -4.23 -1.26 -3.67 115.64 103.19 1n5m s THR 238 Ca 0.02 -1.56 0.04 0.00 -1.18 0.00 0.00 61.69 59.01 1n5m s THR 238 Cb 0.09 -1.45 -0.04 0.00 1.34 0.00 0.00 72.50 72.43 1n5m s THR 238 CO 0.58 -0.86 -0.11 0.68 -0.54 0.00 0.00 174.62 174.37 1n5m s VAL 239 N -3.90 1.11 0.81 2.29 -7.23 -0.68 -4.99 120.40 107.80 1n5m s VAL 239 Ca 0.06 -1.85 -0.11 0.00 -1.81 0.00 0.00 61.98 58.28 1n5m s VAL 239 Cb 0.07 -1.61 0.08 0.00 0.56 0.00 0.00 36.38 35.47 1n5m s VAL 239 CO -0.10 -0.62 1.09 -0.94 -0.31 0.00 0.00 175.10 174.21 1n5m s SER 240 N -2.78 4.29 0.21 4.85 1.04 -1.26 -1.33 113.70 118.72 1n5m s SER 240 Ca 0.11 1.50 -0.10 0.00 0.48 0.00 0.00 55.95 57.95 1n5m s SER 240 Cb -0.01 -2.23 0.18 0.00 0.10 0.00 0.00 66.02 64.06 1n5m s SER 240 CO 0.01 -2.12 1.88 0.00 0.98 0.00 0.00 173.24 173.98 1n5m h ALA 241 N -1.19 0.99 -0.73 5.32 0.00 -1.94 -1.28 119.26 120.43 1n5m h ALA 241 Ca -0.47 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.43 1n5m h ALA 241 Cb 1.26 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1n5m h ALA 241 CO 0.56 0.37 0.46 0.78 0.00 0.00 0.00 179.25 181.42 1n5m h GLY 242 N 1.02 1.06 1.43 0.00 0.00 -1.93 -1.02 103.07 103.63 1n5m h GLY 242 Ca 0.29 -0.35 -0.15 0.00 0.00 0.00 0.00 47.33 47.12 1n5m h GLY 242 CO -0.08 0.30 -0.47 -2.09 0.00 0.00 0.00 176.54 174.20 1n5m h GLU 243 N 0.91 0.61 -0.31 4.80 4.57 -1.80 -1.66 114.58 121.70 1n5m h GLU 243 Ca 0.29 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1n5m h GLU 243 Cb 0.01 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1n5m h GLU 243 CO -0.11 0.95 0.14 0.00 -1.18 0.00 0.00 179.01 178.82 1n5m h ALA 244 N 0.99 0.40 -0.30 2.92 0.00 -0.88 -0.27 119.26 122.12 1n5m h ALA 244 Ca 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1n5m h ALA 244 Cb 1.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1n5m h ALA 244 CO 0.09 -0.03 0.15 -0.09 0.00 0.00 0.00 179.25 179.38 1n5m h ARG 245 N 0.36 0.30 -0.27 0.00 2.43 -1.07 0.15 114.38 116.29 1n5m h ARG 245 Ca 0.11 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1n5m h ARG 245 Cb 0.14 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 1n5m h ARG 245 CO -0.01 0.20 0.02 -0.09 -1.51 0.00 0.00 179.97 178.58 1n5m h ARG 246 N 0.31 0.10 -0.60 0.20 2.43 -1.10 0.06 114.38 115.78 1n5m h ARG 246 Ca 0.12 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1n5m h ARG 246 Cb 0.04 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1n5m h ARG 246 CO -0.09 0.07 0.13 0.00 -1.51 0.00 0.00 179.97 178.57 1n5m h ARG 247 N 0.10 0.97 -0.43 0.20 3.08 -0.45 -0.89 114.38 116.96 1n5m h ARG 247 Ca 0.13 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1n5m h ARG 247 Cb 0.15 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1n5m h ARG 247 CO -0.20 0.90 0.21 0.00 -1.07 0.00 0.00 179.97 179.81 1n5m h ALA 248 N 1.03 0.55 -0.16 0.04 0.00 -0.44 0.74 119.26 121.01 1n5m h ALA 248 Ca 0.19 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1n5m h ALA 248 Cb 0.38 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1n5m h ALA 248 CO 0.01 0.11 -0.55 1.79 0.00 0.00 0.00 179.25 180.61 1n5m h THR 249 N 0.55 1.33 -0.53 0.00 1.35 -0.86 -0.35 112.91 114.40 1n5m h THR 249 Ca 0.15 -1.81 -0.08 0.00 -0.55 0.00 0.00 66.41 64.12 1n5m h THR 249 Cb 0.11 1.80 -0.02 0.00 -1.73 0.00 0.00 68.15 68.31 1n5m h THR 249 CO -0.02 0.56 0.03 0.25 -0.25 0.00 0.00 175.52 176.09 1n5m h LEU 250 N 0.38 0.89 -0.51 3.87 5.85 -0.94 -1.81 115.31 123.04 1n5m h LEU 250 Ca 0.01 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1n5m h LEU 250 Cb 1.08 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 1n5m h LEU 250 CO 0.10 0.96 0.28 0.25 -0.34 0.00 0.00 178.44 179.69 1n5m h LEU 251 N 0.80 0.64 -0.52 2.25 5.85 -0.48 -1.27 115.31 122.57 1n5m h LEU 251 Ca 0.16 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.87 1n5m h LEU 251 Cb 0.48 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 1n5m h LEU 251 CO 0.02 0.55 0.12 0.00 -0.34 0.00 0.00 178.44 178.79 1n5m h ALA 252 N 1.11 0.60 -0.27 1.25 0.00 -0.82 -1.94 119.26 119.19 1n5m h ALA 252 Ca 0.18 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.21 1n5m h ALA 252 Cb 0.06 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1n5m h ALA 252 CO -0.03 -0.29 0.11 0.00 0.00 0.00 0.00 179.25 179.04 1n5m h ARG 253 N 0.26 0.23 -0.04 0.00 3.08 -0.79 0.28 114.38 117.40 1n5m h ARG 253 Ca 0.26 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.31 1n5m h ARG 253 Cb 0.34 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 1n5m h ARG 253 CO -0.32 0.15 0.12 -0.07 -1.07 0.00 0.00 179.97 178.78 1n5m h LEU 254 N 0.24 0.00 -3.13 3.04 3.38 -0.50 -0.06 115.31 118.28 1n5m h LEU 254 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1n5m h LEU 254 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1n5m h LEU 254 CO -0.10 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.76 1n5m n VAL 255 N -3.29 1.86 -1.89 1.22 0.24 -0.80 -4.99 118.33 110.68 1n5m n VAL 255 Ca -0.02 -1.61 0.00 0.00 -2.04 0.00 0.00 64.34 60.67 1n5m n VAL 255 Cb 0.20 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 1n5m n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n5m n GLY 256 N -0.23 0.72 3.18 7.63 0.00 -0.04 -5.06 105.19 111.40 1n5m n GLY 256 Ca 0.18 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 1n5m n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5m n PRO 258 N 1.75 0.00 -0.30 0.00 -0.04 -1.26 -2.59 135.00 132.55 1n5m n PRO 258 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1n5m n PRO 258 Cb 0.54 -0.21 0.00 0.00 -0.04 0.00 0.00 33.50 33.79 1n5m n PRO 258 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n5m n GLY 264 N 2.66 0.79 3.32 0.55 0.00 -1.26 -5.05 105.19 106.20 1n5m n GLY 264 Ca 0.00 -1.88 -0.17 0.00 0.00 0.00 0.00 46.02 43.97 1n5m n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n5m s ASN 265 N -2.55 2.22 0.15 1.61 4.22 -1.26 -5.08 114.94 114.24 1n5m s ASN 265 Ca 0.00 -1.08 -0.18 0.00 -2.14 0.00 0.00 52.86 49.46 1n5m s ASN 265 Cb 0.00 -0.07 0.04 0.00 1.28 0.00 0.00 41.25 42.50 1n5m s ASN 265 CO 0.00 -0.31 1.70 0.44 -2.04 0.00 0.00 177.10 176.89 1n5m h ASP 266 N 2.57 -0.18 -0.63 3.54 3.32 -2.01 -2.65 116.42 120.38 1n5m h ASP 266 Ca -0.38 0.08 0.13 0.00 0.02 0.00 0.00 57.03 56.88 1n5m h ASP 266 Cb 1.21 0.15 -0.10 0.00 0.22 0.00 0.00 39.33 40.81 1n5m h ASP 266 CO 0.64 -0.05 0.05 0.74 -1.72 0.00 0.00 179.24 178.90 1n5m h THR 267 N 0.06 0.52 -0.35 0.35 2.02 -1.99 0.34 112.91 113.86 1n5m h THR 267 Ca 0.15 -0.06 -0.08 0.00 0.77 0.00 0.00 66.41 67.19 1n5m h THR 267 Cb 0.21 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1n5m h THR 267 CO -0.27 0.03 -0.09 -0.33 0.37 0.00 0.00 175.52 175.23 1n5m h GLU 268 N 0.17 0.69 0.26 6.66 5.08 -1.94 0.01 114.58 125.50 1n5m h GLU 268 Ca 0.34 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1n5m h GLU 268 Cb 0.55 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1n5m h GLU 268 CO -0.50 0.85 -0.12 1.25 -1.00 0.00 0.00 179.01 179.48 1n5m h LEU 269 N 0.48 -0.29 -0.81 1.33 6.46 -1.05 -0.95 115.31 120.48 1n5m h LEU 269 Ca 0.09 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.82 1n5m h LEU 269 Cb 0.60 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.57 1n5m h LEU 269 CO 0.04 -0.20 0.40 0.40 -0.62 0.00 0.00 178.44 178.46 1n5m h ILE 270 N -0.36 1.25 -0.74 4.05 2.04 -0.92 -0.10 117.51 122.73 1n5m h ILE 270 Ca -0.04 -0.68 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1n5m h ILE 270 Cb 0.27 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 1n5m h ILE 270 CO 0.06 0.29 0.49 0.00 0.00 0.00 0.00 178.15 178.99 1n5m h ALA 271 N 1.21 1.47 -0.17 1.87 0.00 -0.79 -0.39 119.26 122.45 1n5m h ALA 271 Ca 0.28 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 1n5m h ALA 271 Cb 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1n5m h ALA 271 CO -0.04 0.49 -0.51 0.00 0.00 0.00 0.00 179.25 179.20 1n5m h LEU 273 N 0.33 0.86 -1.23 0.00 3.38 -0.43 -1.31 115.31 116.90 1n5m h LEU 273 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1n5m h LEU 273 Cb 1.13 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1n5m h LEU 273 CO 0.11 0.56 0.00 0.03 0.09 0.00 0.00 178.44 179.23 1n5m h ARG 274 N 0.98 0.00 0.00 1.13 3.08 -1.02 -1.39 114.38 117.16 1n5m h ARG 274 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1n5m h ARG 274 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1n5m h ARG 274 CO -0.13 0.00 -0.53 0.25 -1.07 0.00 0.00 179.97 178.49 1n5m n THR 275 N -2.37 0.02 -2.62 2.04 -2.24 -0.50 -4.91 114.28 103.70 1n5m n THR 275 Ca 0.00 -0.02 -0.40 0.00 -2.27 0.00 0.00 64.05 61.36 1n5m n THR 275 Cb 0.14 0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 1n5m n THR 275 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1n5m s ARG 276 N -3.01 4.76 0.47 -0.78 1.81 -0.53 -5.00 118.95 116.67 1n5m s ARG 276 Ca 0.11 1.63 -0.24 0.00 -1.72 0.00 0.00 55.73 55.51 1n5m s ARG 276 Cb 0.17 -3.24 -0.08 0.00 -0.45 0.00 0.00 34.95 31.35 1n5m s ARG 276 CO 0.71 0.38 1.35 -2.30 -0.68 0.00 0.00 175.30 174.75 1n5m n PRO 277 N 1.37 1.97 -0.35 3.54 -0.02 -1.26 -4.89 135.00 135.36 1n5m n PRO 277 Ca -0.02 0.71 0.06 0.00 -2.02 0.00 0.00 63.50 62.23 1n5m n PRO 277 Cb 0.46 -2.52 0.22 0.00 -0.02 0.00 0.00 33.50 31.63 1n5m n PRO 277 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n5m h ALA 278 N 1.96 1.44 -0.26 3.55 0.00 -1.96 -2.38 119.26 121.61 1n5m h ALA 278 Ca -0.50 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1n5m h ALA 278 Cb 1.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1n5m h ALA 278 CO 0.59 0.26 0.11 0.37 0.00 0.00 0.00 179.25 180.58 1n5m h GLN 279 N 1.01 0.35 -0.46 0.00 5.75 -2.00 -2.03 115.11 117.74 1n5m h GLN 279 Ca 0.47 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.89 1n5m h GLN 279 Cb 0.40 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 1n5m h GLN 279 CO -0.24 0.29 0.08 -0.44 -2.65 0.00 0.00 178.83 175.86 1n5m h ASP 280 N 0.36 0.65 -0.26 -0.69 5.19 -1.79 0.15 116.42 120.04 1n5m h ASP 280 Ca 0.09 -0.12 -0.08 0.00 -0.62 0.00 0.00 57.03 56.31 1n5m h ASP 280 Cb 0.06 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 1n5m h ASP 280 CO -0.01 0.67 -0.14 -0.07 -3.12 0.00 0.00 179.24 176.57 1n5m h LEU 281 N 0.67 0.57 -0.58 1.55 3.38 -1.41 -2.95 115.31 116.54 1n5m h LEU 281 Ca 0.15 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1n5m h LEU 281 Cb 0.31 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1n5m h LEU 281 CO 0.00 0.87 0.36 0.58 0.09 0.00 0.00 178.44 180.34 1n5m h VAL 282 N 0.28 1.16 -0.09 1.22 2.07 -1.14 -2.18 116.25 117.57 1n5m h VAL 282 Ca 0.05 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1n5m h VAL 282 Cb 0.66 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1n5m h VAL 282 CO 0.04 0.16 0.13 0.44 0.02 0.00 0.00 177.57 178.36 1n5m h ASP 283 N 0.78 0.00 -0.07 0.57 3.32 -0.56 -2.76 116.42 117.70 1n5m h ASP 283 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1n5m h ASP 283 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1n5m h ASP 283 CO -0.04 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.89 1n5m n HIS 284 N -3.63 0.09 0.11 4.55 8.25 -0.95 -4.74 115.22 118.90 1n5m n HIS 284 Ca -0.01 -0.15 0.04 0.00 -0.26 0.00 0.00 57.72 57.35 1n5m n HIS 284 Cb 0.23 -0.01 0.46 0.00 1.12 0.00 0.00 29.99 31.78 1n5m n HIS 284 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1n5m h GLU 285 N 1.42 0.30 0.00 -0.41 4.11 -1.10 -1.75 114.58 117.15 1n5m h GLU 285 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1n5m h GLU 285 Cb 0.41 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1n5m h GLU 285 CO 0.00 0.29 0.00 0.91 0.07 0.00 0.00 179.01 180.28 1n5m n TRP 286 N -4.40 0.68 1.33 2.06 7.02 -1.26 -3.58 117.44 119.29 1n5m n TRP 286 Ca 0.00 0.21 0.12 0.00 -1.02 0.00 0.00 57.50 56.81 1n5m n TRP 286 Cb 0.15 -0.84 0.67 0.00 -2.42 0.00 0.00 31.31 28.87 1n5m n TRP 286 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1n5m n HIS 287 N -2.07 0.00 1.01 -5.99 8.25 -0.66 -3.52 115.22 112.24 1n5m n HIS 287 Ca 0.05 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.62 1n5m n HIS 287 Cb 0.36 -0.16 0.03 0.00 1.12 0.00 0.00 29.99 31.35 1n5m n HIS 287 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1n5m n VAL 288 N -1.16 0.00 -1.97 1.59 0.24 -1.23 -4.96 118.33 110.84 1n5m n VAL 288 Ca 0.15 -0.32 -0.41 0.00 -2.04 0.00 0.00 64.34 61.72 1n5m n VAL 288 Cb 0.14 1.31 -0.01 0.00 -1.47 0.00 0.00 33.84 33.82 1n5m n VAL 288 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1n5m s LEU 289 N -2.35 4.34 0.50 1.34 1.43 -1.23 -4.87 118.68 117.84 1n5m s LEU 289 Ca 0.21 2.84 0.29 0.00 -1.03 0.00 0.00 54.13 56.44 1n5m s LEU 289 Cb 0.19 -3.71 1.10 0.00 0.03 0.00 0.00 46.19 43.79 1n5m s LEU 289 CO 0.50 -0.75 1.89 1.55 0.23 0.00 0.00 176.35 179.77 1n5m h PRO 290 N 3.07 0.00 -4.52 1.29 0.13 -1.95 -3.46 132.00 126.56 1n5m h PRO 290 Ca -0.50 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.42 1n5m h PRO 290 Cb 1.24 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 1n5m h PRO 290 CO 0.64 0.07 -0.64 -0.65 -0.23 0.00 0.00 178.00 177.19 1n5m s GLN 291 N -3.59 1.06 0.05 0.86 1.11 -1.26 -5.10 119.66 112.78 1n5m s GLN 291 Ca 0.02 -1.53 -0.31 0.00 0.01 0.00 0.00 55.36 53.55 1n5m s GLN 291 Cb 0.09 0.22 -0.06 0.00 -1.01 0.00 0.00 33.01 32.25 1n5m s GLN 291 CO 0.59 -0.31 1.36 -2.00 0.01 0.00 0.00 175.29 174.93 1n5m s GLU 292 N -4.09 4.33 0.33 2.91 2.12 -1.26 -4.96 118.70 118.07 1n5m s GLU 292 Ca 0.31 1.97 -0.17 0.00 0.36 0.00 0.00 54.97 57.43 1n5m s GLU 292 Cb 0.07 -3.41 0.03 0.00 0.26 0.00 0.00 34.13 31.09 1n5m s GLU 292 CO 0.06 -0.46 0.72 -1.54 -0.54 0.00 0.00 175.26 173.51 1n5m s SER 293 N 1.42 -0.09 0.12 -1.70 1.04 -1.26 -4.56 113.70 108.67 1n5m s SER 293 Ca 0.63 -0.90 0.03 0.00 0.48 0.00 0.00 55.95 56.20 1n5m s SER 293 Cb -0.33 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1n5m s SER 293 CO 0.28 -1.48 -0.09 0.27 0.98 0.00 0.00 173.24 173.20 1n5m s ILE 294 N -3.21 0.97 -1.46 -1.02 -4.36 -1.10 -4.80 121.20 106.22 1n5m s ILE 294 Ca 0.14 -1.93 -0.08 0.00 -0.26 0.00 0.00 60.65 58.52 1n5m s ILE 294 Cb -0.05 -1.69 0.04 0.00 1.25 0.00 0.00 42.46 42.01 1n5m s ILE 294 CO 0.10 -0.75 0.80 0.33 0.24 0.00 0.00 174.94 175.66 1n5m n PHE 295 N 0.02 -2.22 -4.18 1.37 -0.00 -1.26 -4.82 117.46 106.36 1n5m n PHE 295 Ca -0.12 0.71 -0.17 0.00 -0.00 0.00 0.00 57.45 57.86 1n5m n PHE 295 Cb 0.60 -4.25 -0.15 0.00 -0.00 0.00 0.00 39.48 35.68 1n5m n PHE 295 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1n5m s ARG 296 N -6.09 0.58 -0.03 -4.13 1.81 -1.26 -4.73 118.95 105.10 1n5m s ARG 296 Ca 0.46 -0.17 0.05 0.00 -1.72 0.00 0.00 55.73 54.35 1n5m s ARG 296 Cb -0.22 -0.58 -0.01 0.00 -0.45 0.00 0.00 34.95 33.69 1n5m s ARG 296 CO 0.57 0.06 -0.17 -0.06 -0.68 0.00 0.00 175.30 175.02 1n5m s PHE 297 N 0.22 1.56 0.11 -0.53 0.08 -1.26 -5.06 117.98 113.10 1n5m s PHE 297 Ca -0.02 -0.36 -0.25 0.00 0.12 0.00 0.00 56.93 56.41 1n5m s PHE 297 Cb -0.07 -1.03 -0.09 0.00 -0.57 0.00 0.00 43.02 41.27 1n5m s PHE 297 CO -0.00 -0.09 1.67 0.77 -0.10 0.00 0.00 175.22 177.48 1n5m h SER 298 N 5.97 -0.44 -3.75 1.36 0.02 -1.90 -3.40 113.55 111.41 1n5m h SER 298 Ca -0.35 0.06 -0.67 0.00 -0.84 0.00 0.00 61.79 59.99 1n5m h SER 298 Cb 1.16 0.18 -0.37 0.00 0.14 0.00 0.00 62.40 63.50 1n5m h SER 298 CO 0.48 -0.22 -0.73 -0.36 -1.14 0.00 0.00 176.83 174.86 1n5m s PHE 299 N -6.13 3.49 0.31 3.45 0.08 -1.26 -5.02 117.98 112.90 1n5m s PHE 299 Ca -0.15 -2.52 0.03 0.00 0.12 0.00 0.00 56.93 54.42 1n5m s PHE 299 Cb 0.08 -2.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.03 1n5m s PHE 299 CO 0.66 -0.90 0.17 0.14 -0.10 0.00 0.00 175.22 175.18 1n5m s VAL 300 N 1.05 0.30 0.26 -0.44 -7.23 -1.26 -4.48 120.40 108.59 1n5m s VAL 300 Ca 0.01 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.89 1n5m s VAL 300 Cb -0.20 -2.50 -0.15 0.00 0.56 0.00 0.00 36.38 34.09 1n5m s VAL 300 CO -0.05 0.00 0.87 -2.65 -0.31 0.00 0.00 175.10 172.96 1n5m n PRO 301 N -0.59 0.94 -4.86 4.82 -0.02 -1.24 -4.68 135.00 129.36 1n5m n PRO 301 Ca 0.01 0.33 -0.33 0.00 -2.02 0.00 0.00 63.50 61.50 1n5m n PRO 301 Cb 0.65 -1.60 -0.13 0.00 -0.02 0.00 0.00 33.50 32.40 1n5m n PRO 301 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1n5m s VAL 302 N -0.99 3.08 -0.96 -1.45 0.11 -1.26 -1.69 120.40 117.24 1n5m s VAL 302 Ca 0.61 -0.74 -0.24 0.00 -2.93 0.00 0.00 61.98 58.68 1n5m s VAL 302 Cb -0.78 -2.21 0.01 0.00 -1.53 0.00 0.00 36.38 31.87 1n5m s VAL 302 CO 0.58 0.57 1.63 -0.69 -3.33 0.00 0.00 175.10 173.86 1n5m s VAL 303 N -0.75 3.73 -0.93 2.04 1.01 -0.45 -4.67 120.40 120.38 1n5m s VAL 303 Ca 0.12 -0.55 0.25 0.00 0.00 0.00 0.00 61.98 61.80 1n5m s VAL 303 Cb -0.11 -4.66 0.02 0.00 0.00 0.00 0.00 36.38 31.64 1n5m s VAL 303 CO 0.01 -1.56 1.42 -0.90 0.00 0.00 0.00 175.10 174.06 1n5m n ASP 304 N 10.79 0.51 0.00 3.32 5.75 -1.25 -3.84 116.55 131.82 1n5m n ASP 304 Ca 0.34 -0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.97 1n5m n ASP 304 Cb 0.50 0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 1n5m n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n5m n GLY 305 N 1.47 0.85 0.00 6.12 0.00 0.41 -4.87 105.19 109.17 1n5m n GLY 305 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1n5m n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n5m n ASP 306 N -0.00 0.00 -0.21 1.61 2.03 -1.26 -4.52 116.55 114.19 1n5m n ASP 306 Ca 0.00 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.31 1n5m n ASP 306 Cb 0.00 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 40.51 1n5m n ASP 306 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1n5m h PHE 307 N 0.00 0.44 -3.51 -0.67 3.04 -1.92 -3.29 116.94 111.03 1n5m h PHE 307 Ca 0.00 0.03 -0.70 0.00 3.98 0.00 0.00 57.97 61.28 1n5m h PHE 307 Cb 0.00 -0.11 -0.32 0.00 2.56 0.00 0.00 35.95 38.08 1n5m h PHE 307 CO 0.00 0.14 -0.54 -0.51 -2.02 0.00 0.00 178.31 175.38 1n5m s LEU 308 N -10.37 5.02 0.42 0.59 1.43 -1.26 -4.56 118.68 109.95 1n5m s LEU 308 Ca -0.13 -1.74 0.10 0.00 -1.03 0.00 0.00 54.13 51.34 1n5m s LEU 308 Cb 0.17 -1.87 0.91 0.00 0.03 0.00 0.00 46.19 45.43 1n5m s LEU 308 CO 0.75 -0.50 2.01 0.77 0.23 0.00 0.00 176.35 179.61 1n5m h SER 309 N 8.17 0.26 -2.85 2.29 4.64 -1.79 0.12 113.55 124.39 1n5m h SER 309 Ca -0.18 -0.03 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 1n5m h SER 309 Cb 1.06 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 63.05 1n5m h SER 309 CO 0.70 0.29 -0.08 -0.67 -0.87 0.00 0.00 176.83 176.20 1n5m n ASP 310 N -4.40 -0.73 -4.77 4.97 -0.08 -1.26 -4.37 116.55 105.91 1n5m n ASP 310 Ca 0.00 -2.01 -0.36 0.00 -1.51 0.00 0.00 54.79 50.91 1n5m n ASP 310 Cb 0.16 1.36 0.01 0.00 2.34 0.00 0.00 41.12 44.99 1n5m n ASP 310 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1n5m s THR 311 N -2.63 2.92 0.46 5.18 -4.23 -1.26 -4.79 115.64 111.29 1n5m s THR 311 Ca 0.15 0.61 0.19 0.00 -1.18 0.00 0.00 61.69 61.46 1n5m s THR 311 Cb -0.01 -3.27 0.37 0.00 1.34 0.00 0.00 72.50 70.94 1n5m s THR 311 CO 0.11 -0.09 1.94 -0.65 -0.54 0.00 0.00 174.62 175.39 1n5m h PRO 312 N 1.34 0.28 0.05 3.99 0.11 -1.98 -0.28 132.00 135.51 1n5m h PRO 312 Ca -0.50 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.60 1n5m h PRO 312 Cb 1.27 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1n5m h PRO 312 CO 0.57 0.19 -0.09 0.93 -0.21 0.00 0.00 178.00 179.39 1n5m h GLU 313 N 0.29 -0.18 -0.59 1.05 4.39 -1.90 0.02 114.58 117.66 1n5m h GLU 313 Ca 0.34 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 60.02 1n5m h GLU 313 Cb 0.93 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.59 1n5m h GLU 313 CO -0.08 -0.12 0.25 0.00 -1.16 0.00 0.00 179.01 177.89 1n5m h ALA 314 N 0.74 0.77 -0.32 3.43 0.00 -1.47 -2.18 119.26 120.24 1n5m h ALA 314 Ca 0.02 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1n5m h ALA 314 Cb 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1n5m h ALA 314 CO -0.06 0.38 -0.14 -0.07 0.00 0.00 0.00 179.25 179.36 1n5m h LEU 315 N 0.82 0.55 -0.05 0.00 3.38 -0.88 -1.86 115.31 117.27 1n5m h LEU 315 Ca 0.20 -0.16 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1n5m h LEU 315 Cb 0.19 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1n5m h LEU 315 CO -0.02 0.72 -0.76 0.16 0.09 0.00 0.00 178.44 178.63 1n5m h ILE 316 N 0.51 1.32 -0.03 1.22 3.07 -0.89 -1.15 117.51 121.56 1n5m h ILE 316 Ca 0.09 -2.82 -0.17 0.00 1.55 0.00 0.00 64.86 63.51 1n5m h ILE 316 Cb 0.55 2.62 -0.01 0.00 -0.27 0.00 0.00 36.82 39.71 1n5m h ILE 316 CO 0.03 0.74 -0.72 0.78 -1.05 0.00 0.00 178.15 177.93 1n5m h ASN 317 N 0.00 0.23 -0.16 2.16 2.35 -1.16 -3.33 115.58 115.67 1n5m h ASN 317 Ca -0.01 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1n5m h ASN 317 Cb 1.56 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.86 1n5m h ASN 317 CO 0.10 0.87 0.00 0.35 -1.65 0.00 0.00 177.43 177.10 1n5m n THR 318 N -3.77 1.09 -2.44 2.81 -2.24 -0.72 -5.04 114.28 103.97 1n5m n THR 318 Ca -0.03 -1.09 -0.28 0.00 -2.27 0.00 0.00 64.05 60.39 1n5m n THR 318 Cb 0.70 0.44 0.01 0.00 -2.10 0.00 0.00 70.33 69.38 1n5m n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1n5m s GLY 319 N -1.11 1.54 -0.28 3.38 0.00 -0.44 -5.03 107.32 105.39 1n5m s GLY 319 Ca 0.13 -0.44 -0.05 0.00 0.00 0.00 0.00 44.72 44.36 1n5m s GLY 319 CO 0.07 -0.24 0.04 -0.35 0.00 0.00 0.00 173.10 172.62 1n5m s ASP 320 N -4.15 4.88 -0.31 1.64 2.15 -1.26 -4.84 116.67 114.78 1n5m s ASP 320 Ca 0.50 -0.74 0.08 0.00 0.43 0.00 0.00 52.55 52.81 1n5m s ASP 320 Cb -0.10 -1.81 0.48 0.00 -0.30 0.00 0.00 42.92 41.18 1n5m s ASP 320 CO 0.47 -0.17 1.41 0.49 -0.17 0.00 0.00 175.17 177.20 1n5m n PHE 321 N 4.81 1.37 -2.19 -5.34 3.72 -0.52 -5.02 117.46 114.28 1n5m n PHE 321 Ca -0.15 -1.82 -0.35 0.00 -0.05 0.00 0.00 57.45 55.09 1n5m n PHE 321 Cb 0.48 -0.49 0.01 0.00 -0.94 0.00 0.00 39.48 38.53 1n5m n PHE 321 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1n5m s GLN 322 N -3.36 3.30 -0.85 -1.08 -0.21 -1.23 -2.51 119.66 113.70 1n5m s GLN 322 Ca 0.46 1.55 0.00 0.00 0.02 0.00 0.00 55.36 57.39 1n5m s GLN 322 Cb 0.41 -2.00 0.00 0.00 1.00 0.00 0.00 33.01 32.42 1n5m s GLN 322 CO -0.01 -0.88 0.00 -0.25 -2.12 0.00 0.00 175.29 172.03 1n5m n ASP 323 N -1.48 -4.48 -4.29 5.90 8.00 -1.26 -4.95 116.55 113.99 1n5m n ASP 323 Ca 0.11 0.20 -0.32 0.00 0.71 0.00 0.00 54.79 55.49 1n5m n ASP 323 Cb 0.51 -2.69 -0.16 0.00 -0.02 0.00 0.00 41.12 38.76 1n5m n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1n5m s LEU 324 N -1.83 2.35 -0.10 0.64 2.96 -1.14 -5.01 118.68 116.54 1n5m s LEU 324 Ca 0.00 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.48 1n5m s LEU 324 Cb 0.00 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 1n5m s LEU 324 CO 0.00 0.18 -0.17 -1.10 -1.32 0.00 0.00 176.35 173.94 1n5m s GLN 325 N 0.23 3.11 -0.01 1.98 1.11 -1.26 -1.02 119.66 123.80 1n5m s GLN 325 Ca -0.13 -0.75 0.02 0.00 0.01 0.00 0.00 55.36 54.51 1n5m s GLN 325 Cb -0.16 -2.48 -0.00 0.00 -1.01 0.00 0.00 33.01 29.35 1n5m s GLN 325 CO 0.07 0.28 -0.07 0.08 0.01 0.00 0.00 175.29 175.66 1n5m s VAL 326 N 0.15 0.53 -0.14 1.09 1.01 0.19 -2.32 120.40 120.91 1n5m s VAL 326 Ca -0.09 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.60 1n5m s VAL 326 Cb -0.15 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 1n5m s VAL 326 CO 0.06 0.15 -0.13 -0.22 0.00 0.00 0.00 175.10 174.96 1n5m s LEU 327 N -0.14 2.67 0.03 3.92 0.20 -0.37 -1.12 118.68 123.87 1n5m s LEU 327 Ca 0.02 -0.36 0.01 0.00 0.69 0.00 0.00 54.13 54.49 1n5m s LEU 327 Cb -0.03 -1.61 -0.02 0.00 -0.43 0.00 0.00 46.19 44.10 1n5m s LEU 327 CO -0.00 0.14 -0.04 0.68 -0.29 0.00 0.00 176.35 176.83 1n5m s VAL 328 N 0.52 0.24 0.12 1.68 -7.23 0.46 -0.49 120.40 115.70 1n5m s VAL 328 Ca -0.09 -0.93 -0.25 0.00 -1.81 0.00 0.00 61.98 58.91 1n5m s VAL 328 Cb -0.16 -0.36 0.08 0.00 0.56 0.00 0.00 36.38 36.51 1n5m s VAL 328 CO 0.04 -0.44 1.10 -0.83 -0.31 0.00 0.00 175.10 174.66 1n5m s GLY 329 N -1.44 -0.05 0.12 2.32 0.00 -1.00 -1.53 107.32 105.73 1n5m s GLY 329 Ca -0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 44.72 44.51 1n5m s GLY 329 CO -0.01 2.31 0.01 -1.34 0.00 0.00 0.00 173.10 174.07 1n5m s VAL 330 N -2.35 0.33 0.51 1.40 -7.23 -0.89 -0.62 120.40 111.54 1n5m s VAL 330 Ca 0.21 -1.90 0.04 0.00 -1.81 0.00 0.00 61.98 58.51 1n5m s VAL 330 Cb -0.01 -1.89 0.03 0.00 0.56 0.00 0.00 36.38 35.07 1n5m s VAL 330 CO 0.03 -0.65 0.71 0.68 -0.31 0.00 0.00 175.10 175.56 1n5m s VAL 331 N -3.88 2.75 0.28 1.32 -7.23 -1.26 -0.38 120.40 112.00 1n5m s VAL 331 Ca 0.18 -0.79 -0.01 0.00 -1.81 0.00 0.00 61.98 59.56 1n5m s VAL 331 Cb 0.07 -2.96 0.13 0.00 0.56 0.00 0.00 36.38 34.19 1n5m s VAL 331 CO -0.01 0.00 1.80 0.50 -0.31 0.00 0.00 175.10 177.08 1n5m h LYS 332 N 0.25 0.75 -2.14 4.82 3.64 -1.09 -3.34 116.57 119.46 1n5m h LYS 332 Ca -0.41 -0.18 -0.59 0.00 -1.27 0.00 0.00 60.65 58.21 1n5m h LYS 332 Cb 1.29 -0.10 -0.41 0.00 -0.41 0.00 0.00 32.23 32.60 1n5m h LYS 332 CO 0.49 0.74 -0.74 -0.25 -2.27 0.00 0.00 179.45 177.42 1n5m n ASP 333 N -4.24 2.82 -0.26 4.20 9.92 -0.02 -4.91 116.55 124.05 1n5m n ASP 333 Ca 0.03 -3.25 0.09 0.00 -0.53 0.00 0.00 54.79 51.13 1n5m n ASP 333 Cb 0.27 -0.66 0.34 0.00 -0.64 0.00 0.00 41.12 40.43 1n5m n ASP 333 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1n5m h GLU 334 N 4.06 0.75 0.00 -1.24 4.39 -1.75 -3.17 114.58 117.62 1n5m h GLU 334 Ca 0.16 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.73 1n5m h GLU 334 Cb 0.72 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1n5m h GLU 334 CO 0.73 0.50 -0.76 0.78 -1.16 0.00 0.00 179.01 179.10 1n5m h GLY 335 N 0.77 0.00 0.11 -3.84 0.00 -1.86 -3.39 103.07 94.87 1n5m h GLY 335 Ca 0.41 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.89 1n5m h GLY 335 CO -0.18 0.00 0.26 1.48 0.00 0.00 0.00 176.54 178.10 1n5m h SER 336 N 0.00 0.21 -0.98 0.19 4.64 -1.76 -1.55 113.55 114.30 1n5m h SER 336 Ca -0.05 0.12 0.15 0.00 -0.47 0.00 0.00 61.79 61.54 1n5m h SER 336 Cb 1.32 0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 63.43 1n5m h SER 336 CO 0.04 0.07 0.61 0.22 -0.87 0.00 0.00 176.83 176.90 1n5m h TYR 337 N 0.39 1.03 0.00 4.77 3.20 -1.80 -1.76 116.97 122.81 1n5m h TYR 337 Ca 0.41 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.31 1n5m h TYR 337 Cb 0.63 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.58 1n5m h TYR 337 CO -0.19 0.35 0.00 0.74 -1.64 0.00 0.00 178.16 177.42 1n5m h PHE 338 N 0.85 0.00 -0.10 -3.82 -1.00 -1.55 -3.33 116.94 107.99 1n5m h PHE 338 Ca 0.51 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 61.09 1n5m h PHE 338 Cb 0.68 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.24 1n5m h PHE 338 CO -0.00 0.00 -0.76 -0.07 -1.61 0.00 0.00 178.31 175.86 1n5m h LEU 339 N 0.00 0.64 -0.54 1.54 3.38 -1.27 -3.08 115.31 115.97 1n5m h LEU 339 Ca 0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1n5m h LEU 339 Cb 0.66 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1n5m h LEU 339 CO 0.00 1.19 0.00 0.52 0.09 0.00 0.00 178.44 180.24 1n5m n VAL 340 N -3.86 0.78 -0.20 1.22 0.31 -1.25 -1.49 118.33 113.83 1n5m n VAL 340 Ca -0.06 0.13 -0.01 0.00 -0.01 0.00 0.00 64.34 64.40 1n5m n VAL 340 Cb 0.73 -1.04 0.21 0.00 -0.91 0.00 0.00 33.84 32.83 1n5m n VAL 340 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1n5m n TYR 341 N -2.22 1.43 0.00 3.52 4.02 -1.16 -4.68 117.16 118.07 1n5m n TYR 341 Ca 0.03 -0.68 0.00 0.00 -0.01 0.00 0.00 57.90 57.24 1n5m n TYR 341 Cb 0.27 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 39.15 1n5m n TYR 341 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n5m n GLY 342 N 0.14 0.00 3.36 2.72 0.00 -1.13 -4.95 105.19 105.33 1n5m n GLY 342 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1n5m n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n5m s VAL 343 N 0.00 3.78 0.30 1.61 1.01 -0.56 -4.96 120.40 121.58 1n5m s VAL 343 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1n5m s VAL 343 Cb 0.00 -2.77 -0.12 0.00 0.00 0.00 0.00 36.38 33.49 1n5m s VAL 343 CO 0.00 0.35 1.52 -2.65 0.00 0.00 0.00 175.10 174.32 1n5m n PRO 344 N 4.85 2.53 0.00 2.72 -0.02 -1.26 -2.17 135.00 141.64 1n5m n PRO 344 Ca -0.17 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1n5m n PRO 344 Cb 0.51 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1n5m n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n5m n GLY 345 N 1.86 2.25 3.87 -1.23 0.00 -1.26 -4.93 105.19 105.75 1n5m n GLY 345 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1n5m n GLY 345 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n5m s PHE 346 N -2.19 3.60 0.01 1.61 0.40 -0.92 -4.62 117.98 115.88 1n5m s PHE 346 Ca 0.00 0.66 -0.27 0.00 -0.60 0.00 0.00 56.93 56.72 1n5m s PHE 346 Cb 0.00 -2.05 0.07 0.00 0.51 0.00 0.00 43.02 41.54 1n5m s PHE 346 CO 0.00 0.61 0.62 0.45 0.70 0.00 0.00 175.22 177.61 1n5m s SER 347 N -1.55 -0.59 0.02 1.36 0.15 -1.26 -4.74 113.70 107.09 1n5m s SER 347 Ca 0.27 0.45 0.28 0.00 0.70 0.00 0.00 55.95 57.64 1n5m s SER 347 Cb -0.14 0.54 1.02 0.00 -1.71 0.00 0.00 66.02 65.73 1n5m s SER 347 CO 0.15 -0.70 1.79 2.29 1.20 0.00 0.00 173.24 177.96 1n5m n LYS 348 N 0.55 0.02 0.00 5.44 2.85 -1.26 -3.77 118.16 122.00 1n5m n LYS 348 Ca -0.19 0.02 0.11 0.00 -1.05 0.00 0.00 58.31 57.20 1n5m n LYS 348 Cb 0.59 -1.52 0.09 0.00 -0.65 0.00 0.00 35.03 33.53 1n5m n LYS 348 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1n5m n ASP 349 N -1.56 0.74 -3.71 -5.58 8.00 -1.26 -4.36 116.55 108.83 1n5m n ASP 349 Ca 0.06 -0.60 -0.21 0.00 0.71 0.00 0.00 54.79 54.75 1n5m n ASP 349 Cb 0.35 0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 41.95 1n5m n ASP 349 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1n5m s ASN 350 N -2.99 1.98 0.00 -2.24 2.20 -1.25 -5.03 114.94 107.61 1n5m s ASN 350 Ca 0.10 -1.70 0.22 0.00 -0.94 0.00 0.00 52.86 50.53 1n5m s ASN 350 Cb 0.17 0.53 1.25 0.00 -2.00 0.00 0.00 41.25 41.20 1n5m s ASN 350 CO 0.77 -1.00 1.67 -0.62 -2.94 0.00 0.00 177.10 174.98 1n5m n GLU 351 N -0.70 0.62 -3.99 3.55 -0.58 -1.26 -4.72 120.64 113.56 1n5m n GLU 351 Ca 0.02 0.01 -0.32 0.00 -0.42 0.00 0.00 57.16 56.46 1n5m n GLU 351 Cb 0.64 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 30.02 1n5m n GLU 351 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1n5m n SER 352 N -1.05 -4.35 -4.62 1.62 7.64 -1.26 -4.90 113.62 106.70 1n5m n SER 352 Ca 0.15 -0.84 -0.43 0.00 1.01 0.00 0.00 58.87 58.77 1n5m n SER 352 Cb 0.09 -3.61 -0.02 0.00 -1.01 0.00 0.00 64.21 59.65 1n5m n SER 352 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1n5m s LEU 353 N -7.27 3.79 0.34 -3.43 1.43 -1.26 -4.71 118.68 107.57 1n5m s LEU 353 Ca 0.66 1.29 0.08 0.00 -1.03 0.00 0.00 54.13 55.13 1n5m s LEU 353 Cb -0.34 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.31 1n5m s LEU 353 CO 0.85 -1.27 0.25 0.27 0.23 0.00 0.00 176.35 176.68 1n5m s ILE 354 N 5.10 3.40 0.58 -0.59 -4.36 -1.24 -5.02 121.20 119.06 1n5m s ILE 354 Ca 0.65 -1.47 -0.04 0.00 -0.26 0.00 0.00 60.65 59.53 1n5m s ILE 354 Cb -0.20 -3.13 0.02 0.00 1.25 0.00 0.00 42.46 40.41 1n5m s ILE 354 CO 0.28 -0.18 0.86 -0.94 0.24 0.00 0.00 174.94 175.20 1n5m s SER 355 N -3.95 5.47 0.31 4.36 1.04 -1.26 -4.18 113.70 115.49 1n5m s SER 355 Ca 0.40 0.49 0.01 0.00 0.48 0.00 0.00 55.95 57.32 1n5m s SER 355 Cb -0.05 -1.46 0.49 0.00 0.10 0.00 0.00 66.02 65.11 1n5m s SER 355 CO 0.25 -1.09 1.86 -0.09 0.98 0.00 0.00 173.24 175.16 1n5m h ARG 356 N -0.10 0.73 -0.38 4.02 2.43 -1.89 -1.08 114.38 118.12 1n5m h ARG 356 Ca -0.45 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 58.60 1n5m h ARG 356 Cb 1.27 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1n5m h ARG 356 CO 0.59 0.66 0.23 0.00 -1.51 0.00 0.00 179.97 179.94 1n5m h ALA 357 N 1.43 0.48 -0.23 2.80 0.00 -1.98 -0.63 119.26 121.12 1n5m h ALA 357 Ca 0.16 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1n5m h ALA 357 Cb 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1n5m h ALA 357 CO -0.00 -0.11 -0.14 1.96 0.00 0.00 0.00 179.25 180.96 1n5m h GLN 358 N 0.46 0.39 -0.19 0.00 4.20 -1.80 -1.77 115.11 116.41 1n5m h GLN 358 Ca 0.15 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1n5m h GLN 358 Cb -0.01 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1n5m h GLN 358 CO -0.06 0.53 0.04 0.35 -0.67 0.00 0.00 178.83 179.02 1n5m h PHE 359 N 0.36 0.33 -0.81 2.96 3.04 -0.52 0.13 116.94 122.42 1n5m h PHE 359 Ca 0.07 -0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 1n5m h PHE 359 Cb 0.47 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 38.85 1n5m h PHE 359 CO 0.01 0.44 0.48 -0.07 -2.02 0.00 0.00 178.31 177.15 1n5m h LEU 360 N 0.12 0.98 -0.59 0.59 3.38 -0.80 -1.11 115.31 117.89 1n5m h LEU 360 Ca 0.06 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1n5m h LEU 360 Cb 0.28 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1n5m h LEU 360 CO 0.00 0.77 0.06 0.00 0.09 0.00 0.00 178.44 179.36 1n5m h ALA 361 N 1.26 0.78 -0.95 1.53 0.00 -1.20 -2.94 119.26 117.74 1n5m h ALA 361 Ca 0.29 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1n5m h ALA 361 Cb -0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 1n5m h ALA 361 CO -0.05 0.56 0.62 0.78 0.00 0.00 0.00 179.25 181.16 1n5m h GLY 362 N 0.89 1.36 1.01 0.00 0.00 -0.03 -2.34 103.07 103.95 1n5m h GLY 362 Ca 0.17 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1n5m h GLY 362 CO 0.02 0.43 0.49 -2.08 0.00 0.00 0.00 176.54 175.40 1n5m h VAL 363 N 1.22 1.24 -0.41 4.60 2.07 -1.05 0.20 116.25 124.12 1n5m h VAL 363 Ca 0.37 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1n5m h VAL 363 Cb -0.05 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.78 1n5m h VAL 363 CO -0.10 0.25 0.08 0.03 0.02 0.00 0.00 177.57 177.85 1n5m h ARG 364 N 1.15 0.62 0.05 1.57 2.47 -1.34 0.13 114.38 119.03 1n5m h ARG 364 Ca 0.30 -0.11 -0.26 0.00 -1.26 0.00 0.00 59.98 58.64 1n5m h ARG 364 Cb -0.03 -0.10 0.01 0.00 -1.65 0.00 0.00 29.97 28.21 1n5m h ARG 364 CO -0.05 0.58 -1.09 0.82 0.56 0.00 0.00 179.97 180.79 1n5m h ILE 365 N 0.60 1.37 0.00 2.04 2.04 -1.10 -2.97 117.51 119.49 1n5m h ILE 365 Ca 0.14 -2.52 -0.01 0.00 1.00 0.00 0.00 64.86 63.47 1n5m h ILE 365 Cb 0.26 2.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1n5m h ILE 365 CO -0.00 0.76 -0.05 1.23 0.00 0.00 0.00 178.15 180.09 1n5m h GLY 366 N 0.93 0.00 -5.88 5.37 0.00 -0.37 -2.91 103.07 100.21 1n5m h GLY 366 Ca -0.12 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.65 1n5m h GLY 366 CO 0.20 0.00 -0.91 -0.62 0.00 0.00 0.00 176.54 175.21 1n5m n VAL 367 N -3.10 1.02 0.19 4.60 0.31 0.42 -4.87 118.33 116.90 1n5m n VAL 367 Ca 0.04 -4.81 0.18 0.00 -0.01 0.00 0.00 64.34 59.73 1n5m n VAL 367 Cb 0.54 -1.41 0.82 0.00 -0.91 0.00 0.00 33.84 32.89 1n5m n VAL 367 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1n5m h PRO 368 N 3.54 0.00 -0.05 5.55 0.13 -1.62 -1.41 132.00 138.14 1n5m h PRO 368 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1n5m h PRO 368 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1n5m h PRO 368 CO 0.64 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.45 1n5m n GLN 369 N -3.78 1.65 -2.56 0.86 3.00 -1.26 -4.93 117.38 110.36 1n5m n GLN 369 Ca 0.02 -0.95 -0.41 0.00 -0.01 0.00 0.00 57.00 55.66 1n5m n GLN 369 Cb 0.37 -1.46 -0.04 0.00 0.00 0.00 0.00 30.24 29.10 1n5m n GLN 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1n5m s ALA 370 N -1.96 3.36 0.98 -1.58 0.00 -0.53 -5.05 121.76 116.99 1n5m s ALA 370 Ca 0.37 0.79 -0.15 0.00 0.00 0.00 0.00 51.96 52.97 1n5m s ALA 370 Cb 0.20 -3.32 0.19 0.00 0.00 0.00 0.00 23.12 20.19 1n5m s ALA 370 CO 0.32 -0.12 1.20 -1.54 0.00 0.00 0.00 175.76 175.63 1n5m s SER 371 N -0.46 2.92 0.19 0.00 1.04 -1.26 -4.77 113.70 111.35 1n5m s SER 371 Ca 0.47 0.63 -0.12 0.00 0.48 0.00 0.00 55.95 57.40 1n5m s SER 371 Cb -0.29 -0.93 0.11 0.00 0.10 0.00 0.00 66.02 65.01 1n5m s SER 371 CO 0.36 -2.89 1.84 0.44 0.98 0.00 0.00 173.24 173.97 1n5m h ASP 372 N -1.74 0.74 -0.35 7.02 3.32 -1.99 -0.87 116.42 122.56 1n5m h ASP 372 Ca -0.47 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.53 1n5m h ASP 372 Cb 1.29 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 1n5m h ASP 372 CO 0.48 0.56 0.17 0.25 -1.72 0.00 0.00 179.24 178.98 1n5m h LEU 373 N 0.86 0.46 -1.02 1.55 5.85 -1.99 -1.59 115.31 119.43 1n5m h LEU 373 Ca 0.23 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 1n5m h LEU 373 Cb -0.07 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1n5m h LEU 373 CO -0.05 0.45 -0.07 0.00 -0.34 0.00 0.00 178.44 178.43 1n5m h ALA 374 N 1.02 1.18 -0.62 1.25 0.00 -1.88 -0.45 119.26 119.78 1n5m h ALA 374 Ca 0.12 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1n5m h ALA 374 Cb 0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1n5m h ALA 374 CO -0.02 0.53 0.06 0.00 0.00 0.00 0.00 179.25 179.82 1n5m h ALA 375 N 1.35 0.94 -0.28 0.00 0.00 -0.85 -0.77 119.26 119.65 1n5m h ALA 375 Ca 0.11 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1n5m h ALA 375 Cb 0.48 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1n5m h ALA 375 CO 0.03 0.65 -0.42 1.49 0.00 0.00 0.00 179.25 181.00 1n5m h GLU 376 N 0.96 0.68 -0.88 0.00 4.57 -0.87 -0.85 114.58 118.19 1n5m h GLU 376 Ca 0.19 -0.36 0.03 0.00 -1.18 0.00 0.00 59.36 58.04 1n5m h GLU 376 Cb 0.47 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.02 1n5m h GLU 376 CO 0.02 0.97 0.57 0.00 -1.18 0.00 0.00 179.01 179.39 1n5m h ALA 377 N 0.98 1.16 -0.06 2.92 0.00 -0.50 0.62 119.26 124.38 1n5m h ALA 377 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n5m h ALA 377 Cb 0.95 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1n5m h ALA 377 CO 0.09 0.44 0.02 0.28 0.00 0.00 0.00 179.25 180.08 1n5m h VAL 378 N 1.12 1.16 -0.76 0.00 2.07 -0.57 -1.18 116.25 118.09 1n5m h VAL 378 Ca 0.35 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.43 1n5m h VAL 378 Cb -0.02 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 1n5m h VAL 378 CO -0.11 0.13 0.48 0.58 0.02 0.00 0.00 177.57 178.68 1n5m h VAL 379 N -0.09 1.11 -0.31 2.57 2.07 -0.69 -0.65 116.25 120.26 1n5m h VAL 379 Ca 0.02 -0.32 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 1n5m h VAL 379 Cb 0.19 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1n5m h VAL 379 CO -0.00 0.17 -0.23 -0.07 0.02 0.00 0.00 177.57 177.46 1n5m h LEU 380 N 0.94 0.60 -0.39 2.57 3.38 -0.75 -0.41 115.31 121.26 1n5m h LEU 380 Ca 0.31 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1n5m h LEU 380 Cb 0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1n5m h LEU 380 CO -0.11 0.82 -0.64 -0.74 0.09 0.00 0.00 178.44 177.86 1n5m h HIS 381 N 0.53 0.79 0.00 1.13 2.76 -0.78 -3.29 115.15 116.29 1n5m h HIS 381 Ca 0.08 -0.31 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 1n5m h HIS 381 Cb 0.68 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.50 1n5m h HIS 381 CO 0.03 1.08 -0.81 0.66 -1.30 0.00 0.00 177.93 177.59 1n5m n TYR 382 N -3.93 0.34 -2.19 5.26 4.02 -0.29 -4.89 117.16 115.48 1n5m n TYR 382 Ca -0.04 0.10 -0.41 0.00 -0.01 0.00 0.00 57.90 57.53 1n5m n TYR 382 Cb 0.66 -0.49 -0.03 0.00 -0.02 0.00 0.00 39.34 39.46 1n5m n TYR 382 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1n5m s THR 383 N -3.16 3.04 -0.58 -0.72 2.01 -0.17 -4.90 115.64 111.16 1n5m s THR 383 Ca 0.06 0.92 -0.22 0.00 0.31 0.00 0.00 61.69 62.76 1n5m s THR 383 Cb 0.14 -3.59 0.06 0.00 0.01 0.00 0.00 72.50 69.13 1n5m s THR 383 CO 0.76 0.17 0.85 -0.62 -0.69 0.00 0.00 174.62 175.09 1n5m s ASP 384 N -0.01 6.25 0.00 3.53 -1.08 -1.26 -4.92 116.67 119.17 1n5m s ASP 384 Ca 0.54 -0.78 0.10 0.00 -0.52 0.00 0.00 52.55 51.89 1n5m s ASP 384 Cb -0.38 -2.38 0.50 0.00 -1.46 0.00 0.00 42.92 39.20 1n5m s ASP 384 CO 0.43 -1.21 1.20 0.79 0.52 0.00 0.00 175.17 176.91 1n5m n TRP 385 N 7.14 0.00 0.08 -5.34 7.02 -1.26 -1.13 117.44 123.95 1n5m n TRP 385 Ca -0.03 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.27 1n5m n TRP 385 Cb 0.46 -0.29 -0.14 0.00 -2.42 0.00 0.00 31.31 28.92 1n5m n TRP 385 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1n5m h LEU 386 N 0.00 0.46 -5.96 -0.99 3.38 -2.04 -3.39 115.31 106.77 1n5m h LEU 386 Ca 0.00 -0.58 -0.55 0.00 0.09 0.00 0.00 57.88 56.84 1n5m h LEU 386 Cb 0.09 -0.15 -0.40 0.00 0.09 0.00 0.00 40.66 40.29 1n5m h LEU 386 CO 0.00 1.47 -1.00 1.41 0.09 0.00 0.00 178.44 180.41 1n5m n HIS 387 N -3.51 0.92 0.25 1.13 8.25 -0.48 -4.96 115.22 116.81 1n5m n HIS 387 Ca -0.15 -3.78 0.16 0.00 -0.26 0.00 0.00 57.72 53.70 1n5m n HIS 387 Cb 1.05 -0.42 0.87 0.00 1.12 0.00 0.00 29.99 32.61 1n5m n HIS 387 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1n5m h PRO 388 N 3.65 0.00 -0.05 -0.41 0.13 -1.34 -2.57 132.00 131.41 1n5m h PRO 388 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1n5m h PRO 388 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1n5m h PRO 388 CO 0.57 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.73 1n5m n GLU 389 N -2.63 0.55 -1.86 0.86 -0.58 -1.26 -4.86 120.64 110.85 1n5m n GLU 389 Ca -0.02 -1.13 -0.42 0.00 -0.42 0.00 0.00 57.16 55.17 1n5m n GLU 389 Cb 0.07 -1.17 -0.03 0.00 -0.57 0.00 0.00 31.44 29.75 1n5m n GLU 389 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1n5m s ASP 390 N -0.74 6.43 0.38 1.62 2.15 -0.97 -4.78 116.67 120.77 1n5m s ASP 390 Ca 0.11 2.28 0.07 0.00 0.43 0.00 0.00 52.55 55.43 1n5m s ASP 390 Cb 0.07 -2.53 0.77 0.00 -0.30 0.00 0.00 42.92 40.93 1n5m s ASP 390 CO 0.11 -1.12 1.98 1.55 -0.17 0.00 0.00 175.17 177.52 1n5m h PRO 391 N 10.61 0.49 -0.44 4.34 0.13 -1.92 -1.64 132.00 143.57 1n5m h PRO 391 Ca -0.42 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 1n5m h PRO 391 Cb 1.20 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1n5m h PRO 391 CO 0.96 0.42 -0.05 1.15 -0.23 0.00 0.00 178.00 180.25 1n5m h THR 392 N 0.49 1.27 -0.59 1.56 2.02 -1.90 -0.82 112.91 114.93 1n5m h THR 392 Ca 0.12 -1.12 -0.10 0.00 0.77 0.00 0.00 66.41 66.08 1n5m h THR 392 Cb 0.13 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1n5m h THR 392 CO -0.01 0.38 -0.04 -0.74 0.37 0.00 0.00 175.52 175.48 1n5m h HIS 393 N 0.64 1.17 -0.64 3.16 -0.00 -1.84 -2.11 115.15 115.51 1n5m h HIS 393 Ca 0.12 -0.22 -0.04 0.00 -0.00 0.00 0.00 60.37 60.23 1n5m h HIS 393 Cb 0.56 -0.30 -0.03 0.00 -0.00 0.00 0.00 27.41 27.64 1n5m h HIS 393 CO 0.04 1.04 0.25 -0.07 -0.00 0.00 0.00 177.93 179.20 1n5m h LEU 394 N 0.96 0.90 0.23 0.26 3.38 -1.13 0.24 115.31 120.15 1n5m h LEU 394 Ca 0.16 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1n5m h LEU 394 Cb 0.60 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1n5m h LEU 394 CO 0.04 0.83 -0.11 -0.09 0.09 0.00 0.00 178.44 179.19 1n5m h ARG 395 N 0.91 -0.30 -0.63 1.13 1.12 -1.06 -0.87 114.38 114.68 1n5m h ARG 395 Ca 0.21 0.02 -0.03 0.00 -1.11 0.00 0.00 59.98 59.08 1n5m h ARG 395 Cb 0.22 0.07 -0.03 0.00 -0.01 0.00 0.00 29.97 30.22 1n5m h ARG 395 CO -0.02 -0.11 0.28 -0.44 -3.11 0.00 0.00 179.97 176.58 1n5m h ASP 396 N -0.43 0.83 0.29 -3.80 3.32 -1.25 -1.94 116.42 113.44 1n5m h ASP 396 Ca -0.03 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.81 1n5m h ASP 396 Cb 0.33 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1n5m h ASP 396 CO 0.05 0.72 -0.45 0.00 -1.72 0.00 0.00 179.24 177.84 1n5m h ALA 397 N 1.40 1.09 -0.37 3.45 0.00 -0.39 -1.23 119.26 123.20 1n5m h ALA 397 Ca 0.22 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1n5m h ALA 397 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1n5m h ALA 397 CO -0.02 0.61 0.05 1.98 0.00 0.00 0.00 179.25 181.87 1n5m h MET 398 N 0.16 0.62 -0.16 0.00 1.85 -0.56 -0.11 114.93 116.73 1n5m h MET 398 Ca 0.01 -0.17 0.01 0.00 -0.61 0.00 0.00 59.70 58.94 1n5m h MET 398 Cb 0.86 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.81 1n5m h MET 398 CO 0.07 0.70 0.09 1.03 -0.40 0.00 0.00 176.91 178.39 1n5m h SER 399 N 0.46 0.14 -0.78 1.39 0.87 -1.15 -2.48 113.55 112.00 1n5m h SER 399 Ca 0.11 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 1n5m h SER 399 Cb 0.38 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 1n5m h SER 399 CO 0.01 0.10 0.39 0.00 -0.53 0.00 0.00 176.83 176.80 1n5m h ALA 400 N 1.08 1.19 -0.07 6.23 0.00 -0.99 -0.38 119.26 126.32 1n5m h ALA 400 Ca 0.06 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1n5m h ALA 400 Cb 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1n5m h ALA 400 CO -0.04 0.62 -0.07 0.28 0.00 0.00 0.00 179.25 180.04 1n5m h VAL 401 N 1.12 0.79 -0.37 0.00 2.07 -0.78 0.19 116.25 119.28 1n5m h VAL 401 Ca 0.27 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.76 1n5m h VAL 401 Cb 0.10 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1n5m h VAL 401 CO -0.04 0.00 0.08 0.58 0.02 0.00 0.00 177.57 178.21 1n5m h VAL 402 N -0.10 1.23 -0.57 2.57 2.07 -0.99 -1.84 116.25 118.62 1n5m h VAL 402 Ca 0.06 -0.79 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 1n5m h VAL 402 Cb 0.17 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1n5m h VAL 402 CO -0.13 0.27 0.01 1.23 0.02 0.00 0.00 177.57 178.97 1n5m h GLY 403 N 0.45 1.09 0.64 2.17 0.00 -0.92 -2.37 103.07 104.13 1n5m h GLY 403 Ca 0.12 -0.79 -0.02 0.00 0.00 0.00 0.00 47.33 46.63 1n5m h GLY 403 CO 0.00 0.73 -0.05 -0.55 0.00 0.00 0.00 176.54 176.68 1n5m h ASP 404 N 0.90 0.16 -0.44 0.19 3.32 -0.56 0.07 116.42 120.06 1n5m h ASP 404 Ca 0.16 -0.44 -0.00 0.00 0.02 0.00 0.00 57.03 56.77 1n5m h ASP 404 Cb 0.54 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1n5m h ASP 404 CO 0.03 0.57 0.26 -0.74 -1.72 0.00 0.00 179.24 177.64 1n5m h HIS 405 N -0.24 0.58 0.00 4.55 -0.00 -1.38 -0.03 115.15 118.63 1n5m h HIS 405 Ca 0.01 -0.00 -0.29 0.00 -0.00 0.00 0.00 60.37 60.10 1n5m h HIS 405 Cb 0.52 -0.19 -0.05 0.00 -0.00 0.00 0.00 27.41 27.69 1n5m h HIS 405 CO 0.08 0.41 -1.65 -0.91 -0.00 0.00 0.00 177.93 175.86 1n5m h ASN 406 N 0.58 0.01 0.00 3.26 2.35 -1.48 -3.42 115.58 116.88 1n5m h ASN 406 Ca 0.16 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1n5m h ASN 406 Cb 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1n5m h ASN 406 CO -0.03 1.03 0.00 0.52 -1.65 0.00 0.00 177.43 177.30 1n5m n VAL 407 N -3.09 0.82 0.03 2.81 0.31 -0.14 -4.73 118.33 114.34 1n5m n VAL 407 Ca -0.16 0.27 -0.11 0.00 -0.01 0.00 0.00 64.34 64.34 1n5m n VAL 407 Cb 1.04 -1.24 -0.05 0.00 -0.91 0.00 0.00 33.84 32.67 1n5m n VAL 407 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1n5m h VAL 408 N 0.00 0.83 -0.09 2.52 2.07 -1.20 -0.25 116.25 120.13 1n5m h VAL 408 Ca 0.00 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 1n5m h VAL 408 Cb 0.00 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1n5m h VAL 408 CO 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 177.57 176.95 1n5m h PRO 410 N 0.26 0.53 -0.40 0.00 0.11 -1.68 0.21 132.00 131.02 1n5m h PRO 410 Ca -0.01 -0.15 -0.10 0.00 0.11 0.00 0.00 66.00 65.85 1n5m h PRO 410 Cb 1.17 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1n5m h PRO 410 CO 0.11 0.64 -0.15 0.28 -0.21 0.00 0.00 178.00 178.66 1n5m h VAL 411 N 0.49 1.28 -0.41 3.15 2.07 -0.73 -0.77 116.25 121.33 1n5m h VAL 411 Ca 0.09 -1.27 0.01 0.00 0.82 0.00 0.00 66.70 66.35 1n5m h VAL 411 Cb 0.48 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1n5m h VAL 411 CO 0.03 0.42 0.27 0.00 0.02 0.00 0.00 177.57 178.31 1n5m h ALA 412 N 0.82 0.52 -0.27 1.67 0.00 -0.85 0.11 119.26 121.26 1n5m h ALA 412 Ca 0.09 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1n5m h ALA 412 Cb 0.69 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1n5m h ALA 412 CO 0.05 -0.03 0.12 0.37 0.00 0.00 0.00 179.25 179.76 1n5m h GLN 413 N 0.55 0.26 -0.35 0.00 5.75 -0.84 -1.21 115.11 119.26 1n5m h GLN 413 Ca 0.15 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1n5m h GLN 413 Cb -0.06 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 1n5m h GLN 413 CO -0.04 0.17 0.11 1.25 -2.65 0.00 0.00 178.83 177.67 1n5m h LEU 414 N 0.26 0.51 -0.69 -2.39 5.85 -0.65 -1.67 115.31 116.54 1n5m h LEU 414 Ca 0.11 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1n5m h LEU 414 Cb 0.05 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1n5m h LEU 414 CO -0.09 0.58 0.44 0.00 -0.34 0.00 0.00 178.44 179.04 1n5m h ALA 415 N 0.95 0.88 -0.27 1.25 0.00 -0.64 -0.72 119.26 120.71 1n5m h ALA 415 Ca 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1n5m h ALA 415 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1n5m h ALA 415 CO -0.00 0.25 0.09 0.78 0.00 0.00 0.00 179.25 180.37 1n5m h GLY 416 N 0.89 0.45 1.59 0.00 0.00 -1.08 -1.66 103.07 103.26 1n5m h GLY 416 Ca 0.26 -0.26 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1n5m h GLY 416 CO -0.08 0.25 -0.43 3.21 0.00 0.00 0.00 176.54 179.49 1n5m h ARG 417 N 0.28 0.44 -0.29 4.80 2.47 -1.08 -1.62 114.38 119.38 1n5m h ARG 417 Ca 0.09 -0.23 -0.06 0.00 -1.26 0.00 0.00 59.98 58.52 1n5m h ARG 417 Cb 0.23 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 1n5m h ARG 417 CO -0.00 0.80 -0.03 -0.07 0.56 0.00 0.00 179.97 181.22 1n5m h LEU 418 N 0.36 0.54 -0.24 3.04 3.38 -1.08 -0.79 115.31 120.52 1n5m h LEU 418 Ca 0.03 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1n5m h LEU 418 Cb 0.91 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1n5m h LEU 418 CO 0.08 0.75 0.11 0.00 0.09 0.00 0.00 178.44 179.47 1n5m h ALA 419 N 0.81 0.31 -0.18 1.53 0.00 -1.22 -0.19 119.26 120.33 1n5m h ALA 419 Ca 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1n5m h ALA 419 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1n5m h ALA 419 CO 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 179.25 179.15 1n5m h ALA 420 N 0.97 1.67 -0.23 0.00 0.00 -1.23 -1.84 119.26 118.60 1n5m h ALA 420 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1n5m h ALA 420 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1n5m h ALA 420 CO -0.01 0.25 0.00 1.04 0.00 0.00 0.00 179.25 180.53 1n5m n GLN 421 N -4.38 2.08 -0.32 0.00 3.00 -0.31 -4.89 117.38 112.56 1n5m n GLN 421 Ca -0.00 -1.06 0.00 0.00 -0.01 0.00 0.00 57.00 55.93 1n5m n GLN 421 Cb 0.18 -1.54 0.00 0.00 0.00 0.00 0.00 30.24 28.88 1n5m n GLN 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n5m n GLY 422 N 0.51 0.70 3.86 1.08 0.00 -0.69 -1.44 105.19 109.22 1n5m n GLY 422 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1n5m n GLY 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n5m s ALA 423 N -2.49 3.22 -0.36 4.61 0.00 -0.13 -4.03 121.76 122.58 1n5m s ALA 423 Ca 0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 51.96 51.70 1n5m s ALA 423 Cb 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.24 1n5m s ALA 423 CO 0.00 -0.18 0.55 0.50 0.00 0.00 0.00 175.76 176.63 1n5m s ARG 424 N -4.12 3.58 -0.07 0.00 6.06 -0.19 -4.36 118.95 119.85 1n5m s ARG 424 Ca 0.54 -0.16 0.04 0.00 -2.50 0.00 0.00 55.73 53.66 1n5m s ARG 424 Cb -0.10 -3.83 -0.02 0.00 0.06 0.00 0.00 34.95 31.06 1n5m s ARG 424 CO 0.34 -0.71 -0.19 0.08 -2.50 0.00 0.00 175.30 172.33 1n5m s VAL 425 N 2.50 2.63 -0.04 7.11 1.01 -1.26 -0.63 120.40 131.71 1n5m s VAL 425 Ca 0.20 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.39 1n5m s VAL 425 Cb -0.15 -2.02 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 1n5m s VAL 425 CO 0.14 0.57 -0.24 -0.31 0.00 0.00 0.00 175.10 175.27 1n5m s TYR 426 N -0.28 2.22 0.05 5.22 1.51 -0.27 0.16 117.35 125.96 1n5m s TYR 426 Ca 0.01 -0.56 0.06 0.00 -1.01 0.00 0.00 57.07 55.57 1n5m s TYR 426 Cb -0.13 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.25 1n5m s TYR 426 CO 0.03 -0.13 -0.16 0.00 -1.11 0.00 0.00 175.55 174.17 1n5m s ALA 427 N -0.31 1.38 0.15 3.71 0.00 -1.25 -0.40 121.76 125.03 1n5m s ALA 427 Ca 0.02 -0.96 -0.07 0.00 0.00 0.00 0.00 51.96 50.94 1n5m s ALA 427 Cb -0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 1n5m s ALA 427 CO 0.01 0.26 0.23 1.52 0.00 0.00 0.00 175.76 177.79 1n5m s TYR 428 N -0.96 0.48 -0.07 0.00 -0.85 -0.58 -1.36 117.35 114.00 1n5m s TYR 428 Ca 0.03 -0.85 0.01 0.00 -0.52 0.00 0.00 57.07 55.73 1n5m s TYR 428 Cb -0.09 -0.15 0.02 0.00 0.38 0.00 0.00 41.96 42.13 1n5m s TYR 428 CO 0.02 -0.67 -0.07 -1.50 -1.52 0.00 0.00 175.55 171.81 1n5m s ILE 429 N -3.98 0.81 -0.23 -3.49 2.07 -0.53 -2.10 121.20 113.75 1n5m s ILE 429 Ca 0.18 -0.24 -0.17 0.00 -1.41 0.00 0.00 60.65 59.01 1n5m s ILE 429 Cb 0.04 -0.82 -0.03 0.00 0.13 0.00 0.00 42.46 41.78 1n5m s ILE 429 CO -0.00 0.30 0.46 0.12 -1.91 0.00 0.00 174.94 173.90 1n5m s PHE 430 N 1.16 3.32 0.00 3.50 2.19 0.49 -0.88 117.98 127.76 1n5m s PHE 430 Ca -0.06 0.62 0.00 0.00 0.33 0.00 0.00 56.93 57.82 1n5m s PHE 430 Cb -0.14 -2.62 0.00 0.00 -1.31 0.00 0.00 43.02 38.95 1n5m s PHE 430 CO -0.01 -0.15 0.84 0.39 1.83 0.00 0.00 175.22 178.12 1n5m n GLU 431 N 5.00 1.81 -3.35 10.12 1.02 -0.12 -0.84 120.64 134.28 1n5m n GLU 431 Ca -0.06 -1.19 -0.38 0.00 -0.02 0.00 0.00 57.16 55.50 1n5m n GLU 431 Cb 0.50 -0.99 -0.07 0.00 -0.02 0.00 0.00 31.44 30.87 1n5m n GLU 431 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1n5m s HIS 432 N -0.70 3.40 -0.20 -0.32 2.46 -1.25 -4.94 115.29 113.75 1n5m s HIS 432 Ca 0.00 0.70 -0.20 0.00 0.47 0.00 0.00 55.06 56.04 1n5m s HIS 432 Cb 0.00 -2.56 -0.03 0.00 -0.13 0.00 0.00 32.58 29.86 1n5m s HIS 432 CO 0.00 0.01 0.57 0.50 -2.47 0.00 0.00 174.74 173.35 1n5m s ARG 433 N 1.23 4.19 0.29 2.88 3.52 -1.26 -4.93 118.95 124.88 1n5m s ARG 433 Ca 0.21 0.51 -0.30 0.00 -0.13 0.00 0.00 55.73 56.03 1n5m s ARG 433 Cb -0.15 -3.57 -0.12 0.00 -1.56 0.00 0.00 34.95 29.54 1n5m s ARG 433 CO 0.09 -0.21 1.46 0.00 -0.81 0.00 0.00 175.30 175.83 1n5m n ALA 434 N 4.96 1.77 0.31 6.12 0.00 -1.26 -4.84 120.51 127.57 1n5m n ALA 434 Ca -0.03 0.38 0.20 0.00 0.00 0.00 0.00 53.44 53.99 1n5m n ALA 434 Cb 0.50 -2.35 0.98 0.00 0.00 0.00 0.00 19.45 18.58 1n5m n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1n5m h SER 435 N 4.07 0.00 -0.19 0.00 4.64 -1.96 -1.67 113.55 118.44 1n5m h SER 435 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1n5m h SER 435 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1n5m h SER 435 CO 0.74 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 177.06 1n5m n THR 436 N -3.16 0.23 -1.79 2.95 -2.24 -1.26 -4.97 114.28 104.05 1n5m n THR 436 Ca -0.02 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 1n5m n THR 436 Cb 0.17 0.64 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 1n5m n THR 436 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1n5m s LEU 437 N -1.65 4.36 0.00 3.22 2.96 -0.63 -4.92 118.68 122.02 1n5m s LEU 437 Ca 0.34 2.87 0.24 0.00 -0.22 0.00 0.00 54.13 57.36 1n5m s LEU 437 Cb 0.19 -3.62 0.18 0.00 0.50 0.00 0.00 46.19 43.44 1n5m s LEU 437 CO 0.29 -0.91 1.22 0.35 -1.32 0.00 0.00 176.35 175.97 1n5m n THR 438 N 2.99 0.00 -2.47 3.68 -2.24 -1.26 -4.94 114.28 110.04 1n5m n THR 438 Ca 0.11 -0.32 -0.31 0.00 -2.27 0.00 0.00 64.05 61.27 1n5m n THR 438 Cb 0.37 1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.79 1n5m n THR 438 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1n5m s TRP 439 N -2.32 3.51 0.90 4.78 0.52 -1.26 -4.92 118.94 120.15 1n5m s TRP 439 Ca 0.23 1.22 -0.10 0.00 0.02 0.00 0.00 56.10 57.46 1n5m s TRP 439 Cb 0.19 -2.61 0.14 0.00 -1.15 0.00 0.00 33.47 30.04 1n5m s TRP 439 CO 0.48 -0.34 1.15 -1.25 0.02 0.00 0.00 176.95 177.01 1n5m s PRO 440 N -4.30 1.10 0.43 4.98 0.04 -1.26 -4.92 135.00 131.07 1n5m s PRO 440 Ca 0.54 1.54 0.13 0.00 0.04 0.00 0.00 61.00 63.25 1n5m s PRO 440 Cb -0.10 -1.74 0.94 0.00 0.04 0.00 0.00 34.50 33.63 1n5m s PRO 440 CO 0.37 -2.57 1.97 -0.07 0.04 0.00 0.00 177.00 176.74 1n5m h LEU 441 N -1.81 0.06 -2.48 -3.56 3.38 -1.95 -2.56 115.31 106.39 1n5m h LEU 441 Ca -0.43 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1n5m h LEU 441 Cb 1.27 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1n5m h LEU 441 CO 0.42 0.24 -0.02 4.11 0.09 0.00 0.00 178.44 183.28 1n5m h TRP 442 N 0.06 0.00 0.00 1.13 5.08 -1.92 -1.29 115.95 119.00 1n5m h TRP 442 Ca 0.01 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.98 1n5m h TRP 442 Cb 0.34 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.50 1n5m h TRP 442 CO 0.00 0.02 0.00 -1.33 -1.28 0.00 0.00 178.44 175.85 1n5m n MET 443 N -3.62 0.12 0.00 0.12 2.81 -0.97 -4.97 117.12 110.61 1n5m n MET 443 Ca -0.03 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1n5m n MET 443 Cb 0.11 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1n5m n MET 443 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n5m n GLY 444 N 0.83 3.78 3.18 3.03 0.00 -0.49 -3.72 105.19 111.79 1n5m n GLY 444 Ca 0.08 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1n5m n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n5m s VAL 445 N 0.00 4.30 0.72 1.61 1.01 -1.26 -4.86 120.40 121.92 1n5m s VAL 445 Ca 0.00 -2.56 -0.12 0.00 0.00 0.00 0.00 61.98 59.30 1n5m s VAL 445 Cb 0.00 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.64 1n5m s VAL 445 CO 0.00 -0.89 1.09 -2.84 0.00 0.00 0.00 175.10 172.46 1n5m s PRO 446 N 0.33 2.57 0.03 2.72 0.02 -1.24 -0.84 135.00 138.58 1n5m s PRO 446 Ca 0.15 1.19 -0.37 0.00 0.02 0.00 0.00 61.00 61.99 1n5m s PRO 446 Cb -0.19 -1.93 -0.16 0.00 0.02 0.00 0.00 34.50 32.24 1n5m s PRO 446 CO -0.04 -1.40 1.50 1.58 -0.33 0.00 0.00 177.00 178.30 1n5m n HIS 447 N -3.09 1.82 0.00 6.54 -0.00 -1.24 -1.67 115.22 117.58 1n5m n HIS 447 Ca 0.09 0.50 0.00 0.00 -0.00 0.00 0.00 57.72 58.31 1n5m n HIS 447 Cb 0.53 -2.42 0.00 0.00 -0.00 0.00 0.00 29.99 28.10 1n5m n HIS 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1n5m n GLY 448 N 3.12 1.13 0.68 1.57 0.00 -1.26 -4.94 105.19 105.48 1n5m n GLY 448 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 1n5m n GLY 448 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1n5m n TYR 449 N -2.00 0.51 0.02 1.61 4.02 -0.67 -2.95 117.16 117.70 1n5m n TYR 449 Ca 0.00 -0.23 0.08 0.00 -0.01 0.00 0.00 57.90 57.73 1n5m n TYR 449 Cb 0.00 -0.04 -0.11 0.00 -0.02 0.00 0.00 39.34 39.17 1n5m n TYR 449 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1n5m n GLU 450 N 0.44 0.64 -0.09 -0.72 0.00 -1.26 -4.55 120.64 115.10 1n5m n GLU 450 Ca 0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 57.16 57.18 1n5m n GLU 450 Cb 0.33 -1.65 0.01 0.00 0.00 0.00 0.00 31.44 30.13 1n5m n GLU 450 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1n5m h ILE 451 N 0.00 0.77 -0.34 3.84 2.04 -1.93 -1.45 117.51 120.44 1n5m h ILE 451 Ca -0.08 -0.04 0.10 0.00 1.00 0.00 0.00 64.86 65.84 1n5m h ILE 451 Cb 1.20 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1n5m h ILE 451 CO 0.01 0.02 0.30 1.05 0.00 0.00 0.00 178.15 179.53 1n5m h GLU 452 N 0.11 0.00 0.20 2.37 4.11 -1.80 -1.51 114.58 118.07 1n5m h GLU 452 Ca 0.16 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.32 1n5m h GLU 452 Cb 0.21 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.49 1n5m h GLU 452 CO -0.26 0.00 -1.17 0.74 0.07 0.00 0.00 179.01 178.39 1n5m h PHE 453 N 0.00 0.79 -0.96 2.06 0.04 -1.56 -1.40 116.94 115.92 1n5m h PHE 453 Ca 0.16 -0.57 -0.00 0.00 2.80 0.00 0.00 57.97 60.36 1n5m h PHE 453 Cb 0.77 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.84 1n5m h PHE 453 CO 0.00 1.45 0.59 0.82 -0.60 0.00 0.00 178.31 180.56 1n5m h ILE 454 N -0.09 1.26 0.00 -0.55 1.08 -0.87 -1.72 117.51 116.62 1n5m h ILE 454 Ca -0.20 -0.55 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1n5m h ILE 454 Cb 1.92 -0.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 1n5m h ILE 454 CO 0.22 0.27 0.00 0.49 -0.69 0.00 0.00 178.15 178.44 1n5m n PHE 455 N -4.36 0.00 -1.16 1.37 3.01 -0.66 -4.45 117.46 111.21 1n5m n PHE 455 Ca 0.11 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.55 1n5m n PHE 455 Cb 0.05 -0.27 -0.01 0.00 -0.01 0.00 0.00 39.48 39.25 1n5m n PHE 455 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1n5m n GLY 456 N 1.22 0.50 0.33 1.37 0.00 -0.65 -4.15 105.19 103.82 1n5m n GLY 456 Ca 0.15 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.29 1n5m n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n5m h LEU 457 N 0.00 0.28 -2.63 0.99 4.07 -1.51 -1.13 115.31 115.39 1n5m h LEU 457 Ca -0.04 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.93 1n5m h LEU 457 Cb 0.22 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 41.90 1n5m h LEU 457 CO 0.06 0.18 0.09 -0.65 -1.08 0.00 0.00 178.44 177.04 1n5m h PRO 458 N 0.32 0.00 0.00 1.13 0.11 -1.91 0.10 132.00 131.75 1n5m h PRO 458 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1n5m h PRO 458 Cb 0.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.49 1n5m h PRO 458 CO -0.04 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.68 1n5m h LEU 459 N 0.00 0.00 -8.57 2.35 4.07 -1.52 -3.41 115.31 108.23 1n5m h LEU 459 Ca 0.01 0.00 -0.58 0.00 0.08 0.00 0.00 57.88 57.39 1n5m h LEU 459 Cb 0.20 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 41.84 1n5m h LEU 459 CO -0.00 0.00 0.77 -0.62 -1.08 0.00 0.00 178.44 177.51 1n5m s ASP 460 N -4.78 6.42 0.23 -0.43 -1.08 0.36 -4.82 116.67 112.58 1n5m s ASP 460 Ca 0.00 -0.05 -0.14 0.00 -0.52 0.00 0.00 52.55 51.85 1n5m s ASP 460 Cb 0.09 -2.49 0.29 0.00 -1.46 0.00 0.00 42.92 39.35 1n5m s ASP 460 CO 0.40 -1.31 1.58 -0.65 0.52 0.00 0.00 175.17 175.71 1n5m h PRO 461 N 9.38 -0.03 0.00 4.34 0.11 -1.87 0.32 132.00 144.24 1n5m h PRO 461 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1n5m h PRO 461 Cb 1.07 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1n5m h PRO 461 CO 1.12 -0.02 0.04 -1.13 -0.21 0.00 0.00 178.00 177.80 1n5m n SER 462 N -5.51 0.00 -0.01 -2.05 3.41 -1.26 -2.50 113.62 105.70 1n5m n SER 462 Ca 0.10 0.31 0.12 0.00 -0.26 0.00 0.00 58.87 59.14 1n5m n SER 462 Cb 0.41 -0.31 0.16 0.00 -0.26 0.00 0.00 64.21 64.21 1n5m n SER 462 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n5m n LEU 463 N -1.29 0.64 -1.01 1.04 4.77 0.10 -5.00 117.00 116.24 1n5m n LEU 463 Ca 0.00 -0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 55.75 1n5m n LEU 463 Cb 0.04 -0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 1n5m n LEU 463 CO 0.00 0.16 -0.12 0.59 -1.33 0.00 0.00 177.39 176.69 1n5m n ASN 464 N -1.48 -3.60 -4.86 -1.43 3.02 -1.04 -5.02 115.26 100.85 1n5m n ASN 464 Ca 0.05 0.07 -0.31 0.00 -0.03 0.00 0.00 54.58 54.36 1n5m n ASN 464 Cb 0.33 -2.58 0.02 0.00 -0.61 0.00 0.00 39.78 36.94 1n5m n ASN 464 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1n5m s TYR 465 N -2.45 3.52 0.75 3.10 2.02 -1.26 -4.87 117.35 118.16 1n5m s TYR 465 Ca 0.00 1.28 -0.11 0.00 -0.37 0.00 0.00 57.07 57.87 1n5m s TYR 465 Cb 0.00 -2.78 0.04 0.00 -0.40 0.00 0.00 41.96 38.82 1n5m s TYR 465 CO 0.00 -0.82 1.09 0.95 -1.57 0.00 0.00 175.55 175.20 1n5m s THR 466 N -3.18 3.32 0.32 -0.71 -4.23 -1.26 -4.89 115.64 105.00 1n5m s THR 466 Ca 0.56 0.43 -0.00 0.00 -1.18 0.00 0.00 61.69 61.49 1n5m s THR 466 Cb -0.11 -3.29 0.24 0.00 1.34 0.00 0.00 72.50 70.68 1n5m s THR 466 CO 0.54 -0.56 1.96 0.74 -0.54 0.00 0.00 174.62 176.76 1n5m h THR 467 N -0.87 1.20 -0.60 3.99 2.02 -1.97 -1.53 112.91 115.14 1n5m h THR 467 Ca -0.46 -0.42 -0.10 0.00 0.77 0.00 0.00 66.41 66.20 1n5m h THR 467 Cb 1.26 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1n5m h THR 467 CO 0.61 0.20 -0.00 -0.33 0.37 0.00 0.00 175.52 176.37 1n5m h GLU 468 N 0.96 1.06 -0.34 6.66 3.07 -2.00 -2.31 114.58 121.69 1n5m h GLU 468 Ca 0.25 -0.34 -0.05 0.00 -0.50 0.00 0.00 59.36 58.72 1n5m h GLU 468 Cb -0.05 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 1n5m h GLU 468 CO -0.05 1.04 -0.02 0.93 -1.40 0.00 0.00 179.01 179.51 1n5m h GLU 469 N 0.97 0.54 -0.09 2.33 5.08 -1.70 0.32 114.58 122.03 1n5m h GLU 469 Ca 0.17 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1n5m h GLU 469 Cb 0.56 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1n5m h GLU 469 CO 0.03 0.58 0.03 -0.09 -1.00 0.00 0.00 179.01 178.57 1n5m h ARG 470 N 0.52 0.14 -0.66 2.33 2.43 -1.03 0.17 114.38 118.28 1n5m h ARG 470 Ca 0.11 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 1n5m h ARG 470 Cb 0.36 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1n5m h ARG 470 CO 0.01 0.27 0.18 0.82 -1.51 0.00 0.00 179.97 179.75 1n5m h ILE 471 N -0.02 1.25 -0.30 1.20 5.03 -1.10 -2.21 117.51 121.36 1n5m h ILE 471 Ca 0.03 -0.90 -0.00 0.00 -0.12 0.00 0.00 64.86 63.87 1n5m h ILE 471 Cb 0.19 0.55 -0.01 0.00 -3.03 0.00 0.00 36.82 34.51 1n5m h ILE 471 CO -0.00 0.35 0.17 0.15 -0.68 0.00 0.00 178.15 178.13 1n5m h PHE 472 N 0.99 0.40 -0.62 1.37 3.57 -0.64 -1.89 116.94 120.11 1n5m h PHE 472 Ca 0.21 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.76 1n5m h PHE 472 Cb 0.32 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 1n5m h PHE 472 CO 0.02 0.32 0.34 0.00 -2.23 0.00 0.00 178.31 176.76 1n5m h ALA 473 N 1.04 0.82 -0.86 2.41 0.00 -0.35 -1.52 119.26 120.80 1n5m h ALA 473 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1n5m h ALA 473 Cb 0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1n5m h ALA 473 CO -0.02 0.00 0.49 1.96 0.00 0.00 0.00 179.25 181.68 1n5m h GLN 474 N 0.63 1.19 -0.32 0.00 4.20 -1.13 -0.13 115.11 119.54 1n5m h GLN 474 Ca 0.28 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.87 1n5m h GLN 474 Cb 0.18 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1n5m h GLN 474 CO -0.18 0.86 0.20 0.00 -0.67 0.00 0.00 178.83 179.04 1n5m h ARG 475 N 1.19 0.40 -0.27 1.46 3.08 -0.59 -1.53 114.38 118.14 1n5m h ARG 475 Ca 0.30 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 1n5m h ARG 475 Cb 0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1n5m h ARG 475 CO -0.05 0.27 0.14 -0.07 -1.07 0.00 0.00 179.97 179.18 1n5m h LEU 476 N 0.41 0.35 -1.13 3.04 3.38 -0.69 -0.27 115.31 120.41 1n5m h LEU 476 Ca 0.12 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.06 1n5m h LEU 476 Cb -0.03 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 1n5m h LEU 476 CO -0.04 0.36 0.60 0.24 0.09 0.00 0.00 178.44 179.69 1n5m h MET 477 N 0.31 0.97 0.06 1.13 2.86 -0.91 -0.46 114.93 118.89 1n5m h MET 477 Ca 0.09 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1n5m h MET 477 Cb 0.10 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.54 1n5m h MET 477 CO -0.01 0.64 -0.03 0.87 1.06 0.00 0.00 176.91 179.44 1n5m h LYS 478 N 1.00 -0.08 -0.49 1.72 1.79 -0.64 -0.15 116.57 119.73 1n5m h LYS 478 Ca 0.41 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.94 1n5m h LYS 478 Cb 0.29 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.91 1n5m h LYS 478 CO -0.17 0.04 0.22 1.88 -1.08 0.00 0.00 179.45 180.34 1n5m h TYR 479 N -0.17 0.40 -0.22 -1.35 0.05 -0.14 0.16 116.97 115.70 1n5m h TYR 479 Ca -0.01 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 1n5m h TYR 479 Cb 0.15 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 1n5m h TYR 479 CO -0.04 0.18 -0.05 -1.49 -1.05 0.00 0.00 178.16 175.70 1n5m h TRP 480 N 0.43 0.48 -0.04 4.88 6.55 -0.98 -1.29 115.95 125.98 1n5m h TRP 480 Ca 0.23 -0.10 -0.13 0.00 0.95 0.00 0.00 58.89 59.83 1n5m h TRP 480 Cb 0.18 -0.12 -0.01 0.00 -0.86 0.00 0.00 29.16 28.35 1n5m h TRP 480 CO -0.12 0.66 -0.58 1.79 -1.05 0.00 0.00 178.44 179.14 1n5m h THR 481 N 0.16 1.40 -0.48 1.49 1.35 -0.91 0.36 112.91 116.27 1n5m h THR 481 Ca 0.06 -1.95 -0.07 0.00 -0.55 0.00 0.00 66.41 63.90 1n5m h THR 481 Cb 0.50 2.01 -0.02 0.00 -1.73 0.00 0.00 68.15 68.92 1n5m h THR 481 CO 0.02 0.57 0.04 0.78 -0.25 0.00 0.00 175.52 176.68 1n5m h ASN 482 N 0.10 0.80 -0.63 5.36 2.35 -0.62 0.94 115.58 123.87 1n5m h ASN 482 Ca -0.00 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 1n5m h ASN 482 Cb 1.05 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.18 1n5m h ASN 482 CO 0.08 0.88 0.31 0.15 -1.65 0.00 0.00 177.43 177.21 1n5m h PHE 483 N 0.68 0.90 -0.66 1.19 3.57 -0.92 0.22 116.94 121.93 1n5m h PHE 483 Ca 0.14 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1n5m h PHE 483 Cb 0.45 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1n5m h PHE 483 CO 0.03 0.68 0.32 0.00 -2.23 0.00 0.00 178.31 177.11 1n5m h ALA 484 N 1.14 0.84 -0.38 2.41 0.00 -0.56 0.47 119.26 123.18 1n5m h ALA 484 Ca 0.22 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1n5m h ALA 484 Cb 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1n5m h ALA 484 CO -0.03 0.40 -0.25 0.00 0.00 0.00 0.00 179.25 179.37 1n5m h ARG 485 N 0.90 0.85 0.00 0.00 3.08 -0.37 -3.41 114.38 115.44 1n5m h ARG 485 Ca 0.23 -0.40 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1n5m h ARG 485 Cb 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1n5m h ARG 485 CO -0.03 1.04 -0.10 0.25 -1.07 0.00 0.00 179.97 180.06 1n5m n THR 486 N -4.20 0.00 -0.76 2.04 -2.24 0.74 -5.00 114.28 104.86 1n5m n THR 486 Ca -0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1n5m n THR 486 Cb 0.46 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 1n5m n THR 486 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n5m n GLY 487 N 0.86 0.58 2.88 3.38 0.00 0.16 -5.02 105.19 108.03 1n5m n GLY 487 Ca 0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 1n5m n GLY 487 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n5m s ASP 488 N -2.34 0.70 0.37 1.61 -1.08 -1.26 -4.91 116.67 109.77 1n5m s ASP 488 Ca 0.00 0.36 0.27 0.00 -0.52 0.00 0.00 52.55 52.66 1n5m s ASP 488 Cb 0.00 0.41 1.24 0.00 -1.46 0.00 0.00 42.92 43.11 1n5m s ASP 488 CO 0.00 -0.25 1.82 1.55 0.52 0.00 0.00 175.17 178.81 1n5m h PRO 489 N 8.34 0.00 -6.99 4.34 0.13 -1.83 -3.15 132.00 132.84 1n5m h PRO 489 Ca -0.14 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.50 1n5m h PRO 489 Cb 1.12 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.29 1n5m h PRO 489 CO 0.15 0.00 0.45 -0.80 -0.23 0.00 0.00 178.00 177.57 1n5m s ASN 490 N -4.62 6.43 -0.15 1.44 0.01 -1.26 -4.36 114.94 112.42 1n5m s ASN 490 Ca 0.01 2.18 -0.29 0.00 -0.71 0.00 0.00 52.86 54.05 1n5m s ASN 490 Cb 0.09 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 1n5m s ASN 490 CO 0.39 -0.73 1.19 -0.62 -1.51 0.00 0.00 177.10 175.82 1n5m s ASP 491 N -1.47 7.01 0.36 -1.22 2.15 -1.26 -4.92 116.67 117.33 1n5m s ASP 491 Ca 0.61 1.65 0.12 0.00 0.43 0.00 0.00 52.55 55.37 1n5m s ASP 491 Cb -0.25 -2.54 0.93 0.00 -0.30 0.00 0.00 42.92 40.75 1n5m s ASP 491 CO 0.31 -0.69 1.81 -0.65 -0.17 0.00 0.00 175.17 175.78 1n5m h PRO 492 N 7.85 0.56 0.00 4.34 0.11 -1.94 -3.34 132.00 139.58 1n5m h PRO 492 Ca -0.27 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1n5m h PRO 492 Cb 1.11 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1n5m h PRO 492 CO 0.95 0.37 0.00 0.54 -0.21 0.00 0.00 178.00 179.65 1n5m n ARG 493 N -4.63 0.00 -0.14 1.05 1.74 -1.26 -4.84 116.66 108.58 1n5m n ARG 493 Ca 0.22 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.28 1n5m n ARG 493 Cb 0.66 -0.02 -0.01 0.00 -1.02 0.00 0.00 32.46 32.07 1n5m n ARG 493 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1n5m n ASP 494 N 0.00 -0.19 0.16 0.55 -0.08 -1.25 -4.79 116.55 110.95 1n5m n ASP 494 Ca 0.00 -0.10 0.04 0.00 -1.51 0.00 0.00 54.79 53.22 1n5m n ASP 494 Cb 0.00 -0.06 0.13 0.00 2.34 0.00 0.00 41.12 43.53 1n5m n ASP 494 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1n5m h SER 495 N 1.11 0.00 -0.02 1.67 0.02 -1.88 -3.37 113.55 111.07 1n5m h SER 495 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1n5m h SER 495 Cb 0.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1n5m h SER 495 CO 0.15 0.45 -0.09 0.11 -1.14 0.00 0.00 176.83 176.31 1n5m h LYS 496 N 0.00 -0.09 -6.64 3.45 6.56 -1.99 -3.43 116.57 114.44 1n5m h LYS 496 Ca -0.00 0.01 -0.58 0.00 -1.06 0.00 0.00 60.65 59.01 1n5m h LYS 496 Cb 1.23 0.02 0.13 0.00 -0.57 0.00 0.00 32.23 33.04 1n5m h LYS 496 CO 0.06 -0.06 0.16 0.43 -2.06 0.00 0.00 179.45 177.97 1n5m n SER 497 N -3.04 1.23 -4.70 0.86 7.64 -1.26 -4.89 113.62 109.47 1n5m n SER 497 Ca -0.01 1.03 -0.34 0.00 1.01 0.00 0.00 58.87 60.56 1n5m n SER 497 Cb 0.06 -1.35 0.11 0.00 -1.01 0.00 0.00 64.21 62.02 1n5m n SER 497 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1n5m s PRO 498 N -2.00 1.83 0.34 1.43 0.04 -1.26 -4.96 135.00 130.42 1n5m s PRO 498 Ca 0.63 1.83 -0.10 0.00 0.04 0.00 0.00 61.00 63.40 1n5m s PRO 498 Cb -0.56 -1.79 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 1n5m s PRO 498 CO 0.57 -2.08 0.69 -0.65 0.04 0.00 0.00 177.00 175.57 1n5m s GLN 499 N -3.97 3.80 -0.44 4.56 -1.52 -1.26 -4.86 119.66 115.97 1n5m s GLN 499 Ca 0.75 0.39 -0.16 0.00 -1.95 0.00 0.00 55.36 54.40 1n5m s GLN 499 Cb -0.31 -2.48 0.04 0.00 -0.22 0.00 0.00 33.01 30.04 1n5m s GLN 499 CO 0.48 0.09 0.36 -0.46 -0.25 0.00 0.00 175.29 175.52 1n5m s TRP 500 N -2.17 3.22 0.43 0.91 -0.11 -1.26 -4.92 118.94 115.04 1n5m s TRP 500 Ca 0.50 -0.68 -0.12 0.00 1.22 0.00 0.00 56.10 57.02 1n5m s TRP 500 Cb -0.10 -2.86 -0.07 0.00 -1.50 0.00 0.00 33.47 28.93 1n5m s TRP 500 CO 0.27 -0.69 0.82 -1.25 -4.62 0.00 0.00 176.95 171.48 1n5m s PRO 501 N 1.76 3.82 0.72 5.86 0.04 -1.26 -4.85 135.00 141.08 1n5m s PRO 501 Ca 0.06 0.58 -0.16 0.00 0.04 0.00 0.00 61.00 61.53 1n5m s PRO 501 Cb -0.21 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.03 1n5m s PRO 501 CO 0.09 -0.09 1.23 -2.14 0.04 0.00 0.00 177.00 176.13 1n5m s PRO 502 N -3.90 2.20 -0.03 0.56 0.02 -1.26 -4.71 135.00 127.87 1n5m s PRO 502 Ca 0.53 1.84 -0.19 0.00 0.02 0.00 0.00 61.00 63.19 1n5m s PRO 502 Cb -0.10 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.54 1n5m s PRO 502 CO 0.31 -1.81 0.55 -0.47 -0.33 0.00 0.00 177.00 175.26 1n5m s TYR 503 N -1.85 3.64 0.08 6.54 6.14 0.42 -4.54 117.35 127.79 1n5m s TYR 503 Ca 0.76 1.10 0.02 0.00 0.64 0.00 0.00 57.07 59.59 1n5m s TYR 503 Cb -0.31 -2.56 -0.04 0.00 0.42 0.00 0.00 41.96 39.47 1n5m s TYR 503 CO 0.44 0.33 -0.07 0.95 0.64 0.00 0.00 175.55 177.84 1n5m s THR 504 N -0.07 0.65 0.33 4.34 -4.23 -1.26 -4.44 115.64 110.96 1n5m s THR 504 Ca 0.29 -1.65 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 1n5m s THR 504 Cb -0.17 -1.33 0.18 0.00 1.34 0.00 0.00 72.50 72.52 1n5m s THR 504 CO 0.15 -0.71 1.90 0.71 -0.54 0.00 0.00 174.62 176.13 1n5m h THR 505 N 3.47 1.19 0.70 3.99 1.35 -1.92 0.61 112.91 122.30 1n5m h THR 505 Ca -0.35 -0.67 -0.03 0.00 -0.55 0.00 0.00 66.41 64.80 1n5m h THR 505 Cb 1.18 0.76 0.01 0.00 -1.73 0.00 0.00 68.15 68.36 1n5m h THR 505 CO 0.57 0.25 -0.34 0.00 -0.25 0.00 0.00 175.52 175.75 1n5m h ALA 506 N 1.50 -0.98 0.00 6.62 0.00 -2.00 -3.37 119.26 121.04 1n5m h ALA 506 Ca 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1n5m h ALA 506 Cb 0.23 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1n5m h ALA 506 CO -0.00 -0.91 -1.24 0.00 0.00 0.00 0.00 179.25 177.10 1n5m n ALA 507 N -2.67 2.48 -4.03 0.00 0.00 -1.21 -5.00 120.51 110.08 1n5m n ALA 507 Ca -0.12 -0.33 -0.32 0.00 0.00 0.00 0.00 53.44 52.67 1n5m n ALA 507 Cb 0.37 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1n5m n ALA 507 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1n5m n GLN 508 N -2.64 -4.48 -2.95 0.00 6.02 0.21 -4.36 117.38 109.18 1n5m n GLN 508 Ca -0.02 0.50 -0.35 0.00 -0.01 0.00 0.00 57.00 57.12 1n5m n GLN 508 Cb 0.60 -5.28 -0.06 0.00 1.02 0.00 0.00 30.24 26.51 1n5m n GLN 508 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1n5m s GLN 509 N -6.72 4.27 0.19 -1.09 -0.21 -1.26 -0.66 119.66 114.18 1n5m s GLN 509 Ca 0.64 1.01 -0.18 0.00 0.02 0.00 0.00 55.36 56.85 1n5m s GLN 509 Cb -0.33 -2.54 0.03 0.00 1.00 0.00 0.00 33.01 31.17 1n5m s GLN 509 CO 0.87 0.18 0.53 1.52 -2.12 0.00 0.00 175.29 176.28 1n5m s TYR 510 N -1.85 -0.17 0.27 0.91 1.13 -0.62 -4.07 117.35 112.95 1n5m s TYR 510 Ca 0.53 -0.16 0.11 0.00 -1.41 0.00 0.00 57.07 56.14 1n5m s TYR 510 Cb -0.13 0.42 -0.05 0.00 -1.10 0.00 0.00 41.96 41.10 1n5m s TYR 510 CO 0.18 -0.91 -0.11 0.14 -2.51 0.00 0.00 175.55 172.34 1n5m s VAL 511 N -3.86 2.92 -0.16 -3.49 -7.23 -0.47 -0.36 120.40 107.75 1n5m s VAL 511 Ca 0.08 -2.16 -0.13 0.00 -1.81 0.00 0.00 61.98 57.96 1n5m s VAL 511 Cb -0.01 -2.54 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 1n5m s VAL 511 CO -0.04 -0.37 0.26 -0.94 -0.31 0.00 0.00 175.10 173.71 1n5m s SER 512 N -3.53 6.41 -0.32 4.85 1.04 -0.67 -1.46 113.70 120.02 1n5m s SER 512 Ca 0.30 0.48 -0.07 0.00 0.48 0.00 0.00 55.95 57.14 1n5m s SER 512 Cb -0.06 -2.16 0.03 0.00 0.10 0.00 0.00 66.02 63.92 1n5m s SER 512 CO 0.17 0.14 0.10 -0.76 0.98 0.00 0.00 173.24 173.87 1n5m s LEU 513 N 0.31 4.17 0.00 2.42 1.43 -0.06 -4.04 118.68 122.90 1n5m s LEU 513 Ca 0.15 -0.96 -0.02 0.00 -1.03 0.00 0.00 54.13 52.27 1n5m s LEU 513 Cb -0.13 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.21 1n5m s LEU 513 CO 0.03 -0.28 0.12 -0.46 0.23 0.00 0.00 176.35 175.99 1n5m n ASN 514 N 4.85 -0.35 0.29 2.29 2.04 -1.26 -0.94 115.26 122.18 1n5m n ASN 514 Ca -0.13 -1.27 0.16 0.00 -0.44 0.00 0.00 54.58 52.89 1n5m n ASN 514 Cb 0.46 0.59 0.88 0.00 -2.53 0.00 0.00 39.78 39.18 1n5m n ASN 514 CO 0.00 0.00 0.00 -0.07 -0.44 0.00 0.00 177.26 176.75 1n5m h LEU 515 N 0.00 0.00-10.42 -4.53 3.38 -1.96 -3.43 115.31 98.35 1n5m h LEU 515 Ca -0.05 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.43 1n5m h LEU 515 Cb 0.20 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.01 1n5m h LEU 515 CO 0.07 0.05 0.26 -0.54 0.09 0.00 0.00 178.44 178.37 1n5m s LYS 516 N -4.30 3.07 0.69 1.13 1.02 -1.26 -5.02 119.74 115.06 1n5m s LYS 516 Ca -0.04 0.24 -0.16 0.00 0.02 0.00 0.00 55.97 56.03 1n5m s LYS 516 Cb 0.14 -2.19 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 1n5m s LYS 516 CO 0.54 -0.71 1.23 -2.14 -0.92 0.00 0.00 175.35 173.35 1n5m s PRO 517 N -5.08 2.39 0.12 -1.68 0.02 -1.26 -4.85 135.00 124.65 1n5m s PRO 517 Ca 0.54 1.85 -0.34 0.00 0.02 0.00 0.00 61.00 63.07 1n5m s PRO 517 Cb -0.11 -1.85 -0.17 0.00 0.02 0.00 0.00 34.50 32.39 1n5m s PRO 517 CO 0.48 -1.67 1.02 1.28 -0.33 0.00 0.00 177.00 177.78 1n5m n LEU 518 N -2.32 0.52 -4.12 -5.54 4.77 -1.26 -4.97 117.00 104.09 1n5m n LEU 518 Ca 0.14 1.14 -0.28 0.00 -0.03 0.00 0.00 56.01 56.99 1n5m n LEU 518 Cb 0.50 -1.07 -0.17 0.00 -2.33 0.00 0.00 43.42 40.35 1n5m n LEU 518 CO 0.47 -1.81 -0.51 -0.70 -1.33 0.00 0.00 177.39 173.51 1n5m s GLU 519 N -0.34 2.22 -0.04 3.23 2.12 -1.26 -4.75 118.70 119.88 1n5m s GLU 519 Ca 0.77 -0.62 -0.19 0.00 0.36 0.00 0.00 54.97 55.29 1n5m s GLU 519 Cb -1.00 -1.77 -0.05 0.00 0.26 0.00 0.00 34.13 31.57 1n5m s GLU 519 CO 0.54 0.12 0.53 0.08 -0.54 0.00 0.00 175.26 176.00 1n5m s VAL 520 N 0.44 5.02 0.29 3.70 1.01 -1.26 -1.67 120.40 127.92 1n5m s VAL 520 Ca -0.14 1.10 0.06 0.00 0.00 0.00 0.00 61.98 63.00 1n5m s VAL 520 Cb -0.16 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 1n5m s VAL 520 CO 0.05 0.41 -0.04 -0.13 0.00 0.00 0.00 175.10 175.39 1n5m s ARG 521 N -0.03 1.56 -0.02 2.72 0.52 0.52 -4.98 118.95 119.25 1n5m s ARG 521 Ca 0.29 -1.80 0.06 0.00 -0.52 0.00 0.00 55.73 53.75 1n5m s ARG 521 Cb -0.17 -1.11 -0.01 0.00 0.52 0.00 0.00 34.95 34.18 1n5m s ARG 521 CO 0.14 0.00 -0.18 1.03 0.02 0.00 0.00 175.30 176.31 1n5m s ARG 522 N -3.75 1.54 -0.01 3.54 0.52 -1.26 -1.58 118.95 117.94 1n5m s ARG 522 Ca 0.30 -0.66 -0.01 0.00 -0.52 0.00 0.00 55.73 54.85 1n5m s ARG 522 Cb 0.05 -1.47 0.00 0.00 0.52 0.00 0.00 34.95 34.05 1n5m s ARG 522 CO 0.12 0.38 0.02 0.41 0.02 0.00 0.00 175.30 176.25 1n5m n GLY 523 N 2.68 -3.46 3.51 -3.53 0.00 0.17 -4.89 105.19 99.67 1n5m n GLY 523 Ca -0.15 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1n5m n GLY 523 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n5m s LEU 524 N -0.13 4.06 -1.64 0.99 2.96 -1.26 -4.12 118.68 119.54 1n5m s LEU 524 Ca -0.02 -1.36 -0.14 0.00 -0.22 0.00 0.00 54.13 52.40 1n5m s LEU 524 Cb 0.00 -2.49 0.12 0.00 0.50 0.00 0.00 46.19 44.32 1n5m s LEU 524 CO 0.05 -1.43 0.68 0.54 -1.32 0.00 0.00 176.35 174.87 1n5m n ARG 525 N 8.08 -3.11 -0.15 1.98 5.12 -1.26 -4.75 116.66 122.57 1n5m n ARG 525 Ca 0.18 0.37 -0.04 0.00 -1.93 0.00 0.00 57.85 56.42 1n5m n ARG 525 Cb 0.49 -4.92 0.02 0.00 -1.16 0.00 0.00 32.46 26.89 1n5m n ARG 525 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n5m h ALA 526 N 0.90 0.12 0.46 7.54 0.00 -1.93 0.29 119.26 126.64 1n5m h ALA 526 Ca -0.60 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1n5m h ALA 526 Cb 1.38 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1n5m h ALA 526 CO 0.75 -0.56 -0.22 0.37 0.00 0.00 0.00 179.25 179.58 1n5m h GLN 527 N -0.12 -0.59 -0.79 0.00 5.75 -1.95 -1.76 115.11 115.65 1n5m h GLN 527 Ca 0.22 0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.74 1n5m h GLN 527 Cb 0.46 0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.11 1n5m h GLN 527 CO -0.55 -0.37 0.40 1.15 -2.65 0.00 0.00 178.83 176.81 1n5m h THR 528 N -0.66 1.24 0.00 2.39 2.02 -1.90 -2.22 112.91 113.79 1n5m h THR 528 Ca -0.06 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 1n5m h THR 528 Cb 0.49 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1n5m h THR 528 CO 0.10 0.28 -0.10 0.00 0.37 0.00 0.00 175.52 176.17 1n5m h ALA 530 N 1.90 0.95 0.68 0.00 0.00 -0.69 0.42 119.26 122.51 1n5m h ALA 530 Ca -0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1n5m h ALA 530 Cb 0.56 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.22 1n5m h ALA 530 CO 0.01 0.61 -0.33 0.35 0.00 0.00 0.00 179.25 179.89 1n5m h PHE 531 N 0.54 -0.85 -0.32 0.00 3.57 -1.06 0.50 116.94 119.32 1n5m h PHE 531 Ca 0.07 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1n5m h PHE 531 Cb 0.75 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 1n5m h PHE 531 CO 0.03 -0.52 0.10 -1.49 -2.23 0.00 0.00 178.31 174.21 1n5m h TRP 532 N -0.95 0.52 0.00 0.41 4.06 -1.24 -0.19 115.95 118.55 1n5m h TRP 532 Ca -0.09 -0.05 -0.08 0.00 2.06 0.00 0.00 58.89 60.72 1n5m h TRP 532 Cb 0.71 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.71 1n5m h TRP 532 CO -0.02 0.52 -0.75 -0.91 -3.56 0.00 0.00 178.44 173.72 1n5m h ASN 533 N 0.36 0.00 0.00 -3.49 2.35 -0.22 -3.37 115.58 111.21 1n5m h ASN 533 Ca 0.10 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.73 1n5m h ASN 533 Cb 0.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1n5m h ASN 533 CO -0.00 0.33 -1.43 0.54 -1.65 0.00 0.00 177.43 175.21 1n5m n ARG 534 N -3.00 0.18 -0.07 0.81 1.74 0.11 -4.75 116.66 111.67 1n5m n ARG 534 Ca -0.01 0.06 -0.10 0.00 -0.77 0.00 0.00 57.85 57.02 1n5m n ARG 534 Cb 0.69 -0.98 -0.08 0.00 -1.02 0.00 0.00 32.46 31.07 1n5m n ARG 534 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1n5m h PHE 535 N -0.13 0.00 -0.91 -1.55 3.57 -0.96 -3.28 116.94 113.67 1n5m h PHE 535 Ca -0.18 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.52 1n5m h PHE 535 Cb 1.22 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.85 1n5m h PHE 535 CO -0.01 0.71 0.46 -0.07 -2.23 0.00 0.00 178.31 177.18 1n5m h LEU 536 N -1.00 0.49 -0.76 0.59 3.38 -1.21 -0.47 115.31 116.34 1n5m h LEU 536 Ca -0.04 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1n5m h LEU 536 Cb 0.72 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1n5m h LEU 536 CO -0.03 0.11 0.33 -0.65 0.09 0.00 0.00 178.44 178.29 1n5m h PRO 537 N 0.53 1.12 0.00 1.13 0.11 -1.75 -1.65 132.00 131.49 1n5m h PRO 537 Ca 0.55 -0.19 -0.01 0.00 0.11 0.00 0.00 66.00 66.47 1n5m h PRO 537 Cb 0.96 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 1n5m h PRO 537 CO -0.46 0.89 -0.03 0.87 -0.21 0.00 0.00 178.00 179.06 1n5m h LYS 538 N 1.08 0.00 -1.86 1.05 1.57 -1.17 -1.23 116.57 116.01 1n5m h LYS 538 Ca 0.26 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.95 1n5m h LYS 538 Cb 0.17 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 1n5m h LYS 538 CO -0.03 0.03 0.11 -0.11 -0.57 0.00 0.00 179.45 178.89 1n5m n LEU 539 N -3.24 5.61 -0.07 2.94 7.94 -0.62 -4.13 117.00 125.44 1n5m n LEU 539 Ca -0.01 -2.63 0.12 0.00 -1.11 0.00 0.00 56.01 52.38 1n5m n LEU 539 Cb 0.20 -1.10 0.68 0.00 0.53 0.00 0.00 43.42 43.73 1n5m n LEU 539 CO 0.25 1.06 0.94 0.00 -1.11 0.00 0.00 177.39 178.53 1n5m n LEU 540 N 1.19 0.20 -0.69 -1.96 -0.00 -0.47 -4.97 117.00 110.30 1n5m n LEU 540 Ca 0.08 -0.08 0.09 0.00 -0.00 0.00 0.00 56.01 56.10 1n5m n LEU 540 Cb 0.52 -0.01 0.07 0.00 -0.00 0.00 0.00 43.42 44.01 1n5m n LEU 540 CO 0.10 0.04 0.52 -1.20 -0.00 0.00 0.00 177.39 176.85