#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1up4 s ILE 3 N 0.00 3.42 -0.08 5.15 1.01 -0.55 -0.90 121.20 129.25 1up4 s ILE 3 Ca 0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 60.65 60.05 1up4 s ILE 3 Cb 0.00 -2.50 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 1up4 s ILE 3 CO 0.00 0.48 0.22 0.00 0.00 0.00 0.00 174.94 175.65 1up4 s ALA 4 N 0.70 3.83 -0.23 9.38 0.00 0.11 -0.93 121.76 134.61 1up4 s ALA 4 Ca -0.04 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.42 1up4 s ALA 4 Cb -0.15 -2.09 0.05 0.00 0.00 0.00 0.00 23.12 20.93 1up4 s ALA 4 CO 0.02 0.58 -0.12 0.08 0.00 0.00 0.00 175.76 176.32 1up4 s VAL 5 N -1.06 2.01 -0.32 0.00 1.01 0.58 -0.65 120.40 121.97 1up4 s VAL 5 Ca 0.18 -1.37 -0.14 0.00 0.00 0.00 0.00 61.98 60.66 1up4 s VAL 5 Cb -0.13 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1up4 s VAL 5 CO 0.07 0.11 0.30 -0.63 0.00 0.00 0.00 175.10 174.96 1up4 s ILE 6 N 1.21 5.22 0.00 2.22 -1.09 0.43 -1.39 121.20 127.80 1up4 s ILE 6 Ca -0.05 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.46 1up4 s ILE 6 Cb -0.18 -3.73 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 1up4 s ILE 6 CO -0.07 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.27 1up4 n GLY 7 N 4.97 0.64 0.31 6.18 0.00 0.23 -1.14 105.19 116.38 1up4 n GLY 7 Ca -0.11 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1up4 n GLY 7 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1up4 h GLY 8 N 0.00 0.37 0.64 -0.02 0.00 -1.24 -1.90 103.07 100.92 1up4 h GLY 8 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1up4 h GLY 8 CO 0.00 0.11 0.00 0.61 0.00 0.00 0.00 176.54 177.26 1up4 n GLY 9 N -1.52 -0.64 3.77 4.60 0.00 -1.26 -4.71 105.19 105.43 1up4 n GLY 9 Ca 0.04 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1up4 n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1up4 s SER 10 N -1.77 6.14 0.00 1.61 0.15 -0.72 -4.80 113.70 114.31 1up4 s SER 10 Ca 0.20 2.61 0.13 0.00 0.70 0.00 0.00 55.95 59.58 1up4 s SER 10 Cb 0.09 -2.63 0.67 0.00 -1.71 0.00 0.00 66.02 62.44 1up4 s SER 10 CO 0.15 -0.96 1.28 -1.54 1.20 0.00 0.00 173.24 173.37 1up4 n SER 11 N -0.15 0.00 0.11 5.45 3.41 -1.26 -1.59 113.62 119.60 1up4 n SER 11 Ca 0.05 -0.04 0.12 0.00 -0.26 0.00 0.00 58.87 58.75 1up4 n SER 11 Cb 0.45 -0.21 0.13 0.00 -0.26 0.00 0.00 64.21 64.32 1up4 n SER 11 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1up4 h TYR 12 N 0.00 0.00 -0.69 7.33 0.05 -1.94 -3.41 116.97 118.32 1up4 h TYR 12 Ca 0.00 0.00 0.14 0.00 0.05 0.00 0.00 58.73 58.92 1up4 h TYR 12 Cb 0.08 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 37.70 1up4 h TYR 12 CO 0.00 0.00 -0.14 1.15 -1.05 0.00 0.00 178.16 178.12 1up4 h THR 13 N 0.00 0.33 -0.66 -2.88 2.02 -1.58 -0.59 112.91 109.55 1up4 h THR 13 Ca 0.00 -0.01 0.14 0.00 0.77 0.00 0.00 66.41 67.31 1up4 h THR 13 Cb 0.89 0.31 -0.12 0.00 -1.74 0.00 0.00 68.15 67.49 1up4 h THR 13 CO 0.00 0.00 -0.10 -0.65 0.37 0.00 0.00 175.52 175.15 1up4 h PRO 14 N 0.02 0.04 -0.65 6.66 0.11 -1.82 -0.13 132.00 136.22 1up4 h PRO 14 Ca 0.34 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.41 1up4 h PRO 14 Cb 0.53 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.60 1up4 h PRO 14 CO -0.69 0.03 0.27 0.93 -0.21 0.00 0.00 178.00 178.32 1up4 h GLU 15 N 0.04 0.97 -0.39 1.05 4.39 -1.42 0.11 114.58 119.33 1up4 h GLU 15 Ca 0.33 -0.17 0.06 0.00 0.34 0.00 0.00 59.36 59.92 1up4 h GLU 15 Cb 0.53 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.97 1up4 h GLU 15 CO -0.64 0.81 0.07 1.25 -1.16 0.00 0.00 179.01 179.35 1up4 h LEU 16 N 0.92 -0.00 -0.79 1.33 5.85 -0.91 -0.99 115.31 120.71 1up4 h LEU 16 Ca 0.22 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.96 1up4 h LEU 16 Cb 0.20 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1up4 h LEU 16 CO -0.02 0.03 0.31 0.58 -0.34 0.00 0.00 178.44 179.01 1up4 h VAL 17 N 0.20 1.26 -0.26 1.05 2.07 -0.48 0.94 116.25 121.02 1up4 h VAL 17 Ca 0.19 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.94 1up4 h VAL 17 Cb 0.23 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 1up4 h VAL 17 CO -0.25 0.34 -0.14 0.50 0.02 0.00 0.00 177.57 178.04 1up4 h LYS 18 N 1.15 -0.11 -0.34 1.57 3.64 -0.50 0.13 116.57 122.12 1up4 h LYS 18 Ca 0.26 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1up4 h LYS 18 Cb 0.22 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 1up4 h LYS 18 CO -0.02 -0.07 0.01 0.78 -2.27 0.00 0.00 179.45 177.87 1up4 h GLY 19 N -0.11 0.34 0.99 5.01 0.00 -0.27 -0.33 103.07 108.70 1up4 h GLY 19 Ca 0.14 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.52 1up4 h GLY 19 CO -0.33 -0.07 0.66 1.41 0.00 0.00 0.00 176.54 178.21 1up4 h LEU 20 N 0.10 1.14 -0.38 3.11 3.38 -0.15 -2.33 115.31 120.18 1up4 h LEU 20 Ca 0.16 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1up4 h LEU 20 Cb 0.22 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1up4 h LEU 20 CO -0.27 0.82 0.14 -0.07 0.09 0.00 0.00 178.44 179.16 1up4 h LEU 21 N 1.35 0.53 -1.26 1.67 3.38 -0.17 -1.62 115.31 119.18 1up4 h LEU 21 Ca 0.37 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.19 1up4 h LEU 21 Cb -0.13 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 1up4 h LEU 21 CO -0.09 0.56 0.51 0.44 0.09 0.00 0.00 178.44 179.96 1up4 h ASP 22 N 0.47 0.84 1.09 -0.43 3.32 -0.56 -2.01 116.42 119.15 1up4 h ASP 22 Ca 0.13 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1up4 h ASP 22 Cb 0.20 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1up4 h ASP 22 CO -0.01 0.59 -0.30 2.30 -1.72 0.00 0.00 179.24 180.10 1up4 n ILE 23 N -4.44 0.39 0.57 0.35 -5.35 -0.97 -3.89 119.36 106.01 1up4 n ILE 23 Ca 0.10 -0.23 0.05 0.00 -0.27 0.00 0.00 62.75 62.40 1up4 n ILE 23 Cb 0.09 -0.32 0.29 0.00 -1.74 0.00 0.00 39.64 37.96 1up4 n ILE 23 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1up4 n SER 24 N -2.06 0.00 0.01 7.28 3.41 -0.62 -1.43 113.62 120.21 1up4 n SER 24 Ca 0.05 -0.04 -0.12 0.00 -0.26 0.00 0.00 58.87 58.50 1up4 n SER 24 Cb 0.42 -0.18 -0.14 0.00 -0.26 0.00 0.00 64.21 64.05 1up4 n SER 24 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1up4 h GLU 25 N 0.00 0.09 0.00 4.33 4.57 -1.71 -3.38 114.58 118.47 1up4 h GLU 25 Ca 0.00 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1up4 h GLU 25 Cb 0.06 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1up4 h GLU 25 CO 0.00 0.80 -1.56 -0.25 -1.18 0.00 0.00 179.01 176.82 1up4 n ASP 26 N -3.24 0.35 -3.95 1.04 8.00 -0.52 -4.96 116.55 113.28 1up4 n ASP 26 Ca -0.16 -0.03 -0.12 0.00 0.71 0.00 0.00 54.79 55.19 1up4 n ASP 26 Cb 1.03 1.40 -0.13 0.00 -0.02 0.00 0.00 41.12 43.41 1up4 n ASP 26 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1up4 s VAL 27 N -3.40 0.19 -0.07 2.53 0.11 -0.59 -5.00 120.40 114.16 1up4 s VAL 27 Ca -0.03 -0.52 -0.25 0.00 -2.93 0.00 0.00 61.98 58.24 1up4 s VAL 27 Cb 0.13 -0.25 -0.03 0.00 -1.53 0.00 0.00 36.38 34.70 1up4 s VAL 27 CO 0.86 -0.21 0.79 -0.60 -3.33 0.00 0.00 175.10 172.61 1up4 s ARG 28 N -0.77 4.43 -0.14 1.54 3.52 -1.26 -4.20 118.95 122.07 1up4 s ARG 28 Ca -0.07 1.02 -0.01 0.00 -0.13 0.00 0.00 55.73 56.54 1up4 s ARG 28 Cb -0.05 -3.48 0.04 0.00 -1.56 0.00 0.00 34.95 29.90 1up4 s ARG 28 CO -0.00 -0.04 -0.04 0.42 -0.81 0.00 0.00 175.30 174.83 1up4 s ILE 29 N 1.12 0.86 -0.10 4.11 1.01 -1.26 -4.95 121.20 122.00 1up4 s ILE 29 Ca 0.41 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.69 1up4 s ILE 29 Cb -0.18 -1.03 -0.25 0.00 0.01 0.00 0.00 42.46 41.01 1up4 s ILE 29 CO 0.19 0.18 0.46 0.47 0.00 0.00 0.00 174.94 176.23 1up4 n ASP 30 N 4.97 1.63 -3.66 3.58 8.00 -1.26 -4.69 116.55 125.12 1up4 n ASP 30 Ca -0.11 0.27 -0.13 0.00 0.71 0.00 0.00 54.79 55.54 1up4 n ASP 30 Cb 0.49 -0.53 -0.08 0.00 -0.02 0.00 0.00 41.12 40.98 1up4 n ASP 30 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1up4 s GLU 31 N -2.57 0.73 -0.18 -1.24 -1.05 -1.26 -1.46 118.70 111.67 1up4 s GLU 31 Ca -0.16 0.92 -0.02 0.00 -0.15 0.00 0.00 54.97 55.57 1up4 s GLU 31 Cb 0.07 0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 34.07 1up4 s GLU 31 CO 0.79 -0.10 -0.09 0.08 0.95 0.00 0.00 175.26 176.89 1up4 s VAL 32 N 0.54 3.18 -0.12 1.83 1.01 0.17 -1.48 120.40 125.54 1up4 s VAL 32 Ca -0.02 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 1up4 s VAL 32 Cb -0.05 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1up4 s VAL 32 CO -0.02 0.48 -0.09 -0.51 0.00 0.00 0.00 175.10 174.95 1up4 s ILE 33 N 0.93 3.44 0.04 2.22 2.07 -0.10 -1.08 121.20 128.72 1up4 s ILE 33 Ca -0.02 -0.54 0.04 0.00 -1.41 0.00 0.00 60.65 58.73 1up4 s ILE 33 Cb -0.15 -2.45 -0.04 0.00 0.13 0.00 0.00 42.46 39.95 1up4 s ILE 33 CO -0.00 0.53 -0.05 -0.36 -1.91 0.00 0.00 174.94 173.15 1up4 s PHE 34 N 0.04 2.90 -0.01 3.50 0.08 0.13 -0.31 117.98 124.31 1up4 s PHE 34 Ca -0.03 -0.05 -0.01 0.00 0.12 0.00 0.00 56.93 56.97 1up4 s PHE 34 Cb -0.14 -1.57 0.00 0.00 -0.57 0.00 0.00 43.02 40.75 1up4 s PHE 34 CO 0.04 0.41 0.02 -0.47 -0.10 0.00 0.00 175.22 175.12 1up4 s TYR 35 N -1.11 -0.02 -0.10 0.36 5.04 -0.49 -1.35 117.35 119.68 1up4 s TYR 35 Ca 0.20 0.07 -0.17 0.00 -2.44 0.00 0.00 57.07 54.73 1up4 s TYR 35 Cb -0.11 -0.01 0.04 0.00 0.35 0.00 0.00 41.96 42.23 1up4 s TYR 35 CO 0.11 -0.02 0.42 0.34 -1.34 0.00 0.00 175.55 175.06 1up4 s ASP 36 N 0.08 -0.38 0.10 4.32 -1.08 -1.26 0.74 116.67 119.19 1up4 s ASP 36 Ca -0.01 0.58 0.23 0.00 -0.52 0.00 0.00 52.55 52.83 1up4 s ASP 36 Cb -0.01 0.64 0.90 0.00 -1.46 0.00 0.00 42.92 42.99 1up4 s ASP 36 CO -0.00 -0.31 1.70 2.30 0.52 0.00 0.00 175.17 179.38 1up4 n ILE 37 N 2.06 0.63 -3.63 4.11 -5.35 -1.26 -4.14 119.36 111.77 1up4 n ILE 37 Ca -0.17 0.08 -0.38 0.00 -0.27 0.00 0.00 62.75 62.02 1up4 n ILE 37 Cb 0.57 -0.83 -0.07 0.00 -1.74 0.00 0.00 39.64 37.56 1up4 n ILE 37 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1up4 s ASP 38 N -3.58 5.73 0.33 7.28 -1.08 -1.26 -4.95 116.67 119.14 1up4 s ASP 38 Ca 0.09 -3.17 0.02 0.00 -0.52 0.00 0.00 52.55 48.97 1up4 s ASP 38 Cb 0.12 -1.92 0.61 0.00 -1.46 0.00 0.00 42.92 40.27 1up4 s ASP 38 CO 0.42 -0.32 1.96 -0.33 0.52 0.00 0.00 175.17 177.43 1up4 h GLU 39 N 6.73 0.89 -0.35 4.34 3.07 -2.01 -2.22 114.58 125.03 1up4 h GLU 39 Ca 0.07 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 58.79 1up4 h GLU 39 Cb 0.91 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.61 1up4 h GLU 39 CO 0.77 0.59 -0.10 0.93 -1.40 0.00 0.00 179.01 179.80 1up4 h GLU 40 N 0.92 0.69 -0.09 2.33 3.07 -1.95 -1.32 114.58 118.23 1up4 h GLU 40 Ca 0.31 -0.27 0.03 0.00 -0.50 0.00 0.00 59.36 58.93 1up4 h GLU 40 Cb 0.08 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 27.91 1up4 h GLU 40 CO -0.09 0.86 -0.13 -0.22 -1.40 0.00 0.00 179.01 178.02 1up4 h LYS 41 N 0.48 -0.17 -0.55 2.33 3.64 -1.85 -3.11 116.57 117.34 1up4 h LYS 41 Ca 0.09 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1up4 h LYS 41 Cb 0.61 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 1up4 h LYS 41 CO 0.04 -0.11 0.30 0.37 -2.27 0.00 0.00 179.45 177.77 1up4 h GLN 42 N -0.17 0.77 -0.88 1.90 4.15 -1.28 -2.70 115.11 116.90 1up4 h GLN 42 Ca 0.08 -0.09 0.18 0.00 0.77 0.00 0.00 58.65 59.58 1up4 h GLN 42 Cb 0.28 -0.15 -0.11 0.00 0.21 0.00 0.00 27.48 27.72 1up4 h GLN 42 CO -0.20 0.59 0.44 -0.22 -1.93 0.00 0.00 178.83 177.51 1up4 h LYS 43 N 0.74 0.54 -0.18 1.69 3.64 -1.17 0.45 116.57 122.27 1up4 h LYS 43 Ca 0.19 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1up4 h LYS 43 Cb 0.05 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1up4 h LYS 43 CO -0.03 0.36 -0.04 0.82 -2.27 0.00 0.00 179.45 178.28 1up4 h ILE 44 N 0.56 1.28 -0.14 2.00 5.03 -1.46 -1.24 117.51 123.54 1up4 h ILE 44 Ca 0.50 -1.01 -0.02 0.00 -0.12 0.00 0.00 64.86 64.22 1up4 h ILE 44 Cb 0.81 1.57 -0.01 0.00 -3.03 0.00 0.00 36.82 36.17 1up4 h ILE 44 CO -0.42 0.30 0.01 0.58 -0.68 0.00 0.00 178.15 177.94 1up4 h VAL 45 N 0.07 1.24 -0.23 1.67 2.07 -1.21 -2.71 116.25 117.15 1up4 h VAL 45 Ca 0.05 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.74 1up4 h VAL 45 Cb 0.48 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1up4 h VAL 45 CO 0.02 0.22 -0.12 0.58 0.02 0.00 0.00 177.57 178.29 1up4 h VAL 46 N -0.01 1.21 -0.44 2.57 2.07 -0.16 0.14 116.25 121.63 1up4 h VAL 46 Ca 0.04 -0.91 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 1up4 h VAL 46 Cb 0.33 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1up4 h VAL 46 CO 0.00 0.29 0.10 0.44 0.02 0.00 0.00 177.57 178.42 1up4 h ASP 47 N 0.35 0.62 -0.20 0.57 3.32 -1.15 -1.33 116.42 118.59 1up4 h ASP 47 Ca 0.07 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1up4 h ASP 47 Cb 0.43 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1up4 h ASP 47 CO 0.02 0.62 -0.22 0.15 -1.72 0.00 0.00 179.24 178.10 1up4 h PHE 48 N 0.65 0.61 -0.62 4.55 3.57 -0.92 -3.14 116.94 121.64 1up4 h PHE 48 Ca 0.15 -0.19 0.10 0.00 3.53 0.00 0.00 57.97 61.56 1up4 h PHE 48 Cb 0.26 -0.13 -0.08 0.00 2.79 0.00 0.00 35.95 38.79 1up4 h PHE 48 CO 0.01 0.87 0.20 0.28 -2.23 0.00 0.00 178.31 177.44 1up4 h VAL 49 N 0.18 0.72 -0.68 1.41 2.07 -0.70 -1.84 116.25 117.41 1up4 h VAL 49 Ca 0.03 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1up4 h VAL 49 Cb 0.77 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1up4 h VAL 49 CO 0.05 0.07 0.45 0.11 0.02 0.00 0.00 177.57 178.27 1up4 h LYS 50 N 0.36 0.82 -0.20 1.57 1.57 -1.22 0.15 116.57 119.62 1up4 h LYS 50 Ca 0.32 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.94 1up4 h LYS 50 Cb 0.43 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1up4 h LYS 50 CO -0.35 0.54 -0.34 0.00 -0.57 0.00 0.00 179.45 178.73 1up4 h ARG 51 N 0.85 0.42 0.04 3.15 3.08 -1.30 -2.57 114.38 118.05 1up4 h ARG 51 Ca 0.26 -0.18 -0.20 0.00 0.07 0.00 0.00 59.98 59.93 1up4 h ARG 51 Cb 0.01 -0.01 0.02 0.00 0.08 0.00 0.00 29.97 30.07 1up4 h ARG 51 CO -0.07 0.71 -0.82 -0.07 -1.07 0.00 0.00 179.97 178.65 1up4 h LEU 52 N 0.36 0.64 -0.42 3.04 3.38 -0.85 -3.35 115.31 118.12 1up4 h LEU 52 Ca 0.04 -0.80 -0.03 0.00 0.09 0.00 0.00 57.88 57.18 1up4 h LEU 52 Cb 0.78 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1up4 h LEU 52 CO 0.06 1.37 0.13 0.58 0.09 0.00 0.00 178.44 180.67 1up4 h VAL 53 N -0.00 1.22 -6.14 1.22 2.07 -0.77 -3.48 116.25 110.37 1up4 h VAL 53 Ca -0.12 -0.73 -0.43 0.00 0.82 0.00 0.00 66.70 66.24 1up4 h VAL 53 Cb 1.53 0.90 0.04 0.00 -1.52 0.00 0.00 31.29 32.25 1up4 h VAL 53 CO 0.16 0.26 -0.83 0.29 0.02 0.00 0.00 177.57 177.47 1up4 n LYS 54 N -4.57 -4.79 -1.23 1.57 5.02 -0.97 -2.58 118.16 110.60 1up4 n LYS 54 Ca 0.00 0.60 -0.08 0.00 -2.02 0.00 0.00 58.31 56.81 1up4 n LYS 54 Cb 0.19 -5.13 -0.03 0.00 -0.02 0.00 0.00 35.03 30.03 1up4 n LYS 54 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1up4 n ASP 55 N -3.04 -4.84 0.10 4.39 8.00 -1.26 -4.86 116.55 115.04 1up4 n ASP 55 Ca -0.28 0.20 -0.04 0.00 0.71 0.00 0.00 54.79 55.37 1up4 n ASP 55 Cb 0.67 -3.03 0.13 0.00 -0.02 0.00 0.00 41.12 38.87 1up4 n ASP 55 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1up4 h ARG 56 N 0.14 0.18 -4.51 -1.24 3.08 -1.89 -3.45 114.38 106.69 1up4 h ARG 56 Ca -0.16 -0.13 -0.27 0.00 0.07 0.00 0.00 59.98 59.50 1up4 h ARG 56 Cb 0.81 0.02 -0.14 0.00 0.08 0.00 0.00 29.97 30.75 1up4 h ARG 56 CO 0.24 0.74 -0.51 -0.59 -1.07 0.00 0.00 179.97 178.77 1up4 s PHE 57 N -3.71 1.18 -0.02 3.04 -0.12 -1.26 -4.97 117.98 112.12 1up4 s PHE 57 Ca -0.03 -1.36 -0.25 0.00 -0.05 0.00 0.00 56.93 55.24 1up4 s PHE 57 Cb 0.12 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.99 1up4 s PHE 57 CO 0.79 -0.76 0.76 0.15 -0.05 0.00 0.00 175.22 176.12 1up4 s LYS 58 N -3.94 4.47 -0.26 1.99 3.01 -0.53 -4.93 119.74 119.56 1up4 s LYS 58 Ca 0.37 1.02 -0.08 0.00 -1.01 0.00 0.00 55.97 56.27 1up4 s LYS 58 Cb 0.05 -3.42 -0.03 0.00 -1.01 0.00 0.00 37.83 33.42 1up4 s LYS 58 CO 0.15 0.13 0.11 0.08 0.51 0.00 0.00 175.35 176.33 1up4 s VAL 59 N 0.51 4.59 0.08 3.17 1.01 -1.26 -0.65 120.40 127.85 1up4 s VAL 59 Ca 0.40 -0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.35 1up4 s VAL 59 Cb -0.19 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1up4 s VAL 59 CO 0.21 0.29 -0.20 -0.76 0.00 0.00 0.00 175.10 174.65 1up4 s LEU 60 N 1.65 2.26 -0.09 3.92 1.43 -0.24 -5.00 118.68 122.61 1up4 s LEU 60 Ca 0.06 -0.63 0.02 0.00 -1.03 0.00 0.00 54.13 52.55 1up4 s LEU 60 Cb -0.15 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1up4 s LEU 60 CO 0.06 0.07 -0.12 -0.63 0.23 0.00 0.00 176.35 175.95 1up4 s ILE 61 N -1.07 3.19 -0.07 -0.59 1.01 -1.26 0.21 121.20 122.61 1up4 s ILE 61 Ca 0.06 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1up4 s ILE 61 Cb -0.10 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 1up4 s ILE 61 CO 0.03 0.56 -0.06 -0.55 0.00 0.00 0.00 174.94 174.92 1up4 s SER 62 N -0.31 4.68 0.37 3.58 0.15 -0.46 -4.89 113.70 116.82 1up4 s SER 62 Ca 0.03 -0.02 0.20 0.00 0.70 0.00 0.00 55.95 56.86 1up4 s SER 62 Cb -0.13 -1.22 0.56 0.00 -1.71 0.00 0.00 66.02 63.52 1up4 s SER 62 CO 0.03 0.35 1.67 0.44 1.20 0.00 0.00 173.24 176.93 1up4 h ASP 63 N 5.33 0.00 -2.87 5.45 3.32 -1.96 -3.43 116.42 122.27 1up4 h ASP 63 Ca -0.48 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.05 1up4 h ASP 63 Cb 1.18 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.58 1up4 h ASP 63 CO 0.53 0.34 -0.75 0.42 -1.72 0.00 0.00 179.24 178.05 1up4 s THR 64 N -3.39 2.06 0.09 0.35 -4.23 -1.26 -4.99 115.64 104.25 1up4 s THR 64 Ca 0.02 -2.24 -0.24 0.00 -1.18 0.00 0.00 61.69 58.04 1up4 s THR 64 Cb 0.09 -2.12 -0.15 0.00 1.34 0.00 0.00 72.50 71.66 1up4 s THR 64 CO 0.68 -0.47 1.72 0.15 -0.54 0.00 0.00 174.62 176.17 1up4 h PHE 65 N 2.56 -0.08 -0.54 3.99 3.57 -1.99 -2.99 116.94 121.46 1up4 h PHE 65 Ca -0.40 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.18 1up4 h PHE 65 Cb 1.23 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.93 1up4 h PHE 65 CO 0.75 -0.04 0.18 1.49 -2.23 0.00 0.00 178.31 178.45 1up4 h GLU 66 N -0.10 0.33 -0.60 1.11 4.81 -1.97 -0.68 114.58 117.48 1up4 h GLU 66 Ca -0.01 -0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.36 1up4 h GLU 66 Cb 0.08 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1up4 h GLU 66 CO 0.01 0.22 0.42 0.78 -0.73 0.00 0.00 179.01 179.72 1up4 h GLY 67 N 0.34 0.19 0.54 1.92 0.00 -1.96 -0.25 103.07 103.86 1up4 h GLY 67 Ca 0.27 -0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.45 1up4 h GLY 67 CO -0.29 0.02 -0.41 0.00 0.00 0.00 0.00 176.54 175.86 1up4 h ALA 68 N 1.70 0.02 0.00 3.60 0.00 -1.00 -3.37 119.26 120.22 1up4 h ALA 68 Ca 0.29 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1up4 h ALA 68 Cb 0.99 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1up4 h ALA 68 CO -0.03 0.20 -0.67 -0.39 0.00 0.00 0.00 179.25 178.35 1up4 h VAL 69 N -0.41 0.00 -0.95 0.00 -1.51 -1.00 -3.41 116.25 108.98 1up4 h VAL 69 Ca -0.06 -0.58 0.08 0.00 -1.23 0.00 0.00 66.70 64.91 1up4 h VAL 69 Cb 1.19 1.16 -0.07 0.00 -2.13 0.00 0.00 31.29 31.43 1up4 h VAL 69 CO 0.08 0.00 0.59 1.62 -1.23 0.00 0.00 177.57 178.63 1up4 h VAL 70 N 0.00 1.01 -0.23 7.19 3.04 -1.21 -2.19 116.25 123.86 1up4 h VAL 70 Ca 0.00 -0.35 -0.08 0.00 -1.01 0.00 0.00 66.70 65.26 1up4 h VAL 70 Cb 0.79 -0.11 -0.05 0.00 -2.01 0.00 0.00 31.29 29.91 1up4 h VAL 70 CO 0.00 0.19 -0.10 0.47 -1.01 0.00 0.00 177.57 177.11 1up4 n ASP 71 N -4.59 2.71 -4.84 3.17 8.00 -1.26 -3.85 116.55 115.89 1up4 n ASP 71 Ca 0.15 -3.49 -0.37 0.00 0.71 0.00 0.00 54.79 51.80 1up4 n ASP 71 Cb 0.24 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 40.72 1up4 n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up4 s ALA 72 N -3.08 3.65 -0.03 2.24 0.00 -0.82 -4.44 121.76 119.28 1up4 s ALA 72 Ca 0.41 -0.18 0.12 0.00 0.00 0.00 0.00 51.96 52.31 1up4 s ALA 72 Cb 0.37 -2.45 -0.23 0.00 0.00 0.00 0.00 23.12 20.81 1up4 s ALA 72 CO 0.02 0.48 0.72 -0.22 0.00 0.00 0.00 175.76 176.75 1up4 h LYS 73 N 4.11 0.00 -4.98 0.00 3.64 -1.35 -3.39 116.57 114.61 1up4 h LYS 73 Ca -0.50 -0.00 -0.45 0.00 -1.27 0.00 0.00 60.65 58.43 1up4 h LYS 73 Cb 1.20 0.00 -0.29 0.00 -0.41 0.00 0.00 32.23 32.73 1up4 h LYS 73 CO 0.64 0.55 -0.80 0.71 -2.27 0.00 0.00 179.45 178.28 1up4 s TYR 74 N -2.61 1.07 -0.12 1.91 2.02 -1.22 -1.75 117.35 116.65 1up4 s TYR 74 Ca -0.04 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.45 1up4 s TYR 74 Cb 0.08 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.95 1up4 s TYR 74 CO 0.82 -0.04 -0.14 0.08 -1.57 0.00 0.00 175.55 174.70 1up4 s VAL 75 N -0.18 1.49 -0.29 0.71 1.01 -0.05 -0.71 120.40 122.37 1up4 s VAL 75 Ca 0.03 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 1up4 s VAL 75 Cb -0.06 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1up4 s VAL 75 CO -0.00 0.44 0.17 -0.63 0.00 0.00 0.00 175.10 175.08 1up4 s ILE 76 N 1.23 5.05 -0.29 2.22 1.01 0.18 -0.45 121.20 130.15 1up4 s ILE 76 Ca -0.01 -0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.38 1up4 s ILE 76 Cb -0.14 -3.45 -0.00 0.00 0.01 0.00 0.00 42.46 38.87 1up4 s ILE 76 CO -0.06 0.20 0.78 -0.36 0.00 0.00 0.00 174.94 175.50 1up4 s PHE 77 N 1.71 3.23 -0.05 3.97 0.40 -0.32 -0.43 117.98 126.48 1up4 s PHE 77 Ca 0.06 0.86 0.23 0.00 -0.60 0.00 0.00 56.93 57.49 1up4 s PHE 77 Cb -0.16 -3.15 0.41 0.00 0.51 0.00 0.00 43.02 40.63 1up4 s PHE 77 CO 0.09 -0.51 1.15 0.00 0.70 0.00 0.00 175.22 176.65 1up4 n GLN 78 N 6.12 0.32 -3.72 0.44 10.64 -0.29 -0.32 117.38 130.57 1up4 n GLN 78 Ca 0.03 -2.17 -0.21 0.00 -1.83 0.00 0.00 57.00 52.82 1up4 n GLN 78 Cb 0.48 -0.23 -0.01 0.00 -0.86 0.00 0.00 30.24 29.62 1up4 n GLN 78 CO 0.00 0.00 0.00 -0.59 -1.83 0.00 0.00 177.06 174.64 1up4 s PHE 79 N -0.65 3.40 -0.45 2.61 -0.71 -1.17 -4.72 117.98 116.28 1up4 s PHE 79 Ca 0.30 0.04 0.03 0.00 -1.04 0.00 0.00 56.93 56.26 1up4 s PHE 79 Cb 0.35 -1.74 0.12 0.00 -1.21 0.00 0.00 43.02 40.54 1up4 s PHE 79 CO -0.13 0.26 0.20 0.50 -1.34 0.00 0.00 175.22 174.71 1up4 s ARG 80 N -4.11 1.62 0.03 1.99 3.52 -1.26 -4.54 118.95 116.20 1up4 s ARG 80 Ca 0.38 -2.22 -0.32 0.00 -0.13 0.00 0.00 55.73 53.43 1up4 s ARG 80 Cb -0.09 -2.96 -0.11 0.00 -1.56 0.00 0.00 34.95 30.23 1up4 s ARG 80 CO 0.31 -1.08 1.84 -2.30 -0.81 0.00 0.00 175.30 173.26 1up4 n PRO 81 N 3.56 2.49 -0.32 5.12 -0.02 -1.26 -0.66 135.00 143.90 1up4 n PRO 81 Ca 0.05 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1up4 n PRO 81 Cb 0.35 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.05 1up4 n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1up4 n GLY 82 N 4.24 1.31 7.00 -1.23 0.00 -1.26 -4.85 105.19 110.40 1up4 n GLY 82 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1up4 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1up4 n GLY 83 N -2.00 0.90 0.13 -0.02 0.00 0.17 -1.61 105.19 102.76 1up4 n GLY 83 Ca 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.19 1up4 n GLY 83 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1up4 h LEU 84 N 0.00 0.00 -1.32 0.99 3.38 -1.93 -2.29 115.31 114.14 1up4 h LEU 84 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1up4 h LEU 84 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1up4 h LEU 84 CO 0.00 0.66 0.48 0.50 0.09 0.00 0.00 178.44 180.17 1up4 h LYS 85 N 0.00 0.87 -0.07 1.13 3.64 -1.96 0.72 116.57 120.90 1up4 h LYS 85 Ca -0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1up4 h LYS 85 Cb 1.25 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1up4 h LYS 85 CO 0.09 0.57 0.02 0.78 -2.27 0.00 0.00 179.45 178.64 1up4 h GLY 86 N 0.89 0.11 0.51 5.01 0.00 -0.75 -1.90 103.07 106.95 1up4 h GLY 86 Ca 0.29 -0.06 0.12 0.00 0.00 0.00 0.00 47.33 47.68 1up4 h GLY 86 CO -0.08 0.06 0.62 -0.09 0.00 0.00 0.00 176.54 177.04 1up4 h ARG 87 N -0.07 0.90 -0.56 4.80 2.43 -1.07 -0.78 114.38 120.04 1up4 h ARG 87 Ca 0.02 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 1up4 h ARG 87 Cb 0.19 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1up4 h ARG 87 CO -0.00 0.60 0.17 1.49 -1.51 0.00 0.00 179.97 180.71 1up4 h GLU 88 N 0.93 0.88 -0.36 0.20 4.81 -0.54 -1.21 114.58 119.28 1up4 h GLU 88 Ca 0.48 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 1up4 h GLU 88 Cb 0.52 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1up4 h GLU 88 CO -0.24 0.80 0.20 -0.91 -0.73 0.00 0.00 179.01 178.13 1up4 h ASN 89 N 0.79 0.45 -0.64 1.04 2.35 -0.88 0.13 115.58 118.82 1up4 h ASN 89 Ca 0.18 -0.08 0.10 0.00 -0.55 0.00 0.00 56.30 55.95 1up4 h ASN 89 Cb 0.29 -0.11 -0.07 0.00 0.05 0.00 0.00 38.32 38.48 1up4 h ASN 89 CO -0.00 0.40 0.25 0.44 -1.65 0.00 0.00 177.43 176.87 1up4 h ASP 90 N 0.46 0.27 0.42 5.81 3.32 -0.87 -0.25 116.42 125.57 1up4 h ASP 90 Ca 0.13 0.08 -0.26 0.00 0.02 0.00 0.00 57.03 56.99 1up4 h ASP 90 Cb 0.05 0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.66 1up4 h ASP 90 CO -0.02 0.15 -1.14 -0.33 -1.72 0.00 0.00 179.24 176.18 1up4 h GLU 91 N 0.44 0.40 0.14 3.56 5.08 -1.10 -3.37 114.58 119.73 1up4 h GLU 91 Ca 0.32 -0.54 -0.23 0.00 -1.00 0.00 0.00 59.36 57.92 1up4 h GLU 91 Cb 0.40 0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.84 1up4 h GLU 91 CO -0.31 1.21 -1.07 0.78 -1.00 0.00 0.00 179.01 178.62 1up4 h GLY 92 N 1.17 0.34 0.94 -3.84 0.00 -0.39 -3.39 103.07 97.90 1up4 h GLY 92 Ca -0.13 -0.86 -0.01 0.00 0.00 0.00 0.00 47.33 46.33 1up4 h GLY 92 CO 0.20 0.75 0.14 -2.22 0.00 0.00 0.00 176.54 175.41 1up4 h ILE 93 N -0.32 1.14 0.00 2.60 2.04 -1.25 -2.90 117.51 118.82 1up4 h ILE 93 Ca -0.21 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1up4 h ILE 93 Cb 1.72 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1up4 h ILE 93 CO 0.12 0.15 -0.07 -0.65 0.00 0.00 0.00 178.15 177.70 1up4 h PRO 94 N 0.34 0.00 -1.00 2.37 0.11 -1.77 -3.07 132.00 128.98 1up4 h PRO 94 Ca 0.10 0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.34 1up4 h PRO 94 Cb 0.10 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.12 1up4 h PRO 94 CO -0.01 0.07 0.62 -0.07 -0.21 0.00 0.00 178.00 178.40 1up4 h LEU 95 N 0.00 0.89 -1.66 2.35 4.07 -1.54 -1.54 115.31 117.89 1up4 h LEU 95 Ca -0.00 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1up4 h LEU 95 Cb 0.15 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.77 1up4 h LEU 95 CO 0.01 0.44 0.00 0.11 -1.08 0.00 0.00 178.44 177.92 1up4 h LYS 96 N 0.94 0.00 -0.38 1.13 1.57 -1.70 -1.62 116.57 116.51 1up4 h LYS 96 Ca 0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 1up4 h LYS 96 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1up4 h LYS 96 CO -0.29 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.25 1up4 n TYR 97 N -2.59 0.50 -1.67 -1.35 4.01 -0.61 -4.93 117.16 110.52 1up4 n TYR 97 Ca -0.01 -0.29 -0.05 0.00 -0.16 0.00 0.00 57.90 57.40 1up4 n TYR 97 Cb 0.13 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.15 1up4 n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1up4 n GLY 98 N 1.30 0.44 3.73 2.72 0.00 -0.61 -5.03 105.19 107.74 1up4 n GLY 98 Ca 0.18 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1up4 n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up4 s LEU 99 N -1.33 3.61 0.10 0.99 1.02 -1.02 -5.03 118.68 117.03 1up4 s LEU 99 Ca 0.00 -0.11 -0.31 0.00 0.02 0.00 0.00 54.13 53.73 1up4 s LEU 99 Cb 0.00 -2.32 -0.09 0.00 0.02 0.00 0.00 46.19 43.80 1up4 s LEU 99 CO 0.00 0.17 1.70 -0.63 0.02 0.00 0.00 176.35 177.60 1up4 s ILE 100 N -1.38 2.82 -0.38 -0.59 -1.09 -1.26 -3.46 121.20 115.87 1up4 s ILE 100 Ca 0.27 0.34 -0.11 0.00 -2.23 0.00 0.00 60.65 58.93 1up4 s ILE 100 Cb -0.12 -3.22 0.03 0.00 -1.58 0.00 0.00 42.46 37.57 1up4 s ILE 100 CO 0.20 0.00 0.21 -0.83 -1.23 0.00 0.00 174.94 173.30 1up4 s GLY 101 N 2.32 1.93 -0.06 6.18 0.00 -1.26 -4.38 107.32 112.06 1up4 s GLY 101 Ca 0.75 -1.74 -0.08 0.00 0.00 0.00 0.00 44.72 43.65 1up4 s GLY 101 CO 0.33 0.85 0.21 1.62 0.00 0.00 0.00 173.10 176.12 1up4 s GLN 102 N 1.55 0.35 0.32 2.90 -0.44 -1.26 -4.72 119.66 118.37 1up4 s GLN 102 Ca 0.02 0.10 0.09 0.00 -2.50 0.00 0.00 55.36 53.06 1up4 s GLN 102 Cb -0.19 0.16 0.94 0.00 -1.64 0.00 0.00 33.01 32.28 1up4 s GLN 102 CO 0.07 -0.07 1.60 1.49 0.50 0.00 0.00 175.29 178.88 1up4 h GLU 103 N 5.25 0.09 0.00 1.67 4.81 -1.88 -3.24 114.58 121.28 1up4 h GLU 103 Ca -0.27 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1up4 h GLU 103 Cb 1.19 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1up4 h GLU 103 CO 0.38 0.06 0.00 0.25 -0.73 0.00 0.00 179.01 178.97 1up4 n THR 104 N -5.31 0.00 -5.07 0.32 -2.24 -1.26 -3.90 114.28 96.81 1up4 n THR 104 Ca 0.28 -0.26 -0.30 0.00 -2.27 0.00 0.00 64.05 61.49 1up4 n THR 104 Cb 0.91 1.33 -0.17 0.00 -2.10 0.00 0.00 70.33 70.30 1up4 n THR 104 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1up4 s THR 105 N -0.16 1.86 0.00 4.28 2.01 -1.22 -4.38 115.64 118.03 1up4 s THR 105 Ca 0.00 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.10 1up4 s THR 105 Cb 0.00 -1.62 0.00 0.00 0.01 0.00 0.00 72.50 70.89 1up4 s THR 105 CO 0.00 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 1up4 n GLY 106 N 3.59 -0.36 0.38 4.40 0.00 -1.26 -3.85 105.19 108.10 1up4 n GLY 106 Ca -0.20 -1.07 0.17 0.00 0.00 0.00 0.00 46.02 44.92 1up4 n GLY 106 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1up4 h VAL 107 N 0.00 0.77 -0.71 1.61 2.07 -1.80 0.52 116.25 118.72 1up4 h VAL 107 Ca 0.00 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1up4 h VAL 107 Cb 0.00 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 1up4 h VAL 107 CO 0.00 0.06 0.46 1.23 0.02 0.00 0.00 177.57 179.34 1up4 h GLY 108 N 0.33 1.00 1.84 2.17 0.00 -1.69 -2.38 103.07 104.33 1up4 h GLY 108 Ca 0.35 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 47.21 1up4 h GLY 108 CO -0.10 0.38 -0.34 -1.33 0.00 0.00 0.00 176.54 175.16 1up4 h GLY 109 N 0.96 0.21 0.87 4.60 0.00 -0.95 -2.16 103.07 106.59 1up4 h GLY 109 Ca 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 1up4 h GLY 109 CO -0.05 0.16 -0.26 -2.75 0.00 0.00 0.00 176.54 173.64 1up4 h PHE 110 N 0.17 -0.67 -0.37 5.60 3.57 -1.08 0.15 116.94 124.31 1up4 h PHE 110 Ca 0.02 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 1up4 h PHE 110 Cb 0.68 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 1up4 h PHE 110 CO 0.01 -0.39 -0.19 0.66 -2.23 0.00 0.00 178.31 176.17 1up4 h SER 111 N -0.64 0.71 -0.74 0.41 4.64 -1.41 -1.38 113.55 115.15 1up4 h SER 111 Ca -0.04 -0.23 0.04 0.00 -0.47 0.00 0.00 61.79 61.09 1up4 h SER 111 Cb 0.53 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 62.37 1up4 h SER 111 CO 0.04 0.89 0.45 0.00 -0.87 0.00 0.00 176.83 177.34 1up4 h ALA 112 N 1.17 0.99 -0.23 5.18 0.00 -1.23 -1.93 119.26 123.20 1up4 h ALA 112 Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1up4 h ALA 112 Cb 0.66 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1up4 h ALA 112 CO 0.05 0.20 0.09 0.00 0.00 0.00 0.00 179.25 179.59 1up4 h ALA 113 N 1.34 0.30 -0.23 0.00 0.00 -0.10 -2.04 119.26 118.53 1up4 h ALA 113 Ca 0.31 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1up4 h ALA 113 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1up4 h ALA 113 CO -0.14 -0.10 0.08 -0.07 0.00 0.00 0.00 179.25 179.02 1up4 h LEU 114 N 0.22 0.29 -0.95 0.00 3.38 -1.05 -0.35 115.31 116.85 1up4 h LEU 114 Ca 0.08 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1up4 h LEU 114 Cb 0.19 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1up4 h LEU 114 CO -0.01 0.28 -0.49 0.03 0.09 0.00 0.00 178.44 178.35 1up4 h ARG 115 N 0.32 0.00 0.11 1.13 3.08 -1.01 -3.35 114.38 114.67 1up4 h ARG 115 Ca 0.08 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.91 1up4 h ARG 115 Cb 0.10 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.15 1up4 h ARG 115 CO -0.01 0.49 -1.07 0.00 -1.07 0.00 0.00 179.97 178.31 1up4 h ALA 116 N 1.51 0.06 -0.60 0.04 0.00 -0.39 -3.40 119.26 116.49 1up4 h ALA 116 Ca -0.00 -0.89 0.12 0.00 0.00 0.00 0.00 54.91 54.14 1up4 h ALA 116 Cb 0.93 0.30 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 1up4 h ALA 116 CO 0.06 0.58 -0.05 0.74 0.00 0.00 0.00 179.25 180.58 1up4 h PHE 117 N -0.41 -0.13 -0.45 0.00 0.04 -1.42 -0.10 116.94 114.47 1up4 h PHE 117 Ca -0.22 0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.64 1up4 h PHE 117 Cb 1.64 0.15 -0.04 0.00 2.20 0.00 0.00 35.95 39.90 1up4 h PHE 117 CO 0.16 -0.19 0.20 -1.35 -0.60 0.00 0.00 178.31 176.53 1up4 h PRO 118 N 0.07 0.38 -0.18 1.51 0.11 -1.78 0.20 132.00 132.33 1up4 h PRO 118 Ca 0.30 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.36 1up4 h PRO 118 Cb 0.48 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1up4 h PRO 118 CO -0.55 0.25 -0.01 0.82 -0.21 0.00 0.00 178.00 178.31 1up4 h ILE 119 N 0.39 1.26 -0.10 4.15 2.04 -1.47 -2.35 117.51 121.44 1up4 h ILE 119 Ca 0.20 -0.89 -0.09 0.00 1.00 0.00 0.00 64.86 65.09 1up4 h ILE 119 Cb 0.15 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1up4 h ILE 119 CO -0.17 0.27 -0.34 -0.37 0.00 0.00 0.00 178.15 177.54 1up4 h VAL 120 N 0.07 1.27 -0.06 1.67 -1.51 -0.84 -0.74 116.25 116.11 1up4 h VAL 120 Ca 0.05 -1.31 0.01 0.00 -1.23 0.00 0.00 66.70 64.23 1up4 h VAL 120 Cb 0.40 1.58 -0.01 0.00 -2.13 0.00 0.00 31.29 31.13 1up4 h VAL 120 CO 0.01 0.39 -0.02 -0.08 -1.23 0.00 0.00 177.57 176.64 1up4 h GLU 121 N 0.17 -0.01 -0.21 5.19 4.81 -0.84 0.26 114.58 123.95 1up4 h GLU 121 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1up4 h GLU 121 Cb 0.68 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 1up4 h GLU 121 CO 0.05 -0.01 0.14 1.49 -0.73 0.00 0.00 179.01 179.95 1up4 h GLU 122 N -0.01 0.28 -0.34 1.92 4.81 -1.16 -1.59 114.58 118.49 1up4 h GLU 122 Ca 0.03 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1up4 h GLU 122 Cb 0.06 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1up4 h GLU 122 CO -0.07 0.19 -0.10 1.88 -0.73 0.00 0.00 179.01 180.18 1up4 h TYR 123 N 0.29 0.76 -0.56 0.92 -1.99 -0.91 -1.98 116.97 113.49 1up4 h TYR 123 Ca 0.08 -0.17 -0.04 0.00 2.00 0.00 0.00 58.73 60.60 1up4 h TYR 123 Cb -0.03 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 38.49 1up4 h TYR 123 CO -0.06 0.84 0.18 0.28 -0.00 0.00 0.00 178.16 179.40 1up4 h VAL 124 N 0.46 1.24 -0.51 -2.88 2.07 -0.45 -1.54 116.25 114.62 1up4 h VAL 124 Ca 0.09 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 66.83 1up4 h VAL 124 Cb 0.60 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1up4 h VAL 124 CO 0.04 0.30 0.32 -0.78 0.02 0.00 0.00 177.57 177.46 1up4 h ASP 125 N 0.78 0.52 -0.60 0.57 3.58 -1.11 -0.48 116.42 119.68 1up4 h ASP 125 Ca 0.18 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 1up4 h ASP 125 Cb 0.28 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 1up4 h ASP 125 CO -0.01 0.37 0.08 0.74 -2.88 0.00 0.00 179.24 177.55 1up4 h THR 126 N 0.63 1.26 -0.59 2.25 2.02 -1.16 -1.53 112.91 115.80 1up4 h THR 126 Ca 0.20 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.35 1up4 h THR 126 Cb -0.01 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1up4 h THR 126 CO -0.08 0.37 0.30 0.58 0.37 0.00 0.00 175.52 177.07 1up4 h VAL 127 N 0.90 1.20 -0.04 3.16 2.07 -0.91 -2.54 116.25 120.09 1up4 h VAL 127 Ca 0.18 -0.54 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 1up4 h VAL 127 Cb 0.44 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1up4 h VAL 127 CO 0.01 0.22 -0.31 -0.09 0.02 0.00 0.00 177.57 177.43 1up4 h ARG 128 N 0.79 0.07 -0.01 1.57 2.43 -0.87 -0.70 114.38 117.67 1up4 h ARG 128 Ca 0.20 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1up4 h ARG 128 Cb 0.08 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1up4 h ARG 128 CO -0.03 0.38 -0.08 1.63 -1.51 0.00 0.00 179.97 180.36 1up4 n LYS 129 N -4.15 1.19 0.00 0.20 5.02 -0.60 -4.56 118.16 115.26 1up4 n LYS 129 Ca -0.02 -0.58 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1up4 n LYS 129 Cb 0.37 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1up4 n LYS 129 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1up4 n THR 130 N -0.40 0.00 0.22 -0.18 -2.24 -0.91 -4.98 114.28 105.78 1up4 n THR 130 Ca 0.17 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 1up4 n THR 130 Cb 0.30 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.70 1up4 n THR 130 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1up4 h SER 131 N 0.00 0.00 -6.60 3.42 4.64 -1.58 -3.47 113.55 109.96 1up4 h SER 131 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1up4 h SER 131 Cb 0.00 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 61.94 1up4 h SER 131 CO 0.00 0.01 -0.82 -3.20 -0.87 0.00 0.00 176.83 171.95 1up4 n ASN 132 N -3.09 -3.35 -4.77 4.97 2.85 -0.32 -4.94 115.26 106.62 1up4 n ASN 132 Ca 0.04 -0.95 -0.31 0.00 -0.11 0.00 0.00 54.58 53.25 1up4 n ASN 132 Cb 0.53 -3.09 0.09 0.00 1.24 0.00 0.00 39.78 38.55 1up4 n ASN 132 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1up4 s ALA 133 N -3.37 2.19 0.01 5.20 0.00 -1.26 -5.00 121.76 119.54 1up4 s ALA 133 Ca 0.63 0.21 -0.30 0.00 0.00 0.00 0.00 51.96 52.50 1up4 s ALA 133 Cb -0.34 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 1up4 s ALA 133 CO 0.90 -1.81 1.13 0.99 0.00 0.00 0.00 175.76 176.97 1up4 s THR 134 N -2.92 4.35 -0.27 0.00 2.01 -0.72 -4.88 115.64 113.21 1up4 s THR 134 Ca 0.61 1.68 -0.11 0.00 0.31 0.00 0.00 61.69 64.18 1up4 s THR 134 Cb -0.17 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.22 1up4 s THR 134 CO 0.56 0.10 0.21 -0.63 -0.69 0.00 0.00 174.62 174.17 1up4 s ILE 135 N 1.31 5.30 -0.26 1.82 1.01 -0.37 -0.87 121.20 129.14 1up4 s ILE 135 Ca 0.56 0.24 -0.09 0.00 0.00 0.00 0.00 60.65 61.35 1up4 s ILE 135 Cb -0.26 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1up4 s ILE 135 CO 0.27 0.27 0.12 -0.69 0.00 0.00 0.00 174.94 174.90 1up4 s VAL 136 N 1.59 4.76 -0.16 2.92 1.01 0.40 -0.50 120.40 130.43 1up4 s VAL 136 Ca 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 1up4 s VAL 136 Cb -0.15 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 1up4 s VAL 136 CO 0.09 0.31 -0.02 0.21 0.00 0.00 0.00 175.10 175.69 1up4 s ASN 137 N 1.56 4.91 -0.06 3.32 2.47 0.01 -1.18 114.94 125.97 1up4 s ASN 137 Ca 0.06 -0.10 0.10 0.00 0.42 0.00 0.00 52.86 53.35 1up4 s ASN 137 Cb -0.15 -1.80 -0.14 0.00 -1.45 0.00 0.00 41.25 37.71 1up4 s ASN 137 CO 0.06 0.18 0.13 0.49 -3.72 0.00 0.00 177.10 174.24 1up4 n PHE 138 N 3.49 0.00 -1.60 0.43 3.72 0.56 -1.08 117.46 122.98 1up4 n PHE 138 Ca -0.17 0.00 -0.55 0.00 -0.05 0.00 0.00 57.45 56.67 1up4 n PHE 138 Cb 0.52 -0.37 -0.07 0.00 -0.94 0.00 0.00 39.48 38.62 1up4 n PHE 138 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1up4 n THR 139 N -2.13 0.05 -3.43 4.37 -1.04 -1.14 -4.60 114.28 106.35 1up4 n THR 139 Ca -0.09 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.59 1up4 n THR 139 Cb 0.57 -0.69 -0.05 0.00 -1.82 0.00 0.00 70.33 68.33 1up4 n THR 139 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1up4 s ASN 140 N 1.05 6.62 -0.36 8.00 0.01 -1.26 -2.59 114.94 126.41 1up4 s ASN 140 Ca 0.89 0.90 -0.29 0.00 -0.71 0.00 0.00 52.86 53.65 1up4 s ASN 140 Cb -1.08 -2.22 0.01 0.00 0.41 0.00 0.00 41.25 38.38 1up4 s ASN 140 CO 0.54 -0.06 1.19 -2.84 -1.51 0.00 0.00 177.10 174.43 1up4 s PRO 141 N -2.78 3.90 0.10 -0.60 0.02 -1.26 -4.76 135.00 129.62 1up4 s PRO 141 Ca 0.47 1.01 -0.24 0.00 0.02 0.00 0.00 61.00 62.26 1up4 s PRO 141 Cb -0.11 -3.85 -0.10 0.00 0.02 0.00 0.00 34.50 30.46 1up4 s PRO 141 CO 0.21 -1.14 1.70 1.03 -0.33 0.00 0.00 177.00 178.48 1up4 h SER 142 N 8.96 -0.25 -0.31 2.53 0.87 -1.75 -0.33 113.55 123.27 1up4 h SER 142 Ca -0.23 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.33 1up4 h SER 142 Cb 1.08 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 1up4 h SER 142 CO 1.06 -0.13 0.08 1.23 -0.53 0.00 0.00 176.83 178.53 1up4 h GLY 143 N -0.16 0.53 0.89 5.77 0.00 -1.89 -0.96 103.07 107.24 1up4 h GLY 143 Ca 0.03 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.05 1up4 h GLY 143 CO -0.08 0.31 0.28 0.84 0.00 0.00 0.00 176.54 177.89 1up4 h HIS 144 N 0.33 0.52 -0.88 5.60 6.17 -1.89 0.65 115.15 125.64 1up4 h HIS 144 Ca 0.10 0.02 -0.00 0.00 0.71 0.00 0.00 60.37 61.19 1up4 h HIS 144 Cb 0.29 -0.17 -0.04 0.00 2.52 0.00 0.00 27.41 30.01 1up4 h HIS 144 CO 0.01 0.30 0.55 0.82 0.71 0.00 0.00 177.93 180.33 1up4 h ILE 145 N 0.56 1.24 -0.54 6.26 2.04 -0.95 -1.80 117.51 124.31 1up4 h ILE 145 Ca 0.19 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 1up4 h ILE 145 Cb 0.02 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.04 1up4 h ILE 145 CO -0.09 0.24 0.33 0.74 0.00 0.00 0.00 178.15 179.37 1up4 h THR 146 N 1.21 1.16 -0.66 -0.27 2.02 -0.11 0.32 112.91 116.58 1up4 h THR 146 Ca 0.32 -0.37 0.13 0.00 0.77 0.00 0.00 66.41 67.25 1up4 h THR 146 Cb -0.08 0.43 -0.09 0.00 -1.74 0.00 0.00 68.15 66.67 1up4 h THR 146 CO -0.06 0.17 0.16 -0.08 0.37 0.00 0.00 175.52 176.08 1up4 h GLU 147 N 0.73 0.28 0.31 6.66 4.57 -0.61 0.61 114.58 127.13 1up4 h GLU 147 Ca 0.19 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 1up4 h GLU 147 Cb -0.01 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1up4 h GLU 147 CO -0.04 0.18 -0.15 0.35 -1.18 0.00 0.00 179.01 178.18 1up4 h PHE 148 N 0.29 -0.38 -0.38 0.92 3.57 -0.40 -1.16 116.94 119.40 1up4 h PHE 148 Ca 0.35 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.80 1up4 h PHE 148 Cb 0.55 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1up4 h PHE 148 CO -0.24 -0.16 0.06 0.28 -2.23 0.00 0.00 178.31 176.02 1up4 h VAL 149 N -0.54 1.24 -0.36 1.41 2.07 -0.79 -1.09 116.25 118.20 1up4 h VAL 149 Ca -0.04 -0.86 -0.15 0.00 0.82 0.00 0.00 66.70 66.47 1up4 h VAL 149 Cb 0.40 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1up4 h VAL 149 CO 0.07 0.29 -0.35 0.03 0.02 0.00 0.00 177.57 177.63 1up4 h ARG 150 N 0.47 0.88 0.00 1.57 2.47 -0.87 0.37 114.38 119.27 1up4 h ARG 150 Ca 0.12 -0.46 0.00 0.00 -1.26 0.00 0.00 59.98 58.37 1up4 h ARG 150 Cb 0.37 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1up4 h ARG 150 CO 0.01 1.11 -0.93 0.09 0.56 0.00 0.00 179.97 180.80 1up4 n ASN 151 N -4.12 0.84 0.00 7.04 3.02 -0.44 -3.93 115.26 117.67 1up4 n ASN 151 Ca -0.03 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 1up4 n ASN 151 Cb 0.52 1.13 0.00 0.00 -0.61 0.00 0.00 39.78 40.83 1up4 n ASN 151 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1up4 n TYR 152 N -1.50 0.00 0.19 3.10 4.02 -0.49 -4.68 117.16 117.80 1up4 n TYR 152 Ca 0.02 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 58.01 1up4 n TYR 152 Cb 0.28 0.02 0.12 0.00 -0.02 0.00 0.00 39.34 39.74 1up4 n TYR 152 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1up4 h LEU 153 N 0.00 0.00 -1.54 7.72 3.38 -1.25 -3.48 115.31 120.14 1up4 h LEU 153 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1up4 h LEU 153 Cb 0.92 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.81 1up4 h LEU 153 CO 0.00 0.12 -0.77 1.21 0.09 0.00 0.00 178.44 179.09 1up4 n GLU 154 N -3.08 -6.51 -3.72 1.13 2.13 0.12 -4.98 120.64 105.74 1up4 n GLU 154 Ca 0.03 0.80 -0.38 0.00 0.66 0.00 0.00 57.16 58.27 1up4 n GLU 154 Cb 0.58 -5.75 -0.12 0.00 0.27 0.00 0.00 31.44 26.42 1up4 n GLU 154 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1up4 s TYR 155 N -3.40 3.18 0.17 4.31 5.04 -0.83 -5.01 117.35 120.81 1up4 s TYR 155 Ca 0.10 -0.97 -0.09 0.00 -2.44 0.00 0.00 57.07 53.67 1up4 s TYR 155 Cb -0.05 -2.30 0.04 0.00 0.35 0.00 0.00 41.96 40.01 1up4 s TYR 155 CO 0.75 -0.59 1.56 1.49 -1.34 0.00 0.00 175.55 177.42 1up4 h GLU 156 N 8.28 0.95 -3.13 4.97 4.81 -1.90 -3.35 114.58 125.21 1up4 h GLU 156 Ca -0.30 -0.41 -0.75 0.00 -0.13 0.00 0.00 59.36 57.77 1up4 h GLU 156 Cb 1.12 -0.03 -0.15 0.00 0.63 0.00 0.00 28.75 30.32 1up4 h GLU 156 CO 0.61 1.07 2.09 1.63 -0.73 0.00 0.00 179.01 183.69 1up4 n LYS 157 N -4.11 4.05 -3.75 1.92 5.02 -1.26 -4.82 118.16 115.21 1up4 n LYS 157 Ca -0.00 -3.57 -0.27 0.00 -2.02 0.00 0.00 58.31 52.45 1up4 n LYS 157 Cb 0.46 -2.79 -0.17 0.00 -0.02 0.00 0.00 35.03 32.51 1up4 n LYS 157 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1up4 s PHE 158 N -0.41 0.95 -0.21 2.13 2.19 -1.26 -1.24 117.98 120.13 1up4 s PHE 158 Ca 0.44 -0.69 -0.02 0.00 0.33 0.00 0.00 56.93 56.99 1up4 s PHE 158 Cb 0.13 -0.98 0.01 0.00 -1.31 0.00 0.00 43.02 40.87 1up4 s PHE 158 CO -0.03 -0.54 -0.10 0.42 1.83 0.00 0.00 175.22 176.80 1up4 s ILE 159 N 1.88 2.78 0.10 3.12 1.01 0.34 -4.91 121.20 125.52 1up4 s ILE 159 Ca 0.01 -0.80 -0.25 0.00 0.00 0.00 0.00 60.65 59.60 1up4 s ILE 159 Cb -0.16 -2.28 -0.07 0.00 0.01 0.00 0.00 42.46 39.96 1up4 s ILE 159 CO -0.07 0.39 0.78 -0.83 0.00 0.00 0.00 174.94 175.21 1up4 s GLY 160 N 1.37 2.86 0.14 6.18 0.00 -1.04 -0.81 107.32 116.02 1up4 s GLY 160 Ca 0.04 0.34 0.08 0.00 0.00 0.00 0.00 44.72 45.17 1up4 s GLY 160 CO -0.07 1.03 -0.18 -2.27 0.00 0.00 0.00 173.10 171.61 1up4 s LEU 161 N -0.50 2.39 0.12 0.66 2.96 -0.24 -0.43 118.68 123.63 1up4 s LEU 161 Ca 0.38 -0.80 -0.10 0.00 -0.22 0.00 0.00 54.13 53.39 1up4 s LEU 161 Cb -0.22 -0.79 0.00 0.00 0.50 0.00 0.00 46.19 45.68 1up4 s LEU 161 CO 0.25 -0.03 0.25 0.00 -1.32 0.00 0.00 176.35 175.50 1up4 n ASN 163 N -0.13 1.24 0.01 0.00 6.94 -1.26 -4.41 115.26 117.65 1up4 n ASN 163 Ca -0.13 -0.99 -0.18 0.00 -0.02 0.00 0.00 54.58 53.26 1up4 n ASN 163 Cb 0.63 0.33 -0.11 0.00 -2.36 0.00 0.00 39.78 38.27 1up4 n ASN 163 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 1up4 h VAL 164 N 1.28 1.42 -0.35 3.53 3.04 -1.99 -2.54 116.25 120.64 1up4 h VAL 164 Ca 0.00 -2.12 0.07 0.00 -1.01 0.00 0.00 66.70 63.65 1up4 h VAL 164 Cb 0.58 2.62 -0.09 0.00 -2.01 0.00 0.00 31.29 32.39 1up4 h VAL 164 CO 0.00 0.62 -0.33 -0.65 -1.01 0.00 0.00 177.57 176.20 1up4 h PRO 165 N -0.09 -0.27 -0.20 4.17 0.11 -1.95 -0.57 132.00 133.20 1up4 h PRO 165 Ca -0.08 0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 1up4 h PRO 165 Cb 1.35 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.51 1up4 h PRO 165 CO 0.13 -0.18 -0.07 0.97 -0.21 0.00 0.00 178.00 178.63 1up4 h ILE 166 N -0.28 1.17 -0.32 4.15 6.09 -1.81 -1.27 117.51 125.24 1up4 h ILE 166 Ca 0.16 -0.72 -0.16 0.00 -1.37 0.00 0.00 64.86 62.77 1up4 h ILE 166 Cb 0.54 1.10 -0.01 0.00 0.47 0.00 0.00 36.82 38.92 1up4 h ILE 166 CO -0.51 0.23 -0.45 0.78 -3.07 0.00 0.00 178.15 175.14 1up4 h ASN 167 N 0.30 0.90 0.06 2.19 2.35 -0.97 -1.92 115.58 118.49 1up4 h ASN 167 Ca 0.06 -0.44 -0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1up4 h ASN 167 Cb 0.32 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1up4 h ASN 167 CO 0.02 1.21 -0.03 0.15 -1.65 0.00 0.00 177.43 177.13 1up4 h PHE 168 N 0.67 -0.07 -0.36 1.19 3.57 -0.73 -2.31 116.94 118.89 1up4 h PHE 168 Ca 0.04 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.62 1up4 h PHE 168 Cb 1.03 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.71 1up4 h PHE 168 CO 0.06 0.12 -0.25 0.82 -2.23 0.00 0.00 178.31 176.84 1up4 h ILE 169 N -0.26 0.35 -1.00 1.41 2.04 -1.25 -1.25 117.51 117.55 1up4 h ILE 169 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1up4 h ILE 169 Cb 0.23 0.35 -0.06 0.00 -0.74 0.00 0.00 36.82 36.60 1up4 h ILE 169 CO 0.01 0.00 0.65 -0.09 0.00 0.00 0.00 178.15 178.72 1up4 h ARG 170 N -0.20 1.17 -0.01 2.37 2.43 -1.33 0.59 114.38 119.41 1up4 h ARG 170 Ca 0.18 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 1up4 h ARG 170 Cb 0.47 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1up4 h ARG 170 CO -0.47 0.77 -0.03 0.93 -1.51 0.00 0.00 179.97 179.66 1up4 h GLU 171 N 1.20 -0.04 -0.28 0.20 5.08 -0.80 -2.18 114.58 117.76 1up4 h GLU 171 Ca 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.78 1up4 h GLU 171 Cb 0.10 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1up4 h GLU 171 CO -0.15 -0.03 0.18 0.82 -1.00 0.00 0.00 179.01 178.83 1up4 h ILE 172 N -0.04 1.08 -0.53 3.13 1.08 -0.56 -3.03 117.51 118.65 1up4 h ILE 172 Ca 0.01 -0.17 0.10 0.00 -0.39 0.00 0.00 64.86 64.42 1up4 h ILE 172 Cb 0.06 0.69 -0.08 0.00 -3.07 0.00 0.00 36.82 34.42 1up4 h ILE 172 CO -0.03 0.08 0.04 0.00 -0.69 0.00 0.00 178.15 177.54 1up4 h ALA 173 N 1.09 0.54 0.00 1.87 0.00 -0.81 -1.97 119.26 119.99 1up4 h ALA 173 Ca 0.10 0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 1up4 h ALA 173 Cb -0.02 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1up4 h ALA 173 CO -0.02 -0.36 -0.26 -0.85 0.00 0.00 0.00 179.25 177.76 1up4 n GLU 174 N -5.20 1.66 0.00 0.00 0.28 -0.83 -0.47 120.64 116.08 1up4 n GLU 174 Ca 0.06 -0.69 0.00 0.00 -0.16 0.00 0.00 57.16 56.37 1up4 n GLU 174 Cb 0.28 -1.71 0.00 0.00 1.43 0.00 0.00 31.44 31.44 1up4 n GLU 174 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1up4 n PHE 176 N 2.24 0.00 -3.69 -1.84 3.72 -0.74 -4.86 117.46 112.29 1up4 n PHE 176 Ca 0.30 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.44 1up4 n PHE 176 Cb 0.77 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.35 1up4 n PHE 176 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1up4 n SER 177 N 0.00 -3.55 -4.25 4.37 7.64 0.38 -5.00 113.62 113.21 1up4 n SER 177 Ca 0.00 -0.93 -0.14 0.00 1.01 0.00 0.00 58.87 58.81 1up4 n SER 177 Cb 0.00 -3.69 -0.10 0.00 -1.01 0.00 0.00 64.21 59.40 1up4 n SER 177 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up4 s ALA 178 N -3.59 1.41 0.80 -0.43 0.00 -0.23 -5.14 121.76 114.58 1up4 s ALA 178 Ca 0.27 -1.57 -0.11 0.00 0.00 0.00 0.00 51.96 50.55 1up4 s ALA 178 Cb -0.09 0.38 0.07 0.00 0.00 0.00 0.00 23.12 23.49 1up4 s ALA 178 CO 0.84 -0.25 1.10 1.03 0.00 0.00 0.00 175.76 178.48 1up4 s ARG 179 N -3.86 2.05 0.22 0.00 0.52 -1.26 -4.53 118.95 112.10 1up4 s ARG 179 Ca 0.22 0.63 -0.08 0.00 -0.52 0.00 0.00 55.73 55.98 1up4 s ARG 179 Cb 0.05 -1.92 0.27 0.00 0.52 0.00 0.00 34.95 33.87 1up4 s ARG 179 CO 0.03 -1.64 1.85 -0.07 0.02 0.00 0.00 175.30 175.48 1up4 h LEU 180 N -1.10 0.76 -0.19 2.53 4.07 -1.95 -1.91 115.31 117.51 1up4 h LEU 180 Ca -0.47 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.50 1up4 h LEU 180 Cb 1.27 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.86 1up4 h LEU 180 CO 0.59 0.50 0.00 -1.84 -1.08 0.00 0.00 178.44 176.62 1up4 n GLU 181 N -4.65 0.10 0.02 1.13 0.28 -1.26 -2.14 120.64 114.12 1up4 n GLU 181 Ca 0.10 0.23 0.09 0.00 -0.16 0.00 0.00 57.16 57.42 1up4 n GLU 181 Cb 0.14 -1.66 0.38 0.00 1.43 0.00 0.00 31.44 31.73 1up4 n GLU 181 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1up4 n ASP 182 N -1.84 0.13 -4.56 -1.84 8.00 -0.72 -4.72 116.55 110.99 1up4 n ASP 182 Ca 0.04 0.53 -0.36 0.00 0.71 0.00 0.00 54.79 55.71 1up4 n ASP 182 Cb 0.27 -0.56 -0.11 0.00 -0.02 0.00 0.00 41.12 40.71 1up4 n ASP 182 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1up4 s VAL 183 N -3.05 4.84 -0.08 2.53 1.01 -0.91 -0.44 120.40 124.29 1up4 s VAL 183 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1up4 s VAL 183 Cb 0.11 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1up4 s VAL 183 CO 0.33 0.35 -0.14 0.12 0.00 0.00 0.00 175.10 175.76 1up4 s PHE 184 N 1.23 1.69 0.08 5.22 5.36 -0.17 -5.01 117.98 126.38 1up4 s PHE 184 Ca 0.06 -0.70 0.07 0.00 -0.96 0.00 0.00 56.93 55.40 1up4 s PHE 184 Cb -0.14 -1.23 -0.04 0.00 -0.34 0.00 0.00 43.02 41.27 1up4 s PHE 184 CO 0.05 -0.36 -0.13 -0.51 -1.46 0.00 0.00 175.22 172.80 1up4 s LEU 185 N 0.81 2.88 -0.45 6.12 1.02 -1.26 -0.49 118.68 127.30 1up4 s LEU 185 Ca -0.11 -0.41 -0.19 0.00 0.02 0.00 0.00 54.13 53.43 1up4 s LEU 185 Cb -0.15 -1.69 0.03 0.00 0.02 0.00 0.00 46.19 44.40 1up4 s LEU 185 CO 0.02 0.20 0.56 -0.75 0.02 0.00 0.00 176.35 176.41 1up4 s LYS 186 N -1.95 3.16 -0.02 1.70 2.20 -0.47 -4.92 119.74 119.45 1up4 s LYS 186 Ca 0.19 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 55.13 1up4 s LYS 186 Cb -0.11 -4.00 0.02 0.00 -1.51 0.00 0.00 37.83 32.23 1up4 s LYS 186 CO 0.10 -1.02 -0.00 -0.47 -0.36 0.00 0.00 175.35 173.60 1up4 s TYR 187 N 2.52 0.24 0.11 4.03 6.14 -1.26 -1.08 117.35 128.05 1up4 s TYR 187 Ca 0.17 0.01 -0.25 0.00 0.64 0.00 0.00 57.07 57.63 1up4 s TYR 187 Cb -0.17 -0.30 0.08 0.00 0.42 0.00 0.00 41.96 41.99 1up4 s TYR 187 CO 0.15 -0.09 0.75 1.52 0.64 0.00 0.00 175.55 178.52 1up4 s TYR 188 N 0.71 -0.39 -5.00 4.97 -0.85 -0.72 -4.30 117.35 111.76 1up4 s TYR 188 Ca -0.07 0.17 0.00 0.00 -0.52 0.00 0.00 57.07 56.65 1up4 s TYR 188 Cb -0.10 0.58 0.00 0.00 0.38 0.00 0.00 41.96 42.82 1up4 s TYR 188 CO -0.01 -0.78 0.00 0.41 -1.52 0.00 0.00 175.55 173.64 1up4 n GLY 189 N -0.35 0.96 3.97 5.49 0.00 -1.23 -0.33 105.19 113.70 1up4 n GLY 189 Ca -0.12 -1.89 -0.19 0.00 0.00 0.00 0.00 46.02 43.83 1up4 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up4 s LEU 190 N 0.00 3.85 -0.04 0.99 1.02 -0.35 -0.42 118.68 123.73 1up4 s LEU 190 Ca 0.00 -0.29 -0.35 0.00 0.02 0.00 0.00 54.13 53.51 1up4 s LEU 190 Cb 0.00 -2.63 -0.13 0.00 0.02 0.00 0.00 46.19 43.44 1up4 s LEU 190 CO 0.00 -0.47 1.73 -3.20 0.02 0.00 0.00 176.35 174.43 1up4 n ASN 191 N -1.62 2.98 -1.82 2.29 2.85 -1.26 -0.88 115.26 117.80 1up4 n ASN 191 Ca 0.01 1.03 -0.18 0.00 -0.11 0.00 0.00 54.58 55.33 1up4 n ASN 191 Cb 0.59 -1.32 -0.03 0.00 1.24 0.00 0.00 39.78 40.25 1up4 n ASN 191 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1up4 n HIS 192 N 5.19 -0.56 -2.70 1.20 8.25 -1.26 -4.85 115.22 120.49 1up4 n HIS 192 Ca 0.21 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.60 1up4 n HIS 192 Cb 0.25 -3.39 0.11 0.00 1.12 0.00 0.00 29.99 28.08 1up4 n HIS 192 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1up4 n LEU 193 N -2.40 -1.66 -4.54 2.41 0.00 -0.06 -4.54 117.00 106.21 1up4 n LEU 193 Ca -0.20 -3.52 -0.24 0.00 0.00 0.00 0.00 56.01 52.05 1up4 n LEU 193 Cb 0.64 0.14 -0.09 0.00 0.00 0.00 0.00 43.42 44.11 1up4 n LEU 193 CO 0.26 1.89 -0.41 -0.94 0.00 0.00 0.00 177.39 178.19 1up4 s SER 194 N -1.37 3.92 0.01 1.96 1.04 -1.18 -1.21 113.70 116.88 1up4 s SER 194 Ca 0.23 -0.94 0.02 0.00 0.48 0.00 0.00 55.95 55.73 1up4 s SER 194 Cb 0.39 -0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.03 1up4 s SER 194 CO -0.08 -0.03 -0.05 -0.36 0.98 0.00 0.00 173.24 173.70 1up4 s PHE 195 N -2.47 0.46 -0.14 5.02 0.40 0.55 -1.92 117.98 119.88 1up4 s PHE 195 Ca 0.31 -0.21 -0.00 0.00 -0.60 0.00 0.00 56.93 56.43 1up4 s PHE 195 Cb -0.04 -0.29 -0.01 0.00 0.51 0.00 0.00 43.02 43.19 1up4 s PHE 195 CO 0.17 -0.04 -0.14 0.42 0.70 0.00 0.00 175.22 176.33 1up4 s ILE 196 N -0.52 2.86 -0.15 0.64 1.01 0.85 -1.75 121.20 124.15 1up4 s ILE 196 Ca -0.02 -0.71 0.10 0.00 0.00 0.00 0.00 60.65 60.01 1up4 s ILE 196 Cb -0.04 -2.21 -0.16 0.00 0.01 0.00 0.00 42.46 40.06 1up4 s ILE 196 CO -0.00 0.52 -0.00 1.21 0.00 0.00 0.00 174.94 176.66 1up4 n GLU 197 N 3.83 1.43 -3.85 2.79 2.13 -0.24 -0.59 120.64 126.14 1up4 n GLU 197 Ca -0.19 0.02 -0.12 0.00 0.66 0.00 0.00 57.16 57.53 1up4 n GLU 197 Cb 0.52 -1.35 -0.13 0.00 0.27 0.00 0.00 31.44 30.74 1up4 n GLU 197 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1up4 s LYS 198 N -2.34 0.06 -0.11 5.31 3.01 -1.23 -4.94 119.74 119.49 1up4 s LYS 198 Ca -0.11 0.07 0.01 0.00 -1.01 0.00 0.00 55.97 54.93 1up4 s LYS 198 Cb 0.05 0.03 0.02 0.00 -1.01 0.00 0.00 37.83 36.91 1up4 s LYS 198 CO 0.53 -0.01 -0.13 0.08 0.51 0.00 0.00 175.35 176.33 1up4 s VAL 199 N 0.02 1.40 -0.07 3.17 1.01 -1.26 -1.36 120.40 123.30 1up4 s VAL 199 Ca -0.00 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.46 1up4 s VAL 199 Cb -0.00 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.06 1up4 s VAL 199 CO 0.00 0.42 -0.22 -0.36 0.00 0.00 0.00 175.10 174.94 1up4 s PHE 200 N 1.17 2.52 -0.11 5.22 0.40 0.35 -1.04 117.98 126.50 1up4 s PHE 200 Ca -0.03 -0.71 0.01 0.00 -0.60 0.00 0.00 56.93 55.60 1up4 s PHE 200 Cb -0.14 -1.65 0.02 0.00 0.51 0.00 0.00 43.02 41.76 1up4 s PHE 200 CO -0.04 -0.21 -0.13 0.08 0.70 0.00 0.00 175.22 175.62 1up4 s VAL 201 N -0.09 1.34 -1.74 -0.44 1.01 -0.17 -1.00 120.40 119.32 1up4 s VAL 201 Ca -0.05 -0.54 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 1up4 s VAL 201 Cb -0.14 -1.25 0.17 0.00 0.00 0.00 0.00 36.38 35.15 1up4 s VAL 201 CO 0.04 0.41 0.68 0.29 0.00 0.00 0.00 175.10 176.53 1up4 n LYS 202 N 4.33 -2.37 0.00 2.72 5.02 0.41 -0.78 118.16 127.50 1up4 n LYS 202 Ca -0.18 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1up4 n LYS 202 Cb 0.51 -4.89 0.00 0.00 -0.02 0.00 0.00 35.03 30.63 1up4 n LYS 202 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1up4 n GLY 203 N -1.39 3.14 3.74 0.72 0.00 -1.26 -5.03 105.19 105.11 1up4 n GLY 203 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1up4 n GLY 203 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1up4 s GLU 204 N -0.41 4.64 -0.51 1.61 2.12 0.04 -5.00 118.70 121.20 1up4 s GLU 204 Ca 0.00 1.66 -0.29 0.00 0.36 0.00 0.00 54.97 56.70 1up4 s GLU 204 Cb 0.00 -3.29 0.03 0.00 0.26 0.00 0.00 34.13 31.13 1up4 s GLU 204 CO 0.00 0.15 1.18 0.34 -0.54 0.00 0.00 175.26 176.39 1up4 s ASP 205 N -0.25 6.54 -0.06 -1.70 -1.08 -1.26 -0.99 116.67 117.87 1up4 s ASP 205 Ca 0.48 0.36 0.11 0.00 -0.52 0.00 0.00 52.55 52.98 1up4 s ASP 205 Cb -0.28 -2.55 0.31 0.00 -1.46 0.00 0.00 42.92 38.94 1up4 s ASP 205 CO 0.34 -1.35 1.25 1.33 0.52 0.00 0.00 175.17 177.26 1up4 n VAL 206 N 6.81 1.40 -0.13 1.11 0.24 -0.20 -4.75 118.33 122.80 1up4 n VAL 206 Ca 0.11 -1.32 -0.05 0.00 -2.04 0.00 0.00 64.34 61.04 1up4 n VAL 206 Cb 0.49 0.25 0.01 0.00 -1.47 0.00 0.00 33.84 33.12 1up4 n VAL 206 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1up4 h THR 207 N 1.50 0.33 -0.46 3.34 2.02 -1.87 -0.11 112.91 117.67 1up4 h THR 207 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 1up4 h THR 207 Cb 0.90 0.33 -0.07 0.00 -1.74 0.00 0.00 68.15 67.57 1up4 h THR 207 CO 0.06 0.00 0.06 -0.08 0.37 0.00 0.00 175.52 175.92 1up4 h GLU 208 N -0.16 0.17 -0.48 6.66 4.57 -1.93 -1.65 114.58 121.77 1up4 h GLU 208 Ca 0.20 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.34 1up4 h GLU 208 Cb 0.48 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 1up4 h GLU 208 CO -0.53 0.11 0.16 0.87 -1.18 0.00 0.00 179.01 178.44 1up4 h LYS 209 N 0.18 0.69 -0.44 1.92 1.57 -1.65 -1.72 116.57 117.12 1up4 h LYS 209 Ca 0.23 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.76 1up4 h LYS 209 Cb 0.31 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1up4 h LYS 209 CO -0.33 0.60 -0.26 0.28 -0.57 0.00 0.00 179.45 179.17 1up4 h VAL 210 N 0.68 1.27 -0.25 0.50 2.07 -0.34 -2.09 116.25 118.09 1up4 h VAL 210 Ca 0.16 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.23 1up4 h VAL 210 Cb 0.19 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1up4 h VAL 210 CO -0.01 0.48 0.05 -0.26 0.02 0.00 0.00 177.57 177.85 1up4 h PHE 211 N 0.79 0.42 -0.25 1.57 0.04 -0.96 -1.15 116.94 117.41 1up4 h PHE 211 Ca 0.09 -0.05 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1up4 h PHE 211 Cb 0.83 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 1up4 h PHE 211 CO 0.05 0.51 -0.07 0.93 -0.60 0.00 0.00 178.31 179.13 1up4 h GLU 212 N 0.22 0.39 0.00 1.51 4.39 -1.29 -2.61 114.58 117.20 1up4 h GLU 212 Ca 0.08 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1up4 h GLU 212 Cb 0.30 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1up4 h GLU 212 CO 0.00 0.47 -0.41 -0.91 -1.16 0.00 0.00 179.01 177.00 1up4 h ASN 213 N 0.37 0.00 0.84 1.42 2.35 -1.20 -3.15 115.58 116.20 1up4 h ASN 213 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1up4 h ASN 213 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1up4 h ASN 213 CO 0.02 0.15 0.00 0.25 -1.65 0.00 0.00 177.43 176.20 1up4 h LEU 214 N 0.00 0.00 -1.92 1.61 5.85 -0.81 -2.93 115.31 117.11 1up4 h LEU 214 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1up4 h LEU 214 Cb 1.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1up4 h LEU 214 CO 0.02 0.00 0.00 2.29 -0.34 0.00 0.00 178.44 180.41 1up4 n LYS 215 N -3.08 2.21 -3.24 1.25 2.85 -1.19 -5.09 118.16 111.87 1up4 n LYS 215 Ca -0.00 -1.88 -0.26 0.00 -1.05 0.00 0.00 58.31 55.12 1up4 n LYS 215 Cb 0.26 -1.41 -0.06 0.00 -0.65 0.00 0.00 35.03 33.17 1up4 n LYS 215 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1up4 n LEU 216 N 1.03 3.61 -0.04 -5.58 7.99 -1.11 -5.06 117.00 117.85 1up4 n LEU 216 Ca 0.17 -5.45 0.10 0.00 -0.01 0.00 0.00 56.01 50.82 1up4 n LEU 216 Cb 0.44 -0.48 -0.11 0.00 -0.11 0.00 0.00 43.42 43.17 1up4 n LEU 216 CO 0.12 2.17 -0.02 -0.67 -1.51 0.00 0.00 177.39 177.48 1up4 n ASP 223 N 0.51 1.06 -0.92 -1.43 -0.08 -1.26 -5.05 116.55 109.37 1up4 n ASP 223 Ca 0.29 -1.03 0.12 0.00 -1.51 0.00 0.00 54.79 52.67 1up4 n ASP 223 Cb 0.42 0.96 0.09 0.00 2.34 0.00 0.00 41.12 44.93 1up4 n ASP 223 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1up4 n GLU 224 N -1.37 2.24 -4.52 -0.67 1.02 -1.26 -4.91 120.64 111.18 1up4 n GLU 224 Ca 0.04 -1.85 -0.26 0.00 -0.02 0.00 0.00 57.16 55.07 1up4 n GLU 224 Cb 0.33 -1.46 -0.10 0.00 -0.02 0.00 0.00 31.44 30.19 1up4 n GLU 224 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1up4 s ASP 225 N -2.04 3.74 0.36 1.62 1.47 -1.26 -5.08 116.67 115.49 1up4 s ASP 225 Ca 0.27 -1.16 -0.28 0.00 1.18 0.00 0.00 52.55 52.56 1up4 s ASP 225 Cb 0.20 -0.36 -0.11 0.00 -0.34 0.00 0.00 42.92 42.31 1up4 s ASP 225 CO 0.32 -0.17 1.44 0.49 0.68 0.00 0.00 175.17 177.93 1up4 n PHE 226 N -0.78 2.80 -1.16 2.11 3.72 -1.26 -4.99 117.46 117.89 1up4 n PHE 226 Ca -0.05 0.47 -0.29 0.00 -0.05 0.00 0.00 57.45 57.53 1up4 n PHE 226 Cb 0.63 -2.50 0.15 0.00 -0.94 0.00 0.00 39.48 36.82 1up4 n PHE 226 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1up4 s PRO 227 N -1.98 0.94 0.16 -1.08 0.04 -1.26 -4.95 135.00 126.86 1up4 s PRO 227 Ca 0.54 0.75 -0.16 0.00 0.04 0.00 0.00 61.00 62.17 1up4 s PRO 227 Cb -0.50 -1.78 0.08 0.00 0.04 0.00 0.00 34.50 32.34 1up4 s PRO 227 CO 0.63 -2.44 1.75 1.15 0.04 0.00 0.00 177.00 178.13 1up4 h THR 228 N -1.69 0.89 -0.12 1.26 2.02 -1.97 -2.45 112.91 110.85 1up4 h THR 228 Ca -0.51 -0.10 0.03 0.00 0.77 0.00 0.00 66.41 66.60 1up4 h THR 228 Cb 1.30 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1up4 h THR 228 CO 0.55 0.05 0.09 4.11 0.37 0.00 0.00 175.52 180.70 1up4 h TRP 229 N 0.29 0.00 -0.42 3.16 5.08 -1.99 -2.06 115.95 120.01 1up4 h TRP 229 Ca 0.18 0.00 0.03 0.00 1.08 0.00 0.00 58.89 60.17 1up4 h TRP 229 Cb 0.15 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.28 1up4 h TRP 229 CO -0.15 0.00 0.22 0.35 -1.28 0.00 0.00 178.44 177.59 1up4 h PHE 230 N 0.00 0.41 -0.10 0.12 3.04 -1.80 -0.10 116.94 118.51 1up4 h PHE 230 Ca 0.06 0.02 -0.16 0.00 3.98 0.00 0.00 57.97 61.86 1up4 h PHE 230 Cb 0.24 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 1up4 h PHE 230 CO 0.00 0.22 -0.64 1.88 -2.02 0.00 0.00 178.31 177.76 1up4 h TYR 231 N 0.45 0.48 -0.96 0.41 0.05 -1.46 0.07 116.97 116.00 1up4 h TYR 231 Ca 0.17 -0.19 0.03 0.00 0.05 0.00 0.00 58.73 58.79 1up4 h TYR 231 Cb 0.06 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 37.66 1up4 h TYR 231 CO -0.09 0.90 0.63 -0.44 -1.05 0.00 0.00 178.16 178.11 1up4 h ASP 232 N 0.27 1.06 0.00 3.88 3.32 -1.15 -2.12 116.42 121.68 1up4 h ASP 232 Ca -0.01 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1up4 h ASP 232 Cb 1.17 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 1up4 h ASP 232 CO 0.11 0.74 -0.29 0.28 -1.72 0.00 0.00 179.24 178.35 1up4 h SER 233 N 1.24 0.00 0.49 6.45 0.02 -0.78 -3.39 113.55 117.59 1up4 h SER 233 Ca 0.38 -0.39 -0.19 0.00 -0.84 0.00 0.00 61.79 60.75 1up4 h SER 233 Cb -0.03 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1up4 h SER 233 CO -0.11 0.86 -0.83 0.58 -1.14 0.00 0.00 176.83 176.18 1up4 h VAL 234 N -1.00 1.46 -5.56 2.27 2.07 -1.12 -3.47 116.25 110.89 1up4 h VAL 234 Ca -0.06 -2.46 -0.42 0.00 0.82 0.00 0.00 66.70 64.59 1up4 h VAL 234 Cb 0.60 2.36 0.06 0.00 -1.52 0.00 0.00 31.29 32.79 1up4 h VAL 234 CO -0.03 0.72 -0.67 0.54 0.02 0.00 0.00 177.57 178.15 1up4 n ARG 235 N -3.72 -6.31 -4.15 1.57 1.74 -0.80 -5.01 116.66 99.99 1up4 n ARG 235 Ca -0.04 0.77 -0.15 0.00 -0.77 0.00 0.00 57.85 57.66 1up4 n ARG 235 Cb 0.77 -5.72 -0.13 0.00 -1.02 0.00 0.00 32.46 26.36 1up4 n ARG 235 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1up4 s LEU 236 N -7.09 2.15 -0.12 0.55 1.43 -1.26 -4.88 118.68 109.45 1up4 s LEU 236 Ca 0.52 -0.36 -0.23 0.00 -1.03 0.00 0.00 54.13 53.03 1up4 s LEU 236 Cb -0.24 -0.28 -0.03 0.00 0.03 0.00 0.00 46.19 45.67 1up4 s LEU 236 CO 0.64 -0.06 0.69 -0.63 0.23 0.00 0.00 176.35 177.22 1up4 s ILE 237 N -0.81 5.02 -0.03 -0.59 1.01 0.24 -4.90 121.20 121.14 1up4 s ILE 237 Ca -0.03 1.37 0.06 0.00 0.00 0.00 0.00 60.65 62.05 1up4 s ILE 237 Cb -0.07 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 1up4 s ILE 237 CO 0.00 0.18 -0.21 -0.69 0.00 0.00 0.00 174.94 174.22 1up4 s VAL 238 N 1.34 2.47 0.33 2.92 1.01 -1.26 -0.10 120.40 127.10 1up4 s VAL 238 Ca 0.34 -0.95 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 1up4 s VAL 238 Cb -0.17 -1.91 -0.11 0.00 0.00 0.00 0.00 36.38 34.19 1up4 s VAL 238 CO 0.14 0.58 1.54 -3.20 0.00 0.00 0.00 175.10 174.17 1up4 n ASN 239 N 2.38 3.79 0.25 3.32 2.85 -0.81 -4.89 115.26 122.15 1up4 n ASN 239 Ca -0.16 1.18 0.17 0.00 -0.11 0.00 0.00 54.58 55.66 1up4 n ASN 239 Cb 0.51 -1.60 0.89 0.00 1.24 0.00 0.00 39.78 40.83 1up4 n ASN 239 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1up4 h PRO 240 N 4.02 0.00 0.00 1.20 0.11 -1.94 -0.42 132.00 134.97 1up4 h PRO 240 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1up4 h PRO 240 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1up4 h PRO 240 CO 0.73 0.00 -0.01 1.88 -0.21 0.00 0.00 178.00 180.39 1up4 h TYR 241 N 0.00 0.00 0.00 0.65 -1.99 -1.90 -2.20 116.97 111.53 1up4 h TYR 241 Ca 0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.78 1up4 h TYR 241 Cb 0.36 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.09 1up4 h TYR 241 CO 0.00 0.01 0.00 -0.07 -0.00 0.00 0.00 178.16 178.10 1up4 h LEU 242 N 0.00 0.00 -1.62 3.88 -0.00 -1.30 -1.24 115.31 115.04 1up4 h LEU 242 Ca -0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.94 1up4 h LEU 242 Cb 0.41 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.04 1up4 h LEU 242 CO 0.00 0.00 0.34 0.03 -0.00 0.00 0.00 178.44 178.81 1up4 h ARG 243 N 0.00 0.46 0.00 1.13 3.08 -1.59 0.16 114.38 117.63 1up4 h ARG 243 Ca 0.00 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1up4 h ARG 243 Cb 0.07 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1up4 h ARG 243 CO 0.00 0.31 -0.23 1.88 -1.07 0.00 0.00 179.97 180.86 1up4 h TYR 244 N 0.48 0.00 0.03 3.04 0.05 -1.45 -3.13 116.97 115.98 1up4 h TYR 244 Ca 0.22 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.79 1up4 h TYR 244 Cb 0.26 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 1up4 h TYR 244 CO -0.00 0.23 -1.13 1.88 -1.05 0.00 0.00 178.16 178.09 1up4 h TYR 245 N 0.00 0.13 -0.24 4.88 -1.99 -1.45 -3.32 116.97 114.98 1up4 h TYR 245 Ca -0.00 -0.09 -0.07 0.00 2.00 0.00 0.00 58.73 60.57 1up4 h TYR 245 Cb 0.47 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 39.16 1up4 h TYR 245 CO 0.00 1.44 0.08 1.28 -0.00 0.00 0.00 178.16 180.97 1up4 n LEU 246 N -4.29 3.21 0.00 3.88 7.99 -0.05 -4.99 117.00 122.74 1up4 n LEU 246 Ca -0.27 -1.64 0.00 0.00 -0.01 0.00 0.00 56.01 54.09 1up4 n LEU 246 Cb 0.72 -0.58 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 1up4 n LEU 246 CO 0.28 0.49 0.00 1.21 -1.51 0.00 0.00 177.39 177.86 1up4 n GLU 248 N 0.11 0.00 -0.01 3.23 2.13 -1.23 -5.05 120.64 119.82 1up4 n GLU 248 Ca 0.13 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.86 1up4 n GLU 248 Cb 0.69 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.37 1up4 n GLU 248 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1up4 h LYS 249 N 0.00 -0.19 -0.53 5.31 1.57 -1.92 0.21 116.57 121.02 1up4 h LYS 249 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1up4 h LYS 249 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1up4 h LYS 249 CO 0.00 -0.13 0.00 1.17 -0.57 0.00 0.00 179.45 179.92 1up4 n LYS 250 N -5.31 0.06 0.00 3.15 4.81 -1.26 -1.86 118.16 117.75 1up4 n LYS 250 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 1up4 n LYS 250 Cb 0.23 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 34.14 1up4 n LYS 250 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1up4 n PHE 252 N 0.59 0.00 0.00 5.64 7.35 0.73 -2.39 117.46 129.39 1up4 n PHE 252 Ca 0.00 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.72 1up4 n PHE 252 Cb 0.02 0.00 0.38 0.00 0.35 0.00 0.00 39.48 40.23 1up4 n PHE 252 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1up4 h LYS 253 N 0.00 0.52 0.20 -4.13 3.64 -1.61 -1.53 116.57 113.66 1up4 h LYS 253 Ca 0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1up4 h LYS 253 Cb 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1up4 h LYS 253 CO 0.00 0.42 -0.09 -0.22 -2.27 0.00 0.00 179.45 177.29 1up4 h LYS 254 N 0.53 -0.25 -0.62 1.90 3.64 -1.75 -3.18 116.57 116.84 1up4 h LYS 254 Ca 0.13 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1up4 h LYS 254 Cb 0.08 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 1up4 h LYS 254 CO -0.02 0.11 0.36 0.82 -2.27 0.00 0.00 179.45 178.45 1up4 h ILE 255 N -0.93 1.01 -0.00 2.00 2.04 -1.84 -2.78 117.51 117.01 1up4 h ILE 255 Ca -0.03 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1up4 h ILE 255 Cb 0.48 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1up4 h ILE 255 CO 0.04 0.12 -0.02 -1.54 0.00 0.00 0.00 178.15 176.75 1up4 n SER 256 N -4.78 0.12 -0.26 1.72 3.41 -0.58 -3.27 113.62 109.98 1up4 n SER 256 Ca 0.07 -0.44 0.05 0.00 -0.26 0.00 0.00 58.87 58.28 1up4 n SER 256 Cb 0.13 -0.17 0.10 0.00 -0.26 0.00 0.00 64.21 64.00 1up4 n SER 256 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1up4 n THR 257 N -1.13 1.38 -4.17 6.66 -2.24 -1.05 -5.01 114.28 108.72 1up4 n THR 257 Ca 0.16 -1.42 -0.13 0.00 -2.27 0.00 0.00 64.05 60.40 1up4 n THR 257 Cb 0.22 0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.57 1up4 n THR 257 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1up4 s HIS 258 N -1.68 0.98 0.17 4.78 3.76 -1.20 -5.08 115.29 117.01 1up4 s HIS 258 Ca 0.18 -0.72 -0.31 0.00 -0.15 0.00 0.00 55.06 54.06 1up4 s HIS 258 Cb 0.14 -0.54 -0.17 0.00 1.11 0.00 0.00 32.58 33.11 1up4 s HIS 258 CO 0.05 -0.05 0.79 -1.91 -0.85 0.00 0.00 174.74 172.78 1up4 n GLU 259 N 0.44 0.37 -1.81 1.40 2.13 -1.26 -4.89 120.64 117.01 1up4 n GLU 259 Ca -0.15 0.13 -0.41 0.00 0.66 0.00 0.00 57.16 57.39 1up4 n GLU 259 Cb 0.58 -1.35 -0.00 0.00 0.27 0.00 0.00 31.44 30.94 1up4 n GLU 259 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1up4 s LEU 260 N 1.71 4.32 0.30 4.31 1.43 -1.26 -4.91 118.68 124.58 1up4 s LEU 260 Ca 0.70 3.03 -0.01 0.00 -1.03 0.00 0.00 54.13 56.82 1up4 s LEU 260 Cb -0.95 -3.67 0.47 0.00 0.03 0.00 0.00 46.19 42.07 1up4 s LEU 260 CO 0.56 -0.87 1.94 -0.09 0.23 0.00 0.00 176.35 178.12 1up4 h ARG 261 N 3.17 0.97 -0.73 1.70 9.65 -1.94 -2.15 114.38 125.04 1up4 h ARG 261 Ca -0.50 -0.09 0.16 0.00 -1.10 0.00 0.00 59.98 58.44 1up4 h ARG 261 Cb 1.24 -0.20 -0.05 0.00 -1.39 0.00 0.00 29.97 29.57 1up4 h ARG 261 CO 0.65 0.69 0.50 0.00 2.80 0.00 0.00 179.97 184.62 1up4 h ALA 262 N 1.47 2.21 -0.15 2.80 0.00 -1.91 0.79 119.26 124.48 1up4 h ALA 262 Ca 0.25 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1up4 h ALA 262 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1up4 h ALA 262 CO -0.04 -0.42 -0.54 -0.09 0.00 0.00 0.00 179.25 178.16 1up4 h ARG 263 N 0.33 0.45 -0.34 0.00 2.43 -1.75 -2.98 114.38 112.52 1up4 h ARG 263 Ca 0.36 -0.28 -0.16 0.00 -0.81 0.00 0.00 59.98 59.09 1up4 h ARG 263 Cb 0.93 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1up4 h ARG 263 CO -0.10 0.88 -0.41 0.93 -1.51 0.00 0.00 179.97 179.75 1up4 h GLU 264 N 0.35 0.89 -1.96 0.20 5.08 -0.87 -3.10 114.58 115.16 1up4 h GLU 264 Ca 0.01 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1up4 h GLU 264 Cb 1.06 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1up4 h GLU 264 CO 0.10 1.14 0.00 0.28 -1.00 0.00 0.00 179.01 179.53 1up4 n VAL 265 N -4.08 0.10 0.00 3.13 0.31 -0.72 -1.45 118.33 115.63 1up4 n VAL 265 Ca -0.03 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1up4 n VAL 265 Cb 0.56 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 1up4 n VAL 265 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1up4 n LYS 267 N 1.40 0.00 -0.09 5.55 5.02 -1.17 0.01 118.16 128.88 1up4 n LYS 267 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1up4 n LYS 267 Cb 0.04 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.00 1up4 n LYS 267 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1up4 h ILE 268 N 0.00 1.26 -0.26 -0.18 2.04 -1.56 -2.56 117.51 116.25 1up4 h ILE 268 Ca 0.00 -0.93 -0.14 0.00 1.00 0.00 0.00 64.86 64.78 1up4 h ILE 268 Cb 0.00 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1up4 h ILE 268 CO 0.00 0.29 -0.43 -0.33 0.00 0.00 0.00 178.15 177.69 1up4 h GLU 269 N 0.23 0.64 -0.57 2.37 5.08 -0.69 -1.35 114.58 120.27 1up4 h GLU 269 Ca 0.07 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1up4 h GLU 269 Cb 0.43 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1up4 h GLU 269 CO 0.01 0.94 0.29 -0.22 -1.00 0.00 0.00 179.01 179.04 1up4 h LYS 270 N 0.52 0.80 -0.16 2.33 3.64 -1.78 -0.86 116.57 121.06 1up4 h LYS 270 Ca 0.04 -0.09 -0.22 0.00 -1.27 0.00 0.00 60.65 59.11 1up4 h LYS 270 Cb 0.95 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 32.63 1up4 h LYS 270 CO 0.09 0.61 -0.76 1.49 -2.27 0.00 0.00 179.45 178.61 1up4 h GLU 271 N 0.80 0.76 -0.34 1.90 4.81 -1.02 -2.77 114.58 118.72 1up4 h GLU 271 Ca 0.20 -0.61 -0.10 0.00 -0.13 0.00 0.00 59.36 58.73 1up4 h GLU 271 Cb 0.06 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1up4 h GLU 271 CO -0.03 1.22 -0.19 -0.07 -0.73 0.00 0.00 179.01 179.21 1up4 h LEU 272 N 0.53 0.63 -0.61 1.64 3.38 -1.02 -2.43 115.31 117.43 1up4 h LEU 272 Ca -0.04 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 1up4 h LEU 272 Cb 1.38 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1up4 h LEU 272 CO 0.15 0.83 -0.08 -0.26 0.09 0.00 0.00 178.44 179.17 1up4 h PHE 273 N 0.56 1.13 -0.43 1.13 -1.00 -1.13 -1.28 116.94 115.93 1up4 h PHE 273 Ca 0.09 -0.22 -0.07 0.00 2.81 0.00 0.00 57.97 60.58 1up4 h PHE 273 Cb 0.64 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.90 1up4 h PHE 273 CO 0.03 1.03 -0.03 0.93 -1.61 0.00 0.00 178.31 178.66 1up4 h GLU 274 N 0.91 0.71 -0.41 1.51 4.39 -1.39 -2.87 114.58 117.44 1up4 h GLU 274 Ca 0.15 -0.19 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 1up4 h GLU 274 Cb 0.64 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 1up4 h GLU 274 CO 0.04 0.75 -0.07 0.87 -1.16 0.00 0.00 179.01 179.44 1up4 h LYS 275 N 0.67 0.69 -0.01 2.33 1.57 -1.01 -3.19 116.57 117.62 1up4 h LYS 275 Ca 0.13 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1up4 h LYS 275 Cb 0.46 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1up4 h LYS 275 CO 0.02 0.76 -0.19 1.88 -0.57 0.00 0.00 179.45 181.35 1up4 h TYR 276 N 0.64 0.02 -0.97 -1.35 0.05 -1.01 -1.43 116.97 112.92 1up4 h TYR 276 Ca 0.12 -0.00 0.23 0.00 0.05 0.00 0.00 58.73 59.13 1up4 h TYR 276 Cb 0.50 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.16 1up4 h TYR 276 CO 0.02 0.21 0.64 0.00 -1.05 0.00 0.00 178.16 177.98 1up4 h ARG 277 N 0.02 0.40 0.00 4.88 3.08 -1.55 -3.21 114.38 117.99 1up4 h ARG 277 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1up4 h ARG 277 Cb 0.35 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1up4 h ARG 277 CO 0.02 0.26 -0.38 0.25 -1.07 0.00 0.00 179.97 179.06 1up4 n THR 278 N -4.55 0.00 -1.82 2.04 -2.24 -1.09 -5.00 114.28 101.62 1up4 n THR 278 Ca 0.22 -0.24 -0.41 0.00 -2.27 0.00 0.00 64.05 61.34 1up4 n THR 278 Cb 0.78 0.75 -0.02 0.00 -2.10 0.00 0.00 70.33 69.74 1up4 n THR 278 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1up4 s ALA 279 N -1.25 3.71 -0.21 6.98 0.00 -0.56 -4.92 121.76 125.51 1up4 s ALA 279 Ca 0.00 1.53 0.01 0.00 0.00 0.00 0.00 51.96 53.50 1up4 s ALA 279 Cb 0.00 -3.63 -0.20 0.00 0.00 0.00 0.00 23.12 19.29 1up4 s ALA 279 CO 0.00 -0.95 -0.03 1.33 0.00 0.00 0.00 175.76 176.11 1up4 n VAL 280 N 2.06 1.56 -3.78 0.00 0.24 -1.26 -4.95 118.33 112.20 1up4 n VAL 280 Ca 0.07 -0.62 -0.21 0.00 -2.04 0.00 0.00 64.34 61.55 1up4 n VAL 280 Cb 0.38 -1.43 -0.03 0.00 -1.47 0.00 0.00 33.84 31.29 1up4 n VAL 280 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1up4 s GLU 281 N -2.53 2.78 0.09 7.34 2.56 -1.26 -4.64 118.70 123.03 1up4 s GLU 281 Ca -0.29 -1.25 -0.31 0.00 0.00 0.00 0.00 54.97 53.12 1up4 s GLU 281 Cb 0.08 -2.52 -0.07 0.00 2.00 0.00 0.00 34.13 33.62 1up4 s GLU 281 CO 0.66 0.10 1.29 0.42 -0.56 0.00 0.00 175.26 177.18 1up4 s ILE 282 N -2.28 3.66 0.74 -3.70 1.01 -1.26 -5.02 121.20 114.35 1up4 s ILE 282 Ca 0.41 1.20 -0.11 0.00 0.00 0.00 0.00 60.65 62.15 1up4 s ILE 282 Cb -0.06 -3.77 0.04 0.00 0.01 0.00 0.00 42.46 38.68 1up4 s ILE 282 CO 0.27 0.10 1.08 -2.16 0.00 0.00 0.00 174.94 174.22 1up4 s PRO 283 N 1.05 2.56 0.00 2.79 0.04 -1.26 -4.96 135.00 135.22 1up4 s PRO 283 Ca 0.61 0.82 0.14 0.00 0.04 0.00 0.00 61.00 62.62 1up4 s PRO 283 Cb -0.33 -1.96 0.73 0.00 0.04 0.00 0.00 34.50 32.98 1up4 s PRO 283 CO 0.30 -1.33 1.39 -1.91 0.04 0.00 0.00 177.00 175.49 1up4 n GLU 284 N -3.27 0.21 0.00 4.56 2.13 -1.26 -5.18 120.64 117.84 1up4 n GLU 284 Ca 0.07 0.15 0.07 0.00 0.66 0.00 0.00 57.16 58.11 1up4 n GLU 284 Cb 0.55 -1.50 0.43 0.00 0.27 0.00 0.00 31.44 31.19 1up4 n GLU 284 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1up4 n GLU 285 N -1.28 1.00 0.00 5.31 1.02 -1.26 -5.28 120.64 120.15 1up4 n GLU 285 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1up4 n GLU 285 Cb 0.11 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 1up4 n GLU 285 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1up4 n SER 292 N -0.73 0.00 0.00 1.62 3.41 -1.26 -5.14 113.62 111.52 1up4 n SER 292 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1up4 n SER 292 Cb 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1up4 n SER 292 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1up4 n TYR 294 N 0.00 0.00 -0.01 7.33 4.11 -1.26 -4.77 117.16 122.56 1up4 n TYR 294 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.78 1up4 n TYR 294 Cb 0.00 -0.06 -0.07 0.00 -0.00 0.00 0.00 39.34 39.22 1up4 n TYR 294 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 1up4 h SER 295 N 0.00 0.10 -0.92 9.48 4.64 -1.95 -1.94 113.55 122.96 1up4 h SER 295 Ca 0.00 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1up4 h SER 295 Cb 0.00 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 1up4 h SER 295 CO 0.00 0.25 0.57 0.00 -0.87 0.00 0.00 176.83 176.78 1up4 h THR 296 N -0.06 1.25 -0.11 2.95 1.03 -1.86 -1.68 112.91 114.42 1up4 h THR 296 Ca 0.02 -0.52 0.03 0.00 -0.01 0.00 0.00 66.41 65.93 1up4 h THR 296 Cb 0.19 -0.07 -0.03 0.00 -1.07 0.00 0.00 68.15 67.17 1up4 h THR 296 CO -0.00 0.26 -0.07 0.00 -0.01 0.00 0.00 175.52 175.69 1up4 h ALA 297 N 1.36 0.03 -0.24 0.00 0.00 -1.89 0.15 119.26 118.67 1up4 h ALA 297 Ca 0.33 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 1up4 h ALA 297 Cb -0.08 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1up4 h ALA 297 CO -0.07 -0.53 0.00 0.00 0.00 0.00 0.00 179.25 178.66 1up4 h ALA 298 N 1.03 0.32 -0.42 0.00 0.00 -1.08 -1.49 119.26 117.62 1up4 h ALA 298 Ca 0.07 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1up4 h ALA 298 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1up4 h ALA 298 CO -0.16 0.05 0.12 0.00 0.00 0.00 0.00 179.25 179.26 1up4 h ALA 299 N 0.81 0.56 -0.57 0.00 0.00 -1.24 -1.13 119.26 117.68 1up4 h ALA 299 Ca 0.07 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1up4 h ALA 299 Cb 0.41 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1up4 h ALA 299 CO 0.01 0.22 0.00 0.45 0.00 0.00 0.00 179.25 179.94 1up4 h HIS 300 N 0.55 1.07 0.02 0.00 3.86 -0.95 0.39 115.15 120.08 1up4 h HIS 300 Ca 0.14 -0.17 -0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1up4 h HIS 300 Cb 0.29 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1up4 h HIS 300 CO 0.01 0.95 -0.01 1.25 0.86 0.00 0.00 177.93 181.00 1up4 h LEU 301 N 0.91 -0.02 -0.73 2.43 5.85 -1.07 -2.18 115.31 120.50 1up4 h LEU 301 Ca 0.17 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1up4 h LEU 301 Cb 0.53 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1up4 h LEU 301 CO 0.03 0.10 0.49 0.40 -0.34 0.00 0.00 178.44 179.11 1up4 h ILE 302 N -0.13 1.19 -0.76 4.05 2.04 -0.99 -0.16 117.51 122.74 1up4 h ILE 302 Ca -0.00 -0.34 0.16 0.00 1.00 0.00 0.00 64.86 65.68 1up4 h ILE 302 Cb 0.13 0.11 -0.11 0.00 -0.74 0.00 0.00 36.82 36.21 1up4 h ILE 302 CO 0.00 0.18 0.24 -0.09 0.00 0.00 0.00 178.15 178.49 1up4 h ARG 303 N 0.99 0.33 0.00 2.37 2.43 -0.80 -1.58 114.38 118.13 1up4 h ARG 303 Ca 0.27 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.37 1up4 h ARG 303 Cb -0.11 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1up4 h ARG 303 CO -0.06 0.22 -0.98 -0.44 -1.51 0.00 0.00 179.97 177.20 1up4 h ASP 304 N 0.34 0.00 0.58 -3.80 3.32 -0.67 -1.99 116.42 114.20 1up4 h ASP 304 Ca 0.43 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.41 1up4 h ASP 304 Cb 0.73 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1up4 h ASP 304 CO -0.48 0.19 -0.36 -0.07 -1.72 0.00 0.00 179.24 176.80 1up4 h LEU 305 N 0.00 0.00 0.12 1.55 -0.00 -0.68 -3.26 115.31 113.04 1up4 h LEU 305 Ca -0.04 0.00 -0.25 0.00 -0.00 0.00 0.00 57.88 57.59 1up4 h LEU 305 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.85 1up4 h LEU 305 CO 0.02 0.36 -1.22 -0.33 -0.00 0.00 0.00 178.44 177.27 1up4 h GLU 306 N 0.00 0.25 -7.42 1.13 4.39 -0.92 0.31 114.58 112.32 1up4 h GLU 306 Ca -0.00 -0.43 -0.47 0.00 0.34 0.00 0.00 59.36 58.80 1up4 h GLU 306 Cb 0.75 0.16 0.08 0.00 -0.10 0.00 0.00 28.75 29.65 1up4 h GLU 306 CO 0.05 1.21 0.31 0.95 -1.16 0.00 0.00 179.01 180.36 1up4 s THR 307 N -2.46 2.39 -0.45 1.13 -4.23 -0.78 -4.68 115.64 106.56 1up4 s THR 307 Ca -0.18 -0.08 0.16 0.00 -1.18 0.00 0.00 61.69 60.40 1up4 s THR 307 Cb 0.03 -3.08 0.70 0.00 1.34 0.00 0.00 72.50 71.49 1up4 s THR 307 CO 0.78 -0.09 1.62 -0.67 -0.54 0.00 0.00 174.62 175.71 1up4 n ASP 308 N -3.05 4.91 0.25 3.99 2.03 -1.26 -1.54 116.55 121.87 1up4 n ASP 308 Ca 0.08 -2.81 -0.15 0.00 0.52 0.00 0.00 54.79 52.42 1up4 n ASP 308 Cb 0.60 -0.60 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1up4 n ASP 308 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1up4 h GLU 309 N 3.34 -0.58 -0.89 -0.67 5.08 -1.90 -3.47 114.58 115.49 1up4 h GLU 309 Ca 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1up4 h GLU 309 Cb 1.67 0.13 0.00 0.00 0.50 0.00 0.00 28.75 31.05 1up4 h GLU 309 CO 0.34 -0.33 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 1up4 n GLY 310 N -1.03 -0.69 3.04 -3.84 0.00 -1.24 -5.06 105.19 96.37 1up4 n GLY 310 Ca -0.11 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 1up4 n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1up4 s LYS 311 N -0.68 0.48 -0.12 1.61 -0.14 -0.58 -4.90 119.74 115.40 1up4 s LYS 311 Ca 0.00 -0.86 -0.20 0.00 -1.36 0.00 0.00 55.97 53.56 1up4 s LYS 311 Cb 0.00 0.02 -0.04 0.00 -1.68 0.00 0.00 37.83 36.13 1up4 s LYS 311 CO 0.00 -0.04 0.54 0.42 -0.76 0.00 0.00 175.35 175.51 1up4 s ILE 312 N -2.25 5.14 -0.02 2.17 -1.09 -1.26 0.05 121.20 123.93 1up4 s ILE 312 Ca -0.07 1.08 0.01 0.00 -2.23 0.00 0.00 60.65 59.44 1up4 s ILE 312 Cb -0.04 -3.88 0.02 0.00 -1.58 0.00 0.00 42.46 36.98 1up4 s ILE 312 CO -0.03 0.28 -0.03 -1.00 -1.23 0.00 0.00 174.94 172.93 1up4 s HIS 313 N 0.87 0.46 -0.29 3.97 3.76 -0.31 -4.92 115.29 118.83 1up4 s HIS 313 Ca 0.29 -0.08 -0.27 0.00 -0.15 0.00 0.00 55.06 54.84 1up4 s HIS 313 Cb -0.16 -0.43 0.01 0.00 1.11 0.00 0.00 32.58 33.11 1up4 s HIS 313 CO 0.12 -0.10 0.98 0.42 -0.85 0.00 0.00 174.74 175.30 1up4 s ILE 314 N 0.61 4.64 0.20 0.60 1.01 -1.26 -0.38 121.20 126.61 1up4 s ILE 314 Ca -0.07 1.64 -0.02 0.00 0.00 0.00 0.00 60.65 62.20 1up4 s ILE 314 Cb -0.10 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1up4 s ILE 314 CO -0.01 -0.33 0.15 0.68 0.00 0.00 0.00 174.94 175.43 1up4 s VAL 315 N 3.33 0.01 -0.30 2.92 -7.23 -0.27 -4.84 120.40 114.02 1up4 s VAL 315 Ca 0.41 -1.94 -0.16 0.00 -1.81 0.00 0.00 61.98 58.48 1up4 s VAL 315 Cb -0.13 -2.43 -0.02 0.00 0.56 0.00 0.00 36.38 34.36 1up4 s VAL 315 CO 0.12 -0.05 0.43 0.20 -0.31 0.00 0.00 175.10 175.50 1up4 s ASN 316 N -3.14 6.28 0.34 4.85 0.01 0.43 -1.22 114.94 122.50 1up4 s ASN 316 Ca 0.36 0.15 -0.16 0.00 -0.71 0.00 0.00 52.86 52.50 1up4 s ASN 316 Cb 0.06 -2.23 0.04 0.00 0.41 0.00 0.00 41.25 39.53 1up4 s ASN 316 CO 0.11 -0.30 0.73 0.28 -1.51 0.00 0.00 177.10 176.40 1up4 s THR 317 N 2.18 0.00 0.28 1.60 -1.32 -0.30 -2.50 115.64 115.58 1up4 s THR 317 Ca 0.16 -1.07 -0.30 0.00 -1.21 0.00 0.00 61.69 59.28 1up4 s THR 317 Cb -0.16 -2.54 -0.10 0.00 -1.51 0.00 0.00 72.50 68.18 1up4 s THR 317 CO 0.11 0.00 1.47 -0.13 -2.21 0.00 0.00 174.62 173.86 1up4 s ARG 318 N -2.97 4.22 0.18 7.08 0.52 -1.26 -0.27 118.95 126.45 1up4 s ARG 318 Ca 0.16 2.39 -0.25 0.00 -0.52 0.00 0.00 55.73 57.51 1up4 s ARG 318 Cb -0.05 -3.07 0.06 0.00 0.52 0.00 0.00 34.95 32.42 1up4 s ARG 318 CO 0.11 -0.46 1.56 -0.97 0.02 0.00 0.00 175.30 175.56 1up4 h ASN 319 N 4.58 -1.53 -6.97 0.23 -1.24 -0.34 -3.46 115.58 106.85 1up4 h ASN 319 Ca -0.47 0.26 -0.58 0.00 0.71 0.00 0.00 56.30 56.22 1up4 h ASN 319 Cb 1.22 0.71 -0.15 0.00 0.73 0.00 0.00 38.32 40.83 1up4 h ASN 319 CO 0.75 -0.32 -0.92 0.59 -1.29 0.00 0.00 177.43 176.25 1up4 n ASN 320 N -5.40 -0.26 0.00 1.15 5.03 -0.46 -1.30 115.26 114.02 1up4 n ASN 320 Ca 0.03 -1.21 0.00 0.00 0.87 0.00 0.00 54.58 54.27 1up4 n ASN 320 Cb 0.35 -1.49 0.00 0.00 -1.02 0.00 0.00 39.78 37.62 1up4 n ASN 320 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1up4 n GLY 321 N -2.38 1.46 0.25 7.41 0.00 -1.26 -4.90 105.19 105.76 1up4 n GLY 321 Ca -0.26 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 1up4 n GLY 321 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1up4 h SER 322 N 0.00 -0.66 -3.70 1.61 0.87 -1.35 -3.37 113.55 106.95 1up4 h SER 322 Ca 0.00 0.12 -0.68 0.00 -1.23 0.00 0.00 61.79 60.00 1up4 h SER 322 Cb 0.00 0.32 -0.32 0.00 -0.44 0.00 0.00 62.40 61.96 1up4 h SER 322 CO 0.00 -0.25 -0.70 -0.63 -0.53 0.00 0.00 176.83 174.72 1up4 s ILE 323 N -6.11 3.11 -0.50 2.23 -1.09 -1.26 -1.08 121.20 116.50 1up4 s ILE 323 Ca -0.15 -1.24 0.23 0.00 -2.23 0.00 0.00 60.65 57.27 1up4 s ILE 323 Cb 0.12 -2.73 0.24 0.00 -1.58 0.00 0.00 42.46 38.50 1up4 s ILE 323 CO 0.68 -0.04 1.70 -1.84 -1.23 0.00 0.00 174.94 174.21 1up4 n GLU 324 N 4.67 0.18 0.00 2.79 0.28 -0.63 -2.02 120.64 125.92 1up4 n GLU 324 Ca -0.14 0.42 0.14 0.00 -0.16 0.00 0.00 57.16 57.42 1up4 n GLU 324 Cb 0.44 -1.85 0.69 0.00 1.43 0.00 0.00 31.44 32.15 1up4 n GLU 324 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1up4 n ASN 325 N -2.20 0.00 -4.18 -1.84 3.02 -1.26 -4.87 115.26 103.93 1up4 n ASN 325 Ca 0.02 -0.04 -0.20 0.00 -0.03 0.00 0.00 54.58 54.34 1up4 n ASN 325 Cb 0.22 -0.31 -0.12 0.00 -0.61 0.00 0.00 39.78 38.96 1up4 n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1up4 s LEU 326 N -2.62 2.25 0.48 3.41 1.02 -0.85 -4.97 118.68 117.39 1up4 s LEU 326 Ca 0.25 -0.58 -0.23 0.00 0.02 0.00 0.00 54.13 53.59 1up4 s LEU 326 Cb 0.19 -0.60 -0.08 0.00 0.02 0.00 0.00 46.19 45.72 1up4 s LEU 326 CO 0.44 -0.02 1.22 -2.65 0.02 0.00 0.00 176.35 175.36 1up4 n PRO 327 N 1.46 1.65 -0.02 1.29 -0.02 -1.26 -4.84 135.00 133.25 1up4 n PRO 327 Ca -0.20 0.60 0.19 0.00 -2.02 0.00 0.00 63.50 62.07 1up4 n PRO 327 Cb 0.54 -2.37 0.66 0.00 -0.02 0.00 0.00 33.50 32.31 1up4 n PRO 327 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1up4 h ASP 328 N 1.60 0.06 0.36 2.55 3.32 -1.95 -2.96 116.42 119.40 1up4 h ASP 328 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1up4 h ASP 328 Cb 1.31 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1up4 h ASP 328 CO 0.57 0.03 -0.39 -0.90 -1.72 0.00 0.00 179.24 176.83 1up4 n ASP 329 N -4.40 0.78 -4.71 6.45 5.68 -1.26 -1.35 116.55 117.74 1up4 n ASP 329 Ca 0.10 -0.59 -0.42 0.00 -0.50 0.00 0.00 54.79 53.39 1up4 n ASP 329 Cb 0.59 0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.75 1up4 n ASP 329 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1up4 s TYR 330 N -2.75 2.80 -0.12 2.11 1.51 -1.12 -4.70 117.35 115.09 1up4 s TYR 330 Ca 0.17 0.32 -0.30 0.00 -1.01 0.00 0.00 57.07 56.26 1up4 s TYR 330 Cb 0.18 -4.11 -0.02 0.00 -0.11 0.00 0.00 41.96 37.90 1up4 s TYR 330 CO 0.62 -4.27 1.19 0.08 -1.11 0.00 0.00 175.55 172.05 1up4 s VAL 331 N 1.43 4.35 0.32 0.71 1.01 -1.26 -0.27 120.40 126.69 1up4 s VAL 331 Ca 0.75 1.65 0.09 0.00 0.00 0.00 0.00 61.98 64.47 1up4 s VAL 331 Cb -0.48 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 31.78 1up4 s VAL 331 CO 0.33 -0.07 -0.10 -0.76 0.00 0.00 0.00 175.10 174.49 1up4 s LEU 332 N 2.77 2.67 -0.41 3.92 1.43 0.63 -4.87 118.68 124.83 1up4 s LEU 332 Ca 0.54 -1.17 -0.15 0.00 -1.03 0.00 0.00 54.13 52.31 1up4 s LEU 332 Cb -0.22 -0.95 0.02 0.00 0.03 0.00 0.00 46.19 45.07 1up4 s LEU 332 CO 0.17 -0.20 0.32 -0.70 0.23 0.00 0.00 176.35 176.18 1up4 s GLU 333 N -3.62 3.04 0.06 1.70 2.12 0.44 -1.15 118.70 121.28 1up4 s GLU 333 Ca 0.32 -0.94 -0.09 0.00 0.36 0.00 0.00 54.97 54.62 1up4 s GLU 333 Cb 0.02 -3.96 -0.00 0.00 0.26 0.00 0.00 34.13 30.44 1up4 s GLU 333 CO 0.15 -0.75 0.18 0.96 -0.54 0.00 0.00 175.26 175.27 1up4 s ILE 334 N 1.77 0.13 0.11 -3.70 -4.36 -0.36 -3.52 121.20 111.27 1up4 s ILE 334 Ca 0.06 -1.05 -0.31 0.00 -0.26 0.00 0.00 60.65 59.10 1up4 s ILE 334 Cb -0.18 -1.09 -0.07 0.00 1.25 0.00 0.00 42.46 42.36 1up4 s ILE 334 CO 0.11 -0.58 1.32 -2.84 0.24 0.00 0.00 174.94 173.19 1up4 s PRO 335 N -3.11 4.37 0.13 0.37 0.02 -1.26 -1.11 135.00 134.41 1up4 s PRO 335 Ca -0.01 1.97 0.07 0.00 0.02 0.00 0.00 61.00 63.05 1up4 s PRO 335 Cb 0.02 -3.27 -0.04 0.00 0.02 0.00 0.00 34.50 31.22 1up4 s PRO 335 CO -0.07 -0.35 -0.16 0.00 -0.33 0.00 0.00 177.00 176.09 1up4 s TYR 337 N -1.98 3.31 -0.15 0.00 5.04 0.13 -1.16 117.35 122.55 1up4 s TYR 337 Ca 0.11 0.98 0.00 0.00 -2.44 0.00 0.00 57.07 55.72 1up4 s TYR 337 Cb -0.06 -2.93 -0.01 0.00 0.35 0.00 0.00 41.96 39.32 1up4 s TYR 337 CO 0.04 -0.33 -0.15 0.08 -1.34 0.00 0.00 175.55 173.86 1up4 s VAL 338 N 2.54 2.78 -0.29 3.14 1.01 0.11 -0.01 120.40 129.68 1up4 s VAL 338 Ca 0.31 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 1up4 s VAL 338 Cb -0.15 -2.17 0.13 0.00 0.00 0.00 0.00 36.38 34.18 1up4 s VAL 338 CO 0.08 0.52 0.87 -0.60 0.00 0.00 0.00 175.10 175.97 1up4 s ARG 339 N 0.69 0.49 -1.16 2.72 3.52 -0.50 -1.53 118.95 123.17 1up4 s ARG 339 Ca -0.07 0.89 -0.30 0.00 -0.13 0.00 0.00 55.73 56.12 1up4 s ARG 339 Cb -0.16 0.16 0.04 0.00 -1.56 0.00 0.00 34.95 33.44 1up4 s ARG 339 CO 0.02 -0.11 0.68 0.43 -0.81 0.00 0.00 175.30 175.51 1up4 n SER 340 N 4.09 -4.32 0.00 -2.12 7.64 -0.59 -1.27 113.62 117.05 1up4 n SER 340 Ca -0.18 -1.24 0.00 0.00 1.01 0.00 0.00 58.87 58.46 1up4 n SER 340 Cb 0.57 -1.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.00 1up4 n SER 340 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1up4 n GLY 341 N -2.02 0.77 3.38 0.23 0.00 0.11 -4.98 105.19 102.68 1up4 n GLY 341 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1up4 n GLY 341 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1up4 s ARG 342 N -0.16 1.71 -0.25 1.61 0.52 -0.39 -5.09 118.95 116.90 1up4 s ARG 342 Ca 0.00 -1.17 0.02 0.00 -0.52 0.00 0.00 55.73 54.06 1up4 s ARG 342 Cb 0.00 -1.98 0.06 0.00 0.52 0.00 0.00 34.95 33.55 1up4 s ARG 342 CO 0.00 0.50 -0.06 0.08 0.02 0.00 0.00 175.30 175.83 1up4 s VAL 343 N -0.91 1.80 -0.19 3.52 1.01 -1.26 -1.42 120.40 122.95 1up4 s VAL 343 Ca 0.13 -1.45 -0.09 0.00 0.00 0.00 0.00 61.98 60.57 1up4 s VAL 343 Cb -0.10 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 1up4 s VAL 343 CO 0.04 -0.12 0.10 -1.00 0.00 0.00 0.00 175.10 174.11 1up4 s HIS 344 N 1.26 3.32 0.52 5.22 3.76 0.99 -4.93 115.29 125.42 1up4 s HIS 344 Ca -0.06 0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 54.86 1up4 s HIS 344 Cb -0.19 -2.13 -0.07 0.00 1.11 0.00 0.00 32.58 31.30 1up4 s HIS 344 CO -0.06 0.19 1.00 0.95 -0.85 0.00 0.00 174.74 175.97 1up4 s THR 345 N 0.43 4.35 -0.04 1.30 -4.23 -1.26 0.21 115.64 116.40 1up4 s THR 345 Ca 0.05 1.17 0.00 0.00 -1.18 0.00 0.00 61.69 61.74 1up4 s THR 345 Cb -0.12 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 1up4 s THR 345 CO -0.00 -0.60 -0.02 -0.76 -0.54 0.00 0.00 174.62 172.70 1up4 s LEU 346 N -4.04 3.43 0.24 4.79 1.02 -1.25 -4.83 118.68 118.04 1up4 s LEU 346 Ca 0.60 0.02 -0.31 0.00 0.02 0.00 0.00 54.13 54.47 1up4 s LEU 346 Cb -0.11 -1.86 -0.14 0.00 0.02 0.00 0.00 46.19 44.10 1up4 s LEU 346 CO 0.30 0.33 1.31 -1.20 0.02 0.00 0.00 176.35 177.11 1up4 n SER 347 N 1.82 2.33 0.00 2.29 7.64 -1.26 -4.15 113.62 122.29 1up4 n SER 347 Ca -0.17 1.15 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1up4 n SER 347 Cb 0.53 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 1up4 n SER 347 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up4 n GLN 348 N 1.75 3.53 0.00 1.43 6.02 -0.24 -5.02 117.38 124.85 1up4 n GLN 348 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1up4 n GLN 348 Cb 0.30 -0.43 0.00 0.00 1.02 0.00 0.00 30.24 31.13 1up4 n GLN 348 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1up4 n GLY 349 N 0.81 -0.13 3.85 1.08 0.00 -1.23 -4.96 105.19 104.61 1up4 n GLY 349 Ca 0.00 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.37 1up4 n GLY 349 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1up4 s LYS 350 N 0.00 3.98 0.23 1.61 1.02 -1.26 -1.61 119.74 123.71 1up4 s LYS 350 Ca 0.00 0.53 -0.11 0.00 0.02 0.00 0.00 55.97 56.40 1up4 s LYS 350 Cb 0.00 -2.76 -0.07 0.00 -0.52 0.00 0.00 37.83 34.47 1up4 s LYS 350 CO 0.00 0.37 0.58 0.20 -0.92 0.00 0.00 175.35 175.57 1up4 s GLY 351 N -1.97 2.33 0.36 -3.33 0.00 -1.26 -4.96 107.32 98.49 1up4 s GLY 351 Ca 0.44 -0.20 -0.28 0.00 0.00 0.00 0.00 44.72 44.69 1up4 s GLY 351 CO 0.20 -0.02 1.33 -0.35 0.00 0.00 0.00 173.10 174.26 1up4 s ASP 352 N -2.22 6.55 0.41 1.64 -1.08 -1.26 -4.89 116.67 115.82 1up4 s ASP 352 Ca 0.47 2.73 0.11 0.00 -0.52 0.00 0.00 52.55 55.34 1up4 s ASP 352 Cb -0.12 -2.65 0.93 0.00 -1.46 0.00 0.00 42.92 39.62 1up4 s ASP 352 CO 0.20 -0.69 1.96 0.45 0.52 0.00 0.00 175.17 177.61 1up4 h HIS 353 N 3.08 0.57 0.13 -5.34 3.86 -1.98 -1.23 115.15 114.23 1up4 h HIS 353 Ca -0.49 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 58.72 1up4 h HIS 353 Cb 1.23 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 29.52 1up4 h HIS 353 CO 0.54 0.27 -0.06 0.35 0.86 0.00 0.00 177.93 179.89 1up4 h PHE 354 N 0.53 -0.16 -0.37 2.45 3.57 -1.98 -2.01 116.94 118.98 1up4 h PHE 354 Ca 0.31 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.85 1up4 h PHE 354 Cb 0.51 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 1up4 h PHE 354 CO -0.00 -0.05 0.14 0.00 -2.23 0.00 0.00 178.31 176.17 1up4 h ALA 355 N 0.64 0.43 -0.61 2.41 0.00 -1.82 -2.89 119.26 117.42 1up4 h ALA 355 Ca -0.02 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1up4 h ALA 355 Cb 0.18 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1up4 h ALA 355 CO 0.03 -0.25 0.38 -0.07 0.00 0.00 0.00 179.25 179.33 1up4 h LEU 356 N 0.30 0.72 -0.79 0.00 4.07 -1.04 -0.83 115.31 117.74 1up4 h LEU 356 Ca 0.17 -0.03 0.02 0.00 0.08 0.00 0.00 57.88 58.11 1up4 h LEU 356 Cb 0.13 -0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.65 1up4 h LEU 356 CO -0.16 0.55 0.51 0.77 -1.08 0.00 0.00 178.44 179.03 1up4 h SER 357 N 0.84 0.88 -0.13 -0.43 4.64 -1.14 0.19 113.55 118.40 1up4 h SER 357 Ca 0.22 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.48 1up4 h SER 357 Cb -0.05 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 61.83 1up4 h SER 357 CO -0.04 0.62 -0.10 -0.26 -0.87 0.00 0.00 176.83 176.18 1up4 h PHE 358 N 1.03 0.34 0.08 4.77 0.04 -1.40 -2.77 116.94 119.03 1up4 h PHE 358 Ca 0.30 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.97 1up4 h PHE 358 Cb -0.07 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.00 1up4 h PHE 358 CO -0.02 0.67 -0.07 0.82 -0.60 0.00 0.00 178.31 179.11 1up4 h ILE 359 N -0.08 0.84 -0.15 -0.55 2.04 -0.72 -2.05 117.51 116.83 1up4 h ILE 359 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1up4 h ILE 359 Cb 0.60 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.47 1up4 h ILE 359 CO 0.03 0.00 -0.13 0.45 0.00 0.00 0.00 178.15 178.50 1up4 h HIS 360 N -0.16 -0.31 -0.23 1.37 3.86 -1.09 -1.08 115.15 117.51 1up4 h HIS 360 Ca 0.00 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.28 1up4 h HIS 360 Cb 0.16 0.16 -0.04 0.00 1.06 0.00 0.00 27.41 28.74 1up4 h HIS 360 CO -0.10 -0.19 -0.06 0.00 0.86 0.00 0.00 177.93 178.44 1up4 h ALA 361 N 0.97 0.14 0.00 2.45 0.00 -1.18 -2.89 119.26 118.75 1up4 h ALA 361 Ca 0.10 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1up4 h ALA 361 Cb 0.28 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1up4 h ALA 361 CO -0.24 -0.48 -0.52 -0.39 0.00 0.00 0.00 179.25 177.62 1up4 h VAL 362 N -0.01 0.37 0.00 0.00 -1.51 -1.32 -2.31 116.25 111.46 1up4 h VAL 362 Ca 0.11 -1.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.02 1up4 h VAL 362 Cb 0.18 2.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1up4 h VAL 362 CO -0.24 0.21 0.00 1.17 -1.23 0.00 0.00 177.57 177.48 1up4 n LYS 363 N -3.05 0.17 0.00 5.19 3.00 -0.42 -0.12 118.16 122.93 1up4 n LYS 363 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1up4 n LYS 363 Cb 0.65 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 34.36 1up4 n LYS 363 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1up4 n TYR 365 N 0.77 0.00 -0.12 5.64 9.36 -0.87 -1.52 117.16 130.41 1up4 n TYR 365 Ca 0.00 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.13 1up4 n TYR 365 Cb 0.07 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 38.77 1up4 n TYR 365 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1up4 h GLU 366 N 0.00 0.54 -0.03 2.98 5.08 -0.82 -1.08 114.58 121.26 1up4 h GLU 366 Ca 0.00 -0.08 -0.16 0.00 -1.00 0.00 0.00 59.36 58.11 1up4 h GLU 366 Cb 0.00 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1up4 h GLU 366 CO 0.00 0.49 -0.72 0.00 -1.00 0.00 0.00 179.01 177.78 1up4 h ARG 367 N 0.46 0.16 -0.72 2.33 3.08 -1.54 -2.09 114.38 116.06 1up4 h ARG 367 Ca 0.13 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1up4 h ARG 367 Cb 0.13 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 1up4 h ARG 367 CO -0.02 0.81 0.25 -0.07 -1.07 0.00 0.00 179.97 179.87 1up4 h LEU 368 N 0.11 1.02 -0.24 3.04 3.38 -1.76 -0.30 115.31 120.55 1up4 h LEU 368 Ca -0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1up4 h LEU 368 Cb 1.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1up4 h LEU 368 CO 0.11 0.93 0.06 0.74 0.09 0.00 0.00 178.44 180.37 1up4 h THR 369 N 1.06 1.21 -0.45 0.22 2.02 -0.96 -1.50 112.91 114.52 1up4 h THR 369 Ca 0.24 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1up4 h THR 369 Cb 0.26 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1up4 h THR 369 CO -0.01 0.21 0.28 0.40 0.37 0.00 0.00 175.52 176.78 1up4 h ILE 370 N 0.21 1.13 -0.63 3.11 2.04 -1.21 -1.79 117.51 120.37 1up4 h ILE 370 Ca 0.08 -0.26 0.07 0.00 1.00 0.00 0.00 64.86 65.75 1up4 h ILE 370 Cb 0.27 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 36.79 1up4 h ILE 370 CO 0.00 0.13 0.31 -0.33 0.00 0.00 0.00 178.15 178.25 1up4 h GLU 371 N 0.60 0.55 -0.72 2.37 5.08 -0.94 0.64 114.58 122.15 1up4 h GLU 371 Ca 0.16 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1up4 h GLU 371 Cb -0.04 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.04 1up4 h GLU 371 CO -0.03 0.36 0.44 0.00 -1.00 0.00 0.00 179.01 178.78 1up4 h ALA 372 N 1.36 0.96 -0.12 3.43 0.00 -0.90 -2.01 119.26 121.99 1up4 h ALA 372 Ca 0.29 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1up4 h ALA 372 Cb 0.26 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1up4 h ALA 372 CO -0.22 0.19 -0.01 -0.92 0.00 0.00 0.00 179.25 178.29 1up4 h TYR 373 N 0.84 0.24 -0.22 0.00 3.20 -0.55 -0.04 116.97 120.44 1up4 h TYR 373 Ca 0.30 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 1up4 h TYR 373 Cb 0.08 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 1up4 h TYR 373 CO -0.05 0.47 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.81 1up4 h LEU 374 N -0.06 0.32 -1.25 2.82 3.38 -0.69 -0.75 115.31 119.08 1up4 h LEU 374 Ca 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1up4 h LEU 374 Cb 0.38 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1up4 h LEU 374 CO 0.01 0.42 -0.04 0.29 0.09 0.00 0.00 178.44 179.21 1up4 n LYS 375 N -4.30 1.81 -3.99 1.13 5.02 -0.77 -4.96 118.16 112.10 1up4 n LYS 375 Ca 0.00 -1.25 -0.27 0.00 -2.02 0.00 0.00 58.31 54.76 1up4 n LYS 375 Cb 0.24 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.76 1up4 n LYS 375 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1up4 n ARG 376 N 0.50 -3.48 -4.13 1.97 1.74 -0.19 -4.91 116.66 108.16 1up4 n ARG 376 Ca 0.16 0.42 -0.34 0.00 -0.77 0.00 0.00 57.85 57.32 1up4 n ARG 376 Cb 0.44 -4.71 -0.15 0.00 -1.02 0.00 0.00 32.46 27.02 1up4 n ARG 376 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1up4 s SER 377 N -4.13 3.90 0.11 0.55 0.15 -0.29 -0.49 113.70 113.51 1up4 s SER 377 Ca 0.17 -0.46 -0.21 0.00 0.70 0.00 0.00 55.95 56.15 1up4 s SER 377 Cb -0.09 -1.64 -0.10 0.00 -1.71 0.00 0.00 66.02 62.48 1up4 s SER 377 CO 0.89 0.02 1.76 0.50 1.20 0.00 0.00 173.24 177.61 1up4 h LYS 378 N 7.81 0.17 -0.30 5.44 3.64 -1.84 -1.71 116.57 129.78 1up4 h LYS 378 Ca -0.40 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1up4 h LYS 378 Cb 1.16 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.87 1up4 h LYS 378 CO 0.60 0.12 -0.28 0.87 -2.27 0.00 0.00 179.45 178.49 1up4 h LYS 379 N 0.18 -0.25 -0.04 1.90 1.57 -1.94 -1.55 116.57 116.43 1up4 h LYS 379 Ca 0.05 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1up4 h LYS 379 Cb -0.02 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1up4 h LYS 379 CO -0.01 -0.17 -0.32 -0.07 -0.57 0.00 0.00 179.45 178.32 1up4 h LEU 380 N -0.26 0.08 -0.65 2.94 3.38 -1.91 -2.37 115.31 116.52 1up4 h LEU 380 Ca 0.15 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1up4 h LEU 380 Cb 0.51 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1up4 h LEU 380 CO -0.45 0.39 0.31 0.00 0.09 0.00 0.00 178.44 178.78 1up4 h ALA 381 N 1.61 0.84 -0.32 1.53 0.00 -0.37 0.23 119.26 122.78 1up4 h ALA 381 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1up4 h ALA 381 Cb 0.60 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1up4 h ALA 381 CO 0.04 0.40 0.21 -0.07 0.00 0.00 0.00 179.25 179.84 1up4 h LEU 382 N 0.90 0.37 -0.50 0.00 4.07 -0.92 0.14 115.31 119.36 1up4 h LEU 382 Ca 0.22 -0.01 0.08 0.00 0.08 0.00 0.00 57.88 58.25 1up4 h LEU 382 Cb 0.13 -0.09 -0.06 0.00 1.08 0.00 0.00 40.66 41.71 1up4 h LEU 382 CO -0.03 0.27 0.14 0.50 -1.08 0.00 0.00 178.44 178.24 1up4 h LYS 383 N 0.43 0.28 -0.09 1.13 3.64 -1.13 0.14 116.57 120.97 1up4 h LYS 383 Ca 0.12 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1up4 h LYS 383 Cb -0.05 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1up4 h LYS 383 CO -0.02 0.19 0.01 0.00 -2.27 0.00 0.00 179.45 177.35 1up4 h ALA 384 N 1.36 0.13 -0.48 5.00 0.00 -0.45 -2.78 119.26 122.05 1up4 h ALA 384 Ca 0.25 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1up4 h ALA 384 Cb 0.30 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.98 1up4 h ALA 384 CO -0.29 -0.22 0.01 1.25 0.00 0.00 0.00 179.25 180.01 1up4 h LEU 385 N -0.09 -0.17 -2.49 0.00 5.85 -0.45 -1.28 115.31 116.68 1up4 h LEU 385 Ca 0.03 0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1up4 h LEU 385 Cb 0.30 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1up4 h LEU 385 CO 0.00 -0.05 0.05 -0.07 -0.34 0.00 0.00 178.44 178.02 1up4 h LEU 386 N 0.13 0.00 0.00 2.25 3.38 -0.61 -3.04 115.31 117.41 1up4 h LEU 386 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1up4 h LEU 386 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1up4 h LEU 386 CO -0.39 0.00 -0.33 -1.54 0.09 0.00 0.00 178.44 176.27 1up4 n SER 387 N -3.71 0.59 -4.72 -0.43 3.41 -0.49 -4.84 113.62 103.44 1up4 n SER 387 Ca -0.02 0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 58.42 1up4 n SER 387 Cb 0.13 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 1up4 n SER 387 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1up4 s HIS 388 N -3.10 3.62 0.60 7.33 5.04 -1.15 -4.73 115.29 122.90 1up4 s HIS 388 Ca 0.09 1.60 0.28 0.00 -1.54 0.00 0.00 55.06 55.49 1up4 s HIS 388 Cb 0.15 -3.21 1.38 0.00 0.04 0.00 0.00 32.58 30.94 1up4 s HIS 388 CO 0.65 -0.40 1.79 -1.35 -2.34 0.00 0.00 174.74 173.09 1up4 h PRO 389 N 6.31 0.00 -0.29 2.88 0.11 -1.89 0.24 132.00 139.35 1up4 h PRO 389 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1up4 h PRO 389 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1up4 h PRO 389 CO 0.76 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.83 1up4 n LEU 390 N -3.53 3.88 0.00 2.35 4.77 -1.26 -5.03 117.00 118.18 1up4 n LEU 390 Ca 0.10 -2.88 -0.17 0.00 -0.03 0.00 0.00 56.01 53.02 1up4 n LEU 390 Cb 0.78 -0.52 0.11 0.00 -2.33 0.00 0.00 43.42 41.47 1up4 n LEU 390 CO 0.25 0.68 0.50 0.61 -1.33 0.00 0.00 177.39 178.10 1up4 n GLY 391 N -0.31 -0.83 3.82 -0.72 0.00 0.85 -4.53 105.19 103.47 1up4 n GLY 391 Ca 0.21 -1.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 1up4 n GLY 391 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1up4 s PRO 392 N -4.64 3.70 0.70 1.61 0.04 -1.26 -5.01 135.00 130.14 1up4 s PRO 392 Ca 0.46 1.13 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 1up4 s PRO 392 Cb -0.02 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.46 1up4 s PRO 392 CO 0.32 -0.49 1.13 -0.51 0.04 0.00 0.00 177.00 177.48 1up4 s ASP 393 N -2.71 4.71 0.32 6.66 1.11 -1.26 -4.70 116.67 120.80 1up4 s ASP 393 Ca 0.62 2.06 0.09 0.00 0.18 0.00 0.00 52.55 55.50 1up4 s ASP 393 Cb -0.13 -2.56 0.95 0.00 1.07 0.00 0.00 42.92 42.25 1up4 s ASP 393 CO 0.30 -1.90 1.61 0.58 1.18 0.00 0.00 175.17 176.94 1up4 h VAL 394 N -0.31 0.15 0.00 -1.27 2.07 -1.98 0.86 116.25 115.77 1up4 h VAL 394 Ca -0.46 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1up4 h VAL 394 Cb 1.26 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1up4 h VAL 394 CO 0.52 0.02 -0.05 1.05 0.02 0.00 0.00 177.57 179.14 1up4 h GLU 395 N 0.12 0.00 0.00 1.57 4.11 -2.04 -3.14 114.58 115.20 1up4 h GLU 395 Ca 0.67 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.10 1up4 h GLU 395 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1up4 h GLU 395 CO -0.75 0.05 -1.09 -0.25 0.07 0.00 0.00 179.01 177.04 1up4 n ASP 396 N -3.44 1.52 0.03 3.06 8.00 0.23 -4.77 116.55 121.18 1up4 n ASP 396 Ca -0.02 -0.34 -0.10 0.00 0.71 0.00 0.00 54.79 55.03 1up4 n ASP 396 Cb 0.17 1.30 -0.04 0.00 -0.02 0.00 0.00 41.12 42.52 1up4 n ASP 396 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up4 h ALA 397 N 1.31 -0.08 -0.05 2.24 0.00 -1.31 -1.24 119.26 120.12 1up4 h ALA 397 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1up4 h ALA 397 Cb 0.42 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1up4 h ALA 397 CO 0.00 -0.59 0.03 -0.22 0.00 0.00 0.00 179.25 178.47 1up4 h LYS 398 N -0.17 0.07 -0.67 0.00 3.64 -1.86 -0.09 116.57 117.49 1up4 h LYS 398 Ca 0.06 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1up4 h LYS 398 Cb 0.25 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1up4 h LYS 398 CO -0.15 0.11 0.33 -0.44 -2.27 0.00 0.00 179.45 177.03 1up4 h ASP 399 N 0.00 0.88 -0.16 4.20 5.19 -1.87 -1.85 116.42 122.82 1up4 h ASP 399 Ca 0.02 -0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1up4 h ASP 399 Cb 0.06 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 1up4 h ASP 399 CO -0.00 0.76 0.09 0.25 -3.12 0.00 0.00 179.24 177.21 1up4 h LEU 400 N 0.93 0.20 -0.47 1.55 5.85 -0.93 -1.91 115.31 120.53 1up4 h LEU 400 Ca 0.23 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1up4 h LEU 400 Cb 0.11 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1up4 h LEU 400 CO -0.03 0.22 0.30 0.25 -0.34 0.00 0.00 178.44 178.85 1up4 h LEU 401 N 0.15 0.55 -1.16 2.25 5.85 -0.90 -1.06 115.31 120.99 1up4 h LEU 401 Ca 0.06 -0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1up4 h LEU 401 Cb 0.07 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1up4 h LEU 401 CO -0.01 0.41 0.58 -0.33 -0.34 0.00 0.00 178.44 178.75 1up4 h GLU 402 N 0.64 1.00 -0.45 1.25 3.07 -1.17 -0.05 114.58 118.86 1up4 h GLU 402 Ca 0.17 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.90 1up4 h GLU 402 Cb -0.05 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.62 1up4 h GLU 402 CO -0.04 0.66 -0.01 1.49 -1.40 0.00 0.00 179.01 179.72 1up4 h GLU 403 N 1.03 0.80 -0.32 2.33 4.81 -0.71 -1.75 114.58 120.76 1up4 h GLU 403 Ca 0.38 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1up4 h GLU 403 Cb 0.16 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1up4 h GLU 403 CO -0.13 0.87 0.04 0.82 -0.73 0.00 0.00 179.01 179.88 1up4 h ILE 404 N 0.65 1.24 -0.61 2.32 2.04 -0.18 -2.10 117.51 120.86 1up4 h ILE 404 Ca 0.13 -0.85 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 1up4 h ILE 404 Cb 0.51 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1up4 h ILE 404 CO 0.02 0.28 0.07 -0.07 0.00 0.00 0.00 178.15 178.45 1up4 h LEU 405 N 0.37 0.98 -0.53 1.44 3.38 -1.03 -0.96 115.31 118.95 1up4 h LEU 405 Ca 0.10 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1up4 h LEU 405 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1up4 h LEU 405 CO 0.01 0.99 0.13 -0.33 0.09 0.00 0.00 178.44 179.33 1up4 h GLU 406 N 0.95 0.85 -0.44 1.13 5.08 -1.28 -1.67 114.58 119.20 1up4 h GLU 406 Ca 0.18 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1up4 h GLU 406 Cb 0.45 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1up4 h GLU 406 CO 0.02 0.81 0.13 0.00 -1.00 0.00 0.00 179.01 178.96 1up4 h ALA 407 N 1.00 1.41 -0.49 3.43 0.00 -0.98 -2.84 119.26 120.80 1up4 h ALA 407 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1up4 h ALA 407 Cb 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1up4 h ALA 407 CO 0.00 0.43 0.00 0.09 0.00 0.00 0.00 179.25 179.78 1up4 n ASN 408 N -4.33 4.94 -0.33 0.00 3.02 -0.40 -4.70 115.26 113.45 1up4 n ASN 408 Ca 0.03 -2.85 0.18 0.00 -0.03 0.00 0.00 54.58 51.91 1up4 n ASN 408 Cb 0.18 -0.61 0.35 0.00 -0.61 0.00 0.00 39.78 39.09 1up4 n ASN 408 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1up4 n ARG 409 N 0.36 -0.07 0.00 3.52 1.74 -0.65 -0.41 116.66 121.15 1up4 n ARG 409 Ca 0.25 1.45 0.12 0.00 -0.77 0.00 0.00 57.85 58.90 1up4 n ARG 409 Cb 1.03 -2.36 0.60 0.00 -1.02 0.00 0.00 32.46 30.72 1up4 n ARG 409 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1up4 n GLU 410 N -5.42 0.24 -0.00 5.56 4.71 -1.26 -3.90 120.64 120.57 1up4 n GLU 410 Ca 0.26 0.06 -0.00 0.00 -0.01 0.00 0.00 57.16 57.46 1up4 n GLU 410 Cb 0.86 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 29.79 1up4 n GLU 410 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1up4 n TYR 411 N -1.36 0.00 -3.76 -0.32 4.01 0.46 -5.04 117.16 111.14 1up4 n TYR 411 Ca 0.10 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.71 1up4 n TYR 411 Cb 0.23 -0.01 -0.12 0.00 -0.31 0.00 0.00 39.34 39.14 1up4 n TYR 411 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1up4 s VAL 412 N -2.00 -0.01 -0.16 -0.72 0.11 -0.72 -4.86 120.40 112.03 1up4 s VAL 412 Ca -0.00 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.09 1up4 s VAL 412 Cb 0.00 -0.39 0.02 0.00 -1.53 0.00 0.00 36.38 34.48 1up4 s VAL 412 CO 0.01 0.02 -0.15 -0.75 -3.33 0.00 0.00 175.10 170.89 1up4 s LYS 413 N 0.47 2.43 -0.08 1.54 2.20 -1.26 -4.38 119.74 120.66 1up4 s LYS 413 Ca -0.03 -0.66 0.01 0.00 -0.36 0.00 0.00 55.97 54.93 1up4 s LYS 413 Cb -0.04 -2.26 -0.03 0.00 -1.51 0.00 0.00 37.83 33.99 1up4 s LYS 413 CO -0.02 -0.25 -0.09 -0.51 -0.36 0.00 0.00 175.35 174.12 1up4 s LEU 414 N 1.43 3.05 0.00 5.43 1.02 -1.26 -4.91 118.68 123.43 1up4 s LEU 414 Ca 0.04 -0.11 0.25 0.00 0.02 0.00 0.00 54.13 54.34 1up4 s LEU 414 Cb -0.13 -1.67 0.50 0.00 0.02 0.00 0.00 46.19 44.91 1up4 s LEU 414 CO -0.11 0.31 1.44 0.61 0.02 0.00 0.00 176.35 178.61