#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1spi s ALA 12 N 0.00 2.22 0.00 7.82 0.00 -1.26 -4.85 121.76 125.69 1spi s ALA 12 Ca 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.07 1spi s ALA 12 Cb 0.00 -4.54 0.00 0.00 0.00 0.00 0.00 23.12 18.58 1spi s ALA 12 CO 0.00 -4.17 0.00 2.89 0.00 0.00 0.00 175.76 174.48 1spi n ARG 13 N 8.88 0.00 -0.20 0.00 1.85 -1.26 -2.83 116.66 123.10 1spi n ARG 13 Ca 0.36 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 57.19 1spi n ARG 13 Cb 0.49 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 31.90 1spi n ARG 13 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1spi n THR 14 N 0.00 -0.30 -1.38 8.89 -2.24 -1.26 -4.71 114.28 113.28 1spi n THR 14 Ca 0.00 1.22 0.00 0.00 -2.27 0.00 0.00 64.05 63.00 1spi n THR 14 Cb 0.00 -1.57 0.00 0.00 -2.10 0.00 0.00 70.33 66.66 1spi n THR 14 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1spi n ARG 15 N -4.72 0.00 -0.31 -0.78 3.00 -1.13 -2.26 116.66 110.46 1spi n ARG 15 Ca 0.04 0.00 0.30 0.00 -0.00 0.00 0.00 57.85 58.18 1spi n ARG 15 Cb 0.18 0.00 0.46 0.00 0.00 0.00 0.00 32.46 33.10 1spi n ARG 15 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1spi n SER 16 N -0.39 0.00 -0.65 6.15 7.64 -1.26 -1.57 113.62 123.54 1spi n SER 16 Ca 0.00 0.67 0.50 0.00 1.01 0.00 0.00 58.87 61.05 1spi n SER 16 Cb 0.00 -0.27 0.79 0.00 -1.01 0.00 0.00 64.21 63.71 1spi n SER 16 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1spi h LYS 17 N 0.00 0.00 0.00 1.43 6.56 -1.80 0.38 116.57 123.14 1spi h LYS 17 Ca 0.52 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 60.08 1spi h LYS 17 Cb 2.59 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 34.24 1spi h LYS 17 CO -0.01 0.00 -1.02 0.10 -2.06 0.00 0.00 179.45 176.46 1spi h TYR 18 N 0.00 0.00 0.00 -1.35 -0.00 -1.54 -3.44 116.97 110.64 1spi h TYR 18 Ca 0.93 0.00 -0.55 0.00 -0.00 0.00 0.00 58.73 59.11 1spi h TYR 18 Cb 3.53 0.00 0.11 0.00 -0.00 0.00 0.00 36.73 40.37 1spi h TYR 18 CO -0.00 0.12 1.61 -0.85 -0.00 0.00 0.00 178.16 179.04 1spi n GLU 19 N -2.75 0.44 -3.44 0.10 0.00 0.13 -4.52 120.64 110.61 1spi n GLU 19 Ca -0.02 -1.19 0.01 0.00 0.00 0.00 0.00 57.16 55.97 1spi n GLU 19 Cb 0.61 -2.56 -0.03 0.00 0.00 0.00 0.00 31.44 29.46 1spi n GLU 19 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.13 178.09 1spi s ILE 20 N 6.22 -0.99 -0.12 3.84 -4.36 -1.26 -5.01 121.20 119.51 1spi s ILE 20 Ca 0.59 0.00 -0.05 0.00 -0.26 0.00 0.00 60.65 60.94 1spi s ILE 20 Cb 0.13 -1.00 0.01 0.00 1.25 0.00 0.00 42.46 42.85 1spi s ILE 20 CO 0.25 -0.00 0.17 1.21 0.24 0.00 0.00 174.94 176.81 1spi n GLU 21 N 5.44 -0.68 0.00 0.37 4.07 -1.26 -4.70 120.64 123.88 1spi n GLU 21 Ca -0.07 0.96 0.00 0.00 -0.06 0.00 0.00 57.16 57.99 1spi n GLU 21 Cb 0.50 -2.68 0.00 0.00 -0.06 0.00 0.00 31.44 29.19 1spi n GLU 21 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1spi n THR 22 N -0.44 0.00 0.00 6.31 5.66 -1.26 -3.86 114.28 120.69 1spi n THR 22 Ca 0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.03 1spi n THR 22 Cb 0.13 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 1spi n THR 22 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1spi n LEU 23 N 0.00 0.00 0.26 1.09 0.00 0.19 -2.75 117.00 115.79 1spi n LEU 23 Ca 0.00 0.88 0.16 0.00 0.00 0.00 0.00 56.01 57.04 1spi n LEU 23 Cb 0.00 -0.38 0.71 0.00 0.00 0.00 0.00 43.42 43.75 1spi n LEU 23 CO 0.00 -0.38 1.13 0.71 0.00 0.00 0.00 177.39 178.86 1spi h THR 24 N 0.00 0.09 0.39 1.96 1.35 -1.92 0.58 112.91 115.36 1spi h THR 24 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.84 1spi h THR 24 Cb 0.00 0.58 0.00 0.00 -1.73 0.00 0.00 68.15 67.00 1spi h THR 24 CO 0.00 0.00 -0.18 1.23 -0.25 0.00 0.00 175.52 176.32 1spi h GLY 25 N 0.00 -0.54 0.77 5.82 0.00 -1.82 -1.78 103.07 105.52 1spi h GLY 25 Ca 0.06 0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 1spi h GLY 25 CO -0.00 -0.20 -0.11 1.49 0.00 0.00 0.00 176.54 177.72 1spi h TRP 26 N -0.72 -0.29 -0.72 5.60 -0.00 0.31 -1.63 115.95 118.49 1spi h TRP 26 Ca -0.05 -0.01 0.21 0.00 -0.00 0.00 0.00 58.89 59.04 1spi h TRP 26 Cb 0.50 0.09 -0.03 0.00 -0.00 0.00 0.00 29.16 29.73 1spi h TRP 26 CO -0.00 -0.01 0.67 -0.07 -0.00 0.00 0.00 178.44 179.02 1spi h LEU 27 N -0.54 0.00 0.00 -4.49 3.38 -1.26 1.23 115.31 113.62 1spi h LEU 27 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1spi h LEU 27 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1spi h LEU 27 CO 0.05 0.00 -1.06 0.18 0.09 0.00 0.00 178.44 177.70 1spi n LEU 28 N -3.79 0.76 -0.06 1.67 4.77 -0.67 -3.81 117.00 115.87 1spi n LEU 28 Ca 0.15 0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 1spi n LEU 28 Cb 0.93 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.93 1spi n LEU 28 CO 0.31 -0.15 0.43 0.50 -1.33 0.00 0.00 177.39 177.14 1spi h LYS 29 N 0.00 0.81 0.16 3.23 3.64 0.23 -2.92 116.57 121.72 1spi h LYS 29 Ca 0.00 -0.53 0.01 0.00 -1.27 0.00 0.00 60.65 58.86 1spi h LYS 29 Cb 0.97 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.83 1spi h LYS 29 CO 0.00 1.16 -0.26 1.96 -2.27 0.00 0.00 179.45 180.04 1spi h GLN 30 N 0.62 -0.47 -0.35 1.90 1.08 -0.71 1.14 115.11 118.32 1spi h GLN 30 Ca 0.01 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 1spi h GLN 30 Cb 1.17 0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 28.69 1spi h GLN 30 CO 0.12 -0.31 0.17 -1.00 -0.95 0.00 0.00 178.83 176.86 1spi h PRO 31 N -0.49 0.50 -0.24 1.46 0.13 -1.71 2.28 132.00 133.94 1spi h PRO 31 Ca 0.02 -0.07 0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1spi h PRO 31 Cb 0.49 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.52 1spi h PRO 31 CO -0.12 0.44 0.16 1.98 -0.23 0.00 0.00 178.00 180.23 1spi h MET 32 N 0.43 0.18 -0.61 0.86 1.85 -1.27 0.26 114.93 116.63 1spi h MET 32 Ca 0.12 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.20 1spi h MET 32 Cb 0.10 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 32.09 1spi h MET 32 CO -0.02 0.12 0.00 0.00 -0.40 0.00 0.00 176.91 176.61 1spi n ALA 33 N -2.53 2.48 -2.58 0.39 0.00 0.39 -4.69 120.51 113.96 1spi n ALA 33 Ca 0.02 -1.35 -0.02 0.00 0.00 0.00 0.00 53.44 52.09 1spi n ALA 33 Cb 0.18 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1spi n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1spi n GLY 34 N 1.20 -1.04 0.76 0.00 0.00 0.74 -4.94 105.19 101.91 1spi n GLY 34 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1spi n GLY 34 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1spi n VAL 35 N -0.28 0.00 -1.44 1.61 3.14 0.72 -4.72 118.33 117.35 1spi n VAL 35 Ca -0.18 0.00 -0.51 0.00 -2.96 0.00 0.00 64.34 60.69 1spi n VAL 35 Cb 0.56 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.30 1spi n VAL 35 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1spi n ILE 36 N -0.44 1.39 -1.54 1.55 5.41 -1.26 -4.60 119.36 119.88 1spi n ILE 36 Ca 0.00 -0.35 -0.35 0.00 1.00 0.00 0.00 62.75 63.05 1spi n ILE 36 Cb 0.08 -0.08 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 1spi n ILE 36 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1spi n ASP 37 N 1.83 1.85 0.23 4.38 -0.08 -1.26 -4.70 116.55 118.80 1spi n ASP 37 Ca 0.18 -0.48 0.01 0.00 -1.51 0.00 0.00 54.79 53.00 1spi n ASP 37 Cb 0.21 -1.46 0.07 0.00 2.34 0.00 0.00 41.12 42.27 1spi n ASP 37 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1spi h ALA 38 N 17.61 1.65 -0.04 -1.67 0.00 -2.00 0.12 119.26 134.94 1spi h ALA 38 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1spi h ALA 38 Cb 1.25 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1spi h ALA 38 CO 1.20 -0.65 -0.66 1.05 0.00 0.00 0.00 179.25 180.19 1spi h GLU 39 N 0.00 0.16 -0.31 0.00 4.11 -1.95 -2.90 114.58 113.68 1spi h GLU 39 Ca 0.00 -0.12 0.09 0.00 0.07 0.00 0.00 59.36 59.40 1spi h GLU 39 Cb 1.58 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.84 1spi h GLU 39 CO 0.00 0.76 0.24 1.25 0.07 0.00 0.00 179.01 181.33 1spi h LEU 40 N 0.11 0.00 -0.00 3.06 5.85 -1.10 0.39 115.31 123.62 1spi h LEU 40 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1spi h LEU 40 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1spi h LEU 40 CO 0.10 0.00 0.00 0.74 -0.34 0.00 0.00 178.44 178.94 1spi h THR 41 N 0.00 0.00 0.04 1.05 2.02 -1.67 -0.32 112.91 114.02 1spi h THR 41 Ca 0.15 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 1spi h THR 41 Cb 0.64 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1spi h THR 41 CO -0.00 0.00 -0.02 0.16 0.37 0.00 0.00 175.52 176.03 1spi h ILE 42 N 0.00 0.96 -0.49 3.11 -0.00 -0.30 -3.13 117.51 117.65 1spi h ILE 42 Ca 0.00 -1.61 -0.07 0.00 -0.00 0.00 0.00 64.86 63.18 1spi h ILE 42 Cb 0.91 1.77 -0.02 0.00 -0.00 0.00 0.00 36.82 39.48 1spi h ILE 42 CO 0.00 0.31 0.02 0.58 -0.00 0.00 0.00 178.15 179.06 1spi h VAL 43 N -0.97 1.24 0.00 0.16 2.07 -1.51 0.29 116.25 117.52 1spi h VAL 43 Ca -0.00 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1spi h VAL 43 Cb 0.54 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1spi h VAL 43 CO 0.01 0.35 0.00 -0.11 0.02 0.00 0.00 177.57 177.83 1spi n LEU 44 N -4.22 0.00 -0.13 2.57 7.94 -0.13 -1.24 117.00 121.78 1spi n LEU 44 Ca 0.03 0.33 -0.25 0.00 -1.11 0.00 0.00 56.01 55.01 1spi n LEU 44 Cb 0.29 -0.33 -0.10 0.00 0.53 0.00 0.00 43.42 43.80 1spi n LEU 44 CO 0.41 -0.23 -1.39 -1.20 -1.11 0.00 0.00 177.39 173.87 1spi n SER 45 N -1.33 1.95 0.04 1.96 7.64 0.19 -3.91 113.62 120.16 1spi n SER 45 Ca 0.04 0.16 0.04 0.00 1.01 0.00 0.00 58.87 60.12 1spi n SER 45 Cb 0.08 -0.65 0.18 0.00 -1.01 0.00 0.00 64.21 62.81 1spi n SER 45 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1spi n SER 46 N -3.86 0.16 0.06 6.43 7.64 0.77 0.17 113.62 124.99 1spi n SER 46 Ca -0.50 0.57 -0.22 0.00 1.01 0.00 0.00 58.87 59.73 1spi n SER 46 Cb 0.91 -0.59 -0.15 0.00 -1.01 0.00 0.00 64.21 63.37 1spi n SER 46 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1spi h ILE 47 N 0.00 1.14 -0.85 0.44 2.04 -1.35 -1.36 117.51 117.56 1spi h ILE 47 Ca 0.00 -2.52 0.07 0.00 1.00 0.00 0.00 64.86 63.41 1spi h ILE 47 Cb 0.02 2.88 -0.06 0.00 -0.74 0.00 0.00 36.82 38.93 1spi h ILE 47 CO 0.00 0.77 0.56 0.77 0.00 0.00 0.00 178.15 180.25 1spi h SER 48 N -0.11 0.82 0.18 1.72 4.64 -0.39 -1.42 113.55 118.99 1spi h SER 48 Ca -0.28 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 1spi h SER 48 Cb 1.92 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 1spi h SER 48 CO 0.15 0.52 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.48 1spi h LEU 49 N 0.93 -0.20 -1.41 5.97 3.38 -1.55 -2.40 115.31 120.02 1spi h LEU 49 Ca 0.37 0.01 0.45 0.00 0.09 0.00 0.00 57.88 58.80 1spi h LEU 49 Cb 0.25 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 40.95 1spi h LEU 49 CO -0.14 0.03 0.97 0.00 0.09 0.00 0.00 178.44 179.39 1spi n ALA 50 N -2.40 1.38 -0.06 1.53 0.00 -0.51 0.90 120.51 121.35 1spi n ALA 50 Ca -0.03 0.66 -0.13 0.00 0.00 0.00 0.00 53.44 53.94 1spi n ALA 50 Cb 0.09 -0.94 -0.12 0.00 0.00 0.00 0.00 19.45 18.49 1spi n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1spi h LYS 52 N -0.98 0.39 0.30 0.00 3.64 0.11 0.25 116.57 120.27 1spi h LYS 52 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1spi h LYS 52 Cb 0.89 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1spi h LYS 52 CO 0.00 0.26 -0.14 1.96 -2.27 0.00 0.00 179.45 179.26 1spi h GLN 53 N 0.40 -0.38 -0.41 1.90 1.08 -1.40 -2.79 115.11 113.52 1spi h GLN 53 Ca 0.59 0.03 0.12 0.00 -1.45 0.00 0.00 58.65 57.93 1spi h GLN 53 Cb 1.47 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.97 1spi h GLN 53 CO -0.29 -0.25 0.41 0.82 -0.95 0.00 0.00 178.83 178.57 1spi h ILE 54 N -0.43 0.44 0.20 2.54 2.04 -1.43 -1.25 117.51 119.61 1spi h ILE 54 Ca -0.04 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 1spi h ILE 54 Cb 0.30 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1spi h ILE 54 CO 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 178.15 178.12 1spi h ALA 55 N 1.57 -0.26 0.00 1.87 0.00 -0.36 0.77 119.26 122.84 1spi h ALA 55 Ca 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1spi h ALA 55 Cb 1.01 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1spi h ALA 55 CO -0.00 -0.58 0.00 0.43 0.00 0.00 0.00 179.25 179.10 1spi n SER 56 N -5.14 0.00 0.02 0.00 7.64 -0.52 -0.35 113.62 115.26 1spi n SER 56 Ca -0.09 -0.54 -0.15 0.00 1.01 0.00 0.00 58.87 59.11 1spi n SER 56 Cb 0.18 -0.13 -0.14 0.00 -1.01 0.00 0.00 64.21 63.10 1spi n SER 56 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1spi h LEU 57 N 0.00 0.24 -0.21 -3.43 5.85 -0.82 -3.23 115.31 113.71 1spi h LEU 57 Ca 0.00 -0.44 -0.18 0.00 0.84 0.00 0.00 57.88 58.11 1spi h LEU 57 Cb 0.12 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1spi h LEU 57 CO 0.00 1.38 -0.84 0.58 -0.34 0.00 0.00 178.44 179.22 1spi h VAL 58 N 0.04 1.54 0.00 1.05 2.07 0.98 -2.86 116.25 119.07 1spi h VAL 58 Ca -0.30 -2.94 0.00 0.00 0.82 0.00 0.00 66.70 64.28 1spi h VAL 58 Cb 2.01 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 34.39 1spi h VAL 58 CO 0.11 0.82 0.00 0.00 0.02 0.00 0.00 177.57 178.52 1spi n GLN 59 N -3.45 0.51 -0.86 1.57 6.02 0.53 -4.94 117.38 116.77 1spi n GLN 59 Ca -0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1spi n GLN 59 Cb 0.83 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.59 1spi n GLN 59 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1spi n ARG 60 N -1.08 -2.44 0.00 -1.09 3.00 -1.08 -5.04 116.66 108.94 1spi n ARG 60 Ca 0.13 1.79 0.00 0.00 -0.01 0.00 0.00 57.85 59.76 1spi n ARG 60 Cb 0.09 -1.99 0.00 0.00 0.00 0.00 0.00 32.46 30.56 1spi n ARG 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1spi n ALA 61 N -0.45 0.00 -1.19 7.54 0.00 -1.26 -4.81 120.51 120.34 1spi n ALA 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1spi n ALA 61 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1spi n ALA 61 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1spi n LYS 82 N 0.00 0.00 0.00 0.00 5.02 -1.26 -4.91 118.16 117.01 1spi n LYS 82 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1spi n LYS 82 Cb 0.00 -0.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.62 1spi n LYS 82 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1spi n LEU 83 N 1.32 0.00 -0.34 -0.35 0.00 -1.26 -4.80 117.00 111.57 1spi n LEU 83 Ca 0.00 0.00 0.23 0.00 0.00 0.00 0.00 56.01 56.24 1spi n LEU 83 Cb 0.00 0.06 0.50 0.00 0.00 0.00 0.00 43.42 43.98 1spi n LEU 83 CO 0.00 -0.06 1.20 0.44 0.00 0.00 0.00 177.39 178.97 1spi h ASP 84 N 0.00 0.48 0.06 1.96 3.32 -2.00 -2.13 116.42 118.10 1spi h ASP 84 Ca 0.00 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1spi h ASP 84 Cb 0.00 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 1spi h ASP 84 CO 0.00 0.05 -1.95 0.55 -1.72 0.00 0.00 179.24 176.17 1spi n VAL 85 N -4.70 0.06 -0.11 -1.35 3.14 -1.26 -4.22 118.33 109.88 1spi n VAL 85 Ca 0.27 -0.51 -0.10 0.00 -2.96 0.00 0.00 64.34 61.04 1spi n VAL 85 Cb 0.91 -0.03 -0.03 0.00 -1.06 0.00 0.00 33.84 33.64 1spi n VAL 85 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1spi h VAL 86 N 0.00 1.24 -0.31 1.55 2.07 -1.71 0.71 116.25 119.79 1spi h VAL 86 Ca -0.01 -0.83 0.09 0.00 0.82 0.00 0.00 66.70 66.77 1spi h VAL 86 Cb 1.02 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1spi h VAL 86 CO 0.00 0.27 0.28 0.28 0.02 0.00 0.00 177.57 178.43 1spi h SER 87 N 0.37 0.00 0.02 0.57 0.02 -1.61 0.33 113.55 113.24 1spi h SER 87 Ca 0.10 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1spi h SER 87 Cb 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1spi h SER 87 CO 0.01 0.00 -0.21 -1.13 -1.14 0.00 0.00 176.83 174.36 1spi h ASN 88 N 0.00 0.06 0.01 3.07 -1.24 -1.50 -2.80 115.58 113.18 1spi h ASN 88 Ca 0.15 -0.96 0.00 0.00 0.71 0.00 0.00 56.30 56.20 1spi h ASN 88 Cb 0.71 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.74 1spi h ASN 88 CO -0.00 1.09 0.00 -0.62 -1.29 0.00 0.00 177.43 176.61 1spi n GLU 89 N -4.53 0.00 0.00 6.67 1.02 0.48 -0.00 120.64 124.28 1spi n GLU 89 Ca -0.12 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 1spi n GLU 89 Cb 0.54 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1spi n GLU 89 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1spi n VAL 90 N -1.43 0.00 -0.21 2.62 0.31 0.85 -4.16 118.33 116.31 1spi n VAL 90 Ca 0.00 0.31 0.20 0.00 -0.01 0.00 0.00 64.34 64.84 1spi n VAL 90 Cb 0.00 -1.11 0.36 0.00 -0.91 0.00 0.00 33.84 32.18 1spi n VAL 90 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1spi n PHE 91 N -1.76 0.72 0.00 3.52 7.35 -0.63 -0.55 117.46 126.12 1spi n PHE 91 Ca 0.00 0.76 0.00 0.00 -0.76 0.00 0.00 57.45 57.45 1spi n PHE 91 Cb 0.00 -1.18 0.00 0.00 0.35 0.00 0.00 39.48 38.65 1spi n PHE 91 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1spi n SER 92 N -4.48 0.00 -0.25 -2.13 2.88 1.00 -2.44 113.62 108.19 1spi n SER 92 Ca 0.24 0.84 0.06 0.00 -1.33 0.00 0.00 58.87 58.67 1spi n SER 92 Cb 0.80 -0.37 0.19 0.00 -0.75 0.00 0.00 64.21 64.08 1spi n SER 92 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1spi h SER 93 N 0.00 0.04 0.00 -3.46 4.64 -0.99 1.68 113.55 115.47 1spi h SER 93 Ca 0.00 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1spi h SER 93 Cb 0.00 0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1spi h SER 93 CO 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.93 1spi n LEU 95 N -0.55 0.00 -0.69 0.00 7.94 0.16 -4.79 117.00 119.07 1spi n LEU 95 Ca 0.01 0.00 0.52 0.00 -1.11 0.00 0.00 56.01 55.43 1spi n LEU 95 Cb 0.00 0.08 0.80 0.00 0.53 0.00 0.00 43.42 44.83 1spi n LEU 95 CO 0.01 -0.47 1.44 -1.14 -1.11 0.00 0.00 177.39 176.12 1spi n ARG 96 N -2.44 -0.00 0.00 1.96 0.63 0.52 -0.64 116.66 116.69 1spi n ARG 96 Ca 0.00 1.05 0.00 0.00 -0.92 0.00 0.00 57.85 57.98 1spi n ARG 96 Cb 0.00 -2.43 0.00 0.00 0.45 0.00 0.00 32.46 30.48 1spi n ARG 96 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1spi n SER 97 N -3.88 0.00 0.00 6.15 3.41 -1.16 -4.65 113.62 113.49 1spi n SER 97 Ca 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 1spi n SER 97 Cb 1.96 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 1spi n SER 97 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1spi n SER 98 N 0.00 0.00 0.00 4.04 3.41 -0.95 -4.83 113.62 115.29 1spi n SER 98 Ca 0.00 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1spi n SER 98 Cb 0.00 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1spi n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1spi n GLY 99 N -0.93 1.11 4.12 5.00 0.00 0.19 -4.92 105.19 109.76 1spi n GLY 99 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1spi n GLY 99 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1spi n ARG 100 N 0.00 0.00 0.00 1.61 -4.01 -1.26 -4.50 116.66 108.50 1spi n ARG 100 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 1spi n ARG 100 Cb 0.00 -0.11 0.00 0.00 -3.04 0.00 0.00 32.46 29.31 1spi n ARG 100 CO 0.00 0.00 0.00 0.25 -3.04 0.00 0.00 177.63 174.84 1spi n THR 101 N 0.00 0.00 0.00 8.89 -2.24 -1.26 -4.59 114.28 115.08 1spi n THR 101 Ca 0.00 0.62 0.00 0.00 -2.27 0.00 0.00 64.05 62.40 1spi n THR 101 Cb 0.00 -1.53 0.00 0.00 -2.10 0.00 0.00 70.33 66.70 1spi n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1spi n GLY 102 N 1.54 3.86 3.14 3.38 0.00 -1.26 -3.04 105.19 112.82 1spi n GLY 102 Ca 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1spi n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1spi s ILE 103 N 0.00 0.13 0.10 -0.61 1.01 -1.25 -3.20 121.20 117.39 1spi s ILE 103 Ca 0.00 -1.10 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 1spi s ILE 103 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 1spi s ILE 103 CO 0.00 -0.61 0.08 0.27 0.00 0.00 0.00 174.94 174.68 1spi s ILE 104 N -2.86 0.15 0.00 2.92 -4.36 -0.78 -1.92 121.20 114.35 1spi s ILE 104 Ca -0.03 -1.68 0.00 0.00 -0.26 0.00 0.00 60.65 58.68 1spi s ILE 104 Cb 0.00 -1.70 0.00 0.00 1.25 0.00 0.00 42.46 42.01 1spi s ILE 104 CO -0.06 -0.67 0.00 0.00 0.24 0.00 0.00 174.94 174.45 1spi n ALA 105 N -0.03 0.00 -3.00 2.27 0.00 -1.26 -1.53 120.51 116.95 1spi n ALA 105 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1spi n ALA 105 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1spi n ALA 105 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1spi n SER 106 N -0.39 0.00 0.04 0.00 3.41 -1.25 -2.66 113.62 112.76 1spi n SER 106 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1spi n SER 106 Cb 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.81 1spi n SER 106 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1spi h GLU 107 N 0.00 0.32 -0.00 4.33 4.81 -1.95 -3.39 114.58 118.70 1spi h GLU 107 Ca 0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1spi h GLU 107 Cb 0.00 0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1spi h GLU 107 CO 0.00 1.26 -0.83 0.39 -0.73 0.00 0.00 179.01 179.10 1spi n GLU 108 N -3.75 1.02 -2.59 1.92 4.71 -1.26 -4.83 120.64 115.86 1spi n GLU 108 Ca -0.25 -0.05 -0.41 0.00 -0.01 0.00 0.00 57.16 56.43 1spi n GLU 108 Cb 0.99 -1.36 -0.03 0.00 -1.01 0.00 0.00 31.44 30.03 1spi n GLU 108 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1spi s GLU 109 N -2.69 3.56 0.00 3.49 2.02 -1.26 -4.74 118.70 119.08 1spi s GLU 109 Ca 0.07 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1spi s GLU 109 Cb 0.14 -5.23 0.00 0.00 0.10 0.00 0.00 34.13 29.14 1spi s GLU 109 CO 0.73 -2.17 0.71 -0.40 0.02 0.00 0.00 175.26 174.15 1spi n ASP 110 N 8.73 0.31 -3.19 -0.19 5.75 -1.26 -3.23 116.55 123.47 1spi n ASP 110 Ca 0.30 -1.73 -0.20 0.00 -0.01 0.00 0.00 54.79 53.15 1spi n ASP 110 Cb 0.51 -0.15 -0.05 0.00 -1.03 0.00 0.00 41.12 40.40 1spi n ASP 110 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1spi n VAL 111 N -0.30 -0.33 -0.24 2.12 0.24 -1.26 -4.60 118.33 113.97 1spi n VAL 111 Ca 0.00 -4.39 -0.11 0.00 -2.04 0.00 0.00 64.34 57.80 1spi n VAL 111 Cb 0.08 -0.90 -0.02 0.00 -1.47 0.00 0.00 33.84 31.52 1spi n VAL 111 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1spi n PRO 112 N 0.69 0.00 -1.77 7.34 -0.02 -1.20 -4.60 135.00 135.45 1spi n PRO 112 Ca 0.24 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.42 1spi n PRO 112 Cb 0.61 -0.27 -0.04 0.00 -0.02 0.00 0.00 33.50 33.78 1spi n PRO 112 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1spi s VAL 113 N 0.96 3.17 -0.95 -1.45 0.11 -0.59 -4.89 120.40 116.76 1spi s VAL 113 Ca 0.21 -0.02 -0.24 0.00 -2.93 0.00 0.00 61.98 59.00 1spi s VAL 113 Cb -0.27 -3.42 0.03 0.00 -1.53 0.00 0.00 36.38 31.19 1spi s VAL 113 CO 0.12 -0.40 1.52 0.00 -3.33 0.00 0.00 175.10 173.01 1spi s ALA 114 N 11.72 2.53 -0.67 1.54 0.00 -1.26 -1.86 121.76 133.77 1spi s ALA 114 Ca 0.84 -1.97 -0.24 0.00 0.00 0.00 0.00 51.96 50.59 1spi s ALA 114 Cb -0.13 -4.49 -0.19 0.00 0.00 0.00 0.00 23.12 18.30 1spi s ALA 114 CO 0.15 -3.77 1.87 1.33 0.00 0.00 0.00 175.76 175.34 1spi n VAL 115 N 6.99 1.47 -1.20 0.00 0.24 -1.19 -4.62 118.33 120.02 1spi n VAL 115 Ca 0.30 -1.31 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 1spi n VAL 115 Cb 0.50 -2.25 0.00 0.00 -1.47 0.00 0.00 33.84 30.62 1spi n VAL 115 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1spi n GLU 116 N 7.30 -3.36 0.21 7.34 4.71 -1.26 -4.42 120.64 131.16 1spi n GLU 116 Ca 0.49 2.44 0.09 0.00 -0.01 0.00 0.00 57.16 60.16 1spi n GLU 116 Cb 0.41 -2.69 0.38 0.00 -1.01 0.00 0.00 31.44 28.53 1spi n GLU 116 CO 0.00 0.00 0.00 1.05 0.09 0.00 0.00 177.13 178.27 1spi h GLU 117 N 1.85 0.00 -0.73 3.49 4.11 -1.85 -3.23 114.58 118.22 1spi h GLU 117 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1spi h GLU 117 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1spi h GLU 117 CO 0.00 0.26 0.40 0.66 0.07 0.00 0.00 179.01 180.40 1spi h SER 118 N 0.00 0.91 0.21 3.06 4.64 -1.93 -3.24 113.55 117.20 1spi h SER 118 Ca -0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1spi h SER 118 Cb 0.85 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1spi h SER 118 CO 0.03 0.73 0.00 -1.22 -0.87 0.00 0.00 176.83 175.51 1spi n TYR 119 N -4.36 0.00 -2.27 4.77 4.01 -1.22 -4.96 117.16 113.14 1spi n TYR 119 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1spi n TYR 119 Cb 0.10 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 1spi n TYR 119 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1spi n SER 120 N -1.14 0.00 0.00 7.72 7.64 -1.22 -4.35 113.62 122.27 1spi n SER 120 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1spi n SER 120 Cb 0.13 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1spi n SER 120 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1spi n GLY 121 N 0.00 -0.59 1.71 0.23 0.00 -1.24 -4.95 105.19 100.35 1spi n GLY 121 Ca 0.00 0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1spi n GLY 121 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1spi n ASN 122 N -2.50 3.71 -3.79 1.61 4.13 -1.26 -4.88 115.26 112.28 1spi n ASN 122 Ca 0.00 -3.74 -0.12 0.00 1.68 0.00 0.00 54.58 52.40 1spi n ASN 122 Cb 0.00 -0.72 -0.08 0.00 -1.54 0.00 0.00 39.78 37.44 1spi n ASN 122 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1spi s TYR 123 N -3.37 -0.10 -0.25 3.10 2.02 -1.17 -4.44 117.35 113.14 1spi s TYR 123 Ca 0.51 0.07 -0.02 0.00 -0.37 0.00 0.00 57.07 57.26 1spi s TYR 123 Cb 0.44 0.06 0.12 0.00 -0.40 0.00 0.00 41.96 42.18 1spi s TYR 123 CO 0.03 -0.41 0.28 0.42 -1.57 0.00 0.00 175.55 174.30 1spi s ILE 124 N -1.77 -0.41 -0.96 2.71 -1.09 -0.34 -3.81 121.20 115.53 1spi s ILE 124 Ca -0.11 -0.26 -0.02 0.00 -2.23 0.00 0.00 60.65 58.03 1spi s ILE 124 Cb -0.04 -0.83 0.28 0.00 -1.58 0.00 0.00 42.46 40.29 1spi s ILE 124 CO 0.01 -0.30 1.18 0.55 -1.23 0.00 0.00 174.94 175.15 1spi n VAL 125 N 5.32 4.25 -1.58 2.92 3.14 -0.81 -0.05 118.33 131.53 1spi n VAL 125 Ca -0.04 -5.60 -0.53 0.00 -2.96 0.00 0.00 64.34 55.21 1spi n VAL 125 Cb 0.48 -2.18 -0.06 0.00 -1.06 0.00 0.00 33.84 31.02 1spi n VAL 125 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 1spi n VAL 126 N 1.51 0.01 -3.89 1.55 0.24 -0.95 -4.28 118.33 112.53 1spi n VAL 126 Ca 0.26 -0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.29 1spi n VAL 126 Cb 0.36 -0.68 -0.17 0.00 -1.47 0.00 0.00 33.84 31.88 1spi n VAL 126 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1spi s PHE 127 N 0.47 1.50 -0.51 6.34 5.36 -1.09 -1.69 117.98 128.36 1spi s PHE 127 Ca 0.86 -0.83 -0.22 0.00 -0.96 0.00 0.00 56.93 55.78 1spi s PHE 127 Cb -1.02 -1.23 0.04 0.00 -0.34 0.00 0.00 43.02 40.48 1spi s PHE 127 CO 0.49 -0.54 0.78 0.34 -1.46 0.00 0.00 175.22 174.84 1spi s ASP 128 N 1.70 6.31 0.07 6.13 2.15 0.13 -3.83 116.67 129.34 1spi s ASP 128 Ca 0.03 -0.48 -0.14 0.00 0.43 0.00 0.00 52.55 52.39 1spi s ASP 128 Cb -0.14 -2.37 -0.03 0.00 -0.30 0.00 0.00 42.92 40.08 1spi s ASP 128 CO -0.08 -1.02 0.99 -2.65 -0.17 0.00 0.00 175.17 172.24 1spi n PRO 129 N 6.81 -0.21 -2.02 4.34 -0.02 -1.26 -2.33 135.00 140.31 1spi n PRO 129 Ca -0.01 0.98 -0.03 0.00 -2.02 0.00 0.00 63.50 62.42 1spi n PRO 129 Cb 0.47 -1.44 -0.01 0.00 -0.02 0.00 0.00 33.50 32.50 1spi n PRO 129 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1spi n LEU 130 N -4.12 0.00 -3.72 2.45 4.32 -1.25 -4.12 117.00 110.56 1spi n LEU 130 Ca 0.01 -0.50 -0.13 0.00 -0.02 0.00 0.00 56.01 55.36 1spi n LEU 130 Cb 0.12 0.43 -0.10 0.00 -1.62 0.00 0.00 43.42 42.26 1spi n LEU 130 CO -0.07 -0.11 0.12 1.51 -1.22 0.00 0.00 177.39 177.61 1spi s ASP 131 N -1.38 -0.45 -0.37 -1.43 1.47 -0.95 -4.88 116.67 108.68 1spi s ASP 131 Ca 0.05 0.86 -0.01 0.00 1.18 0.00 0.00 52.55 54.63 1spi s ASP 131 Cb -0.00 0.88 0.00 0.00 -0.34 0.00 0.00 42.92 43.46 1spi s ASP 131 CO 0.04 -0.17 0.32 0.61 0.68 0.00 0.00 175.17 176.64 1spi n GLY 132 N 2.76 0.34 0.00 2.12 0.00 -1.26 -4.34 105.19 104.81 1spi n GLY 132 Ca -0.14 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1spi n GLY 132 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1spi n SER 133 N -0.83 0.00 -0.05 1.61 3.41 -1.26 -3.92 113.62 112.58 1spi n SER 133 Ca -0.05 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.52 1spi n SER 133 Cb 0.54 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.47 1spi n SER 133 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1spi n SER 134 N -0.85 1.21 -0.64 4.04 7.64 -1.26 -4.38 113.62 119.37 1spi n SER 134 Ca 0.00 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.19 1spi n SER 134 Cb 0.00 -0.68 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 1spi n SER 134 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1spi n ASN 135 N -3.75 0.91 0.07 6.43 0.23 -1.25 -1.45 115.26 116.45 1spi n ASN 135 Ca -0.07 -1.17 0.11 0.00 -0.53 0.00 0.00 54.58 52.92 1spi n ASN 135 Cb 0.27 -0.29 0.03 0.00 -2.08 0.00 0.00 39.78 37.71 1spi n ASN 135 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1spi n ILE 136 N 0.35 0.41 0.24 1.53 -5.35 -1.26 -2.88 119.36 112.40 1spi n ILE 136 Ca 0.00 -0.42 0.11 0.00 -0.27 0.00 0.00 62.75 62.18 1spi n ILE 136 Cb 0.19 -0.14 0.59 0.00 -1.74 0.00 0.00 39.64 38.53 1spi n ILE 136 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1spi h ASP 137 N 0.00 0.00 0.03 7.28 3.32 -1.52 -2.75 116.42 122.79 1spi h ASP 137 Ca 0.00 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.66 1spi h ASP 137 Cb 0.88 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.38 1spi h ASP 137 CO 0.00 0.18 -2.30 0.00 -1.72 0.00 0.00 179.24 175.40 1spi n ALA 138 N -2.24 1.23 -0.82 3.45 0.00 -1.25 -5.09 120.51 115.78 1spi n ALA 138 Ca -0.01 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1spi n ALA 138 Cb 0.34 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1spi n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1spi n ALA 139 N -3.32 -1.65 0.00 0.00 0.00 -1.04 -5.10 120.51 109.40 1spi n ALA 139 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1spi n ALA 139 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.43 1spi n ALA 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1spi n VAL 140 N 0.47 0.00 -3.86 0.00 0.31 -1.25 -5.05 118.33 108.94 1spi n VAL 140 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 1spi n VAL 140 Cb 0.00 -0.69 -0.04 0.00 -0.91 0.00 0.00 33.84 32.20 1spi n VAL 140 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1spi s SER 141 N -4.65 -0.20 0.03 4.52 0.15 -1.26 -4.68 113.70 107.61 1spi s SER 141 Ca 0.00 -0.67 -0.20 0.00 0.70 0.00 0.00 55.95 55.78 1spi s SER 141 Cb 0.00 0.62 0.07 0.00 -1.71 0.00 0.00 66.02 65.00 1spi s SER 141 CO 0.00 -1.17 0.90 0.41 1.20 0.00 0.00 173.24 174.59 1spi n THR 142 N -0.39 0.00 -3.65 6.45 -1.04 -1.22 -4.73 114.28 109.70 1spi n THR 142 Ca -0.05 -0.21 -0.02 0.00 -2.04 0.00 0.00 64.05 61.72 1spi n THR 142 Cb 0.61 0.48 -0.05 0.00 -1.82 0.00 0.00 70.33 69.55 1spi n THR 142 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1spi s GLY 143 N -3.41 0.22 -0.01 3.41 0.00 -1.26 -2.58 107.32 103.70 1spi s GLY 143 Ca 0.21 3.16 0.00 0.00 0.00 0.00 0.00 44.72 48.09 1spi s GLY 143 CO 0.01 1.46 0.05 -0.56 0.00 0.00 0.00 173.10 174.06 1spi s SER 144 N -0.58 5.44 0.06 1.64 0.01 -0.81 -2.23 113.70 117.23 1spi s SER 144 Ca 0.08 0.09 0.03 0.00 1.31 0.00 0.00 55.95 57.46 1spi s SER 144 Cb -0.03 -1.51 -0.03 0.00 0.21 0.00 0.00 66.02 64.66 1spi s SER 144 CO -0.11 0.28 -0.09 -0.63 0.41 0.00 0.00 173.24 173.10 1spi s ILE 145 N -1.13 0.70 0.27 1.44 1.01 -0.98 0.06 121.20 122.56 1spi s ILE 145 Ca 0.21 -1.24 -0.18 0.00 0.00 0.00 0.00 60.65 59.43 1spi s ILE 145 Cb -0.12 -0.85 0.01 0.00 0.01 0.00 0.00 42.46 41.52 1spi s ILE 145 CO 0.12 -0.41 0.65 0.72 0.00 0.00 0.00 174.94 176.02 1spi s PHE 146 N -1.63 -0.01 -0.24 3.97 -0.71 -1.03 0.17 117.98 118.48 1spi s PHE 146 Ca -0.05 -0.42 -0.12 0.00 -1.04 0.00 0.00 56.93 55.30 1spi s PHE 146 Cb -0.08 0.55 0.08 0.00 -1.21 0.00 0.00 43.02 42.36 1spi s PHE 146 CO 0.00 -1.17 0.57 0.20 -1.34 0.00 0.00 175.22 173.48 1spi s GLY 147 N -2.95 -0.53 -0.14 1.99 0.00 -0.68 -3.49 107.32 101.51 1spi s GLY 147 Ca 0.15 2.06 -0.23 0.00 0.00 0.00 0.00 44.72 46.70 1spi s GLY 147 CO 0.08 2.29 0.69 -0.42 0.00 0.00 0.00 173.10 175.74 1spi s ILE 148 N 1.85 5.01 -0.21 0.90 -1.09 -1.18 -2.23 121.20 124.25 1spi s ILE 148 Ca -0.08 1.36 0.01 0.00 -2.23 0.00 0.00 60.65 59.71 1spi s ILE 148 Cb -0.08 -4.01 0.03 0.00 -1.58 0.00 0.00 42.46 36.82 1spi s ILE 148 CO -0.17 0.15 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.23 1spi s TYR 149 N 1.50 2.95 -0.63 3.97 1.51 0.93 -1.70 117.35 125.87 1spi s TYR 149 Ca 0.34 -1.79 -0.25 0.00 -1.01 0.00 0.00 57.07 54.36 1spi s TYR 149 Cb -0.17 -1.95 0.05 0.00 -0.11 0.00 0.00 41.96 39.78 1spi s TYR 149 CO 0.13 -0.81 1.07 -1.54 -1.11 0.00 0.00 175.55 173.29 1spi s SER 150 N 1.25 6.26 -0.29 2.29 1.04 -1.21 -1.20 113.70 121.84 1spi s SER 150 Ca 0.01 -0.49 -0.29 0.00 0.48 0.00 0.00 55.95 55.66 1spi s SER 150 Cb -0.15 -2.48 -0.02 0.00 0.10 0.00 0.00 66.02 63.47 1spi s SER 150 CO -0.10 -1.48 1.73 -2.16 0.98 0.00 0.00 173.24 172.22 1spi s PRO 151 N 4.57 3.49 0.30 4.02 0.04 -1.26 -4.84 135.00 141.32 1spi s PRO 151 Ca 0.31 1.50 0.11 0.00 0.04 0.00 0.00 61.00 62.96 1spi s PRO 151 Cb -0.12 -4.14 0.44 0.00 0.04 0.00 0.00 34.50 30.72 1spi s PRO 151 CO 0.16 -1.66 1.67 -0.91 0.04 0.00 0.00 177.00 176.30 1spi h ASN 152 N 12.13 0.02 -3.01 6.66 4.21 -1.97 -3.42 115.58 130.19 1spi h ASN 152 Ca -0.34 -0.01 -0.62 0.00 1.21 0.00 0.00 56.30 56.54 1spi h ASN 152 Cb 1.16 -0.01 -0.06 0.00 -1.12 0.00 0.00 38.32 38.29 1spi h ASN 152 CO 1.02 0.57 -0.55 -0.62 -1.29 0.00 0.00 177.43 176.56 1spi s ASP 153 N -6.87 5.94 0.00 5.81 2.15 -1.26 -5.07 116.67 117.36 1spi s ASP 153 Ca -0.02 0.12 0.00 0.00 0.43 0.00 0.00 52.55 53.08 1spi s ASP 153 Cb 0.13 -1.71 0.00 0.00 -0.30 0.00 0.00 42.92 41.04 1spi s ASP 153 CO 0.76 0.16 0.00 -0.62 -0.17 0.00 0.00 175.17 175.30 1spi n GLU 154 N 0.30 0.00 -0.22 4.34 1.02 -1.26 -5.12 120.64 119.70 1spi n GLU 154 Ca -0.07 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.10 1spi n GLU 154 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.93 1spi n GLU 154 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1spi n ILE 156 N -2.22 0.00 0.00 0.00 -5.35 -1.26 -5.08 119.36 105.46 1spi n ILE 156 Ca -0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1spi n ILE 156 Cb 0.10 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 1spi n ILE 156 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1spi n VAL 157 N 0.00 0.00 -4.89 7.28 0.24 -1.26 -5.04 118.33 114.66 1spi n VAL 157 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1spi n VAL 157 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1spi n VAL 157 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1spi n ASP 158 N 0.00 -2.75 -2.00 -1.34 2.03 -1.26 -5.02 116.55 106.21 1spi n ASP 158 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 1spi n ASP 158 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 1spi n ASP 158 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1spi n SER 159 N -2.66 -2.85 -1.10 1.67 7.64 -1.26 -4.98 113.62 110.08 1spi n SER 159 Ca 0.00 0.60 0.01 0.00 1.01 0.00 0.00 58.87 60.49 1spi n SER 159 Cb 0.00 -2.86 0.00 0.00 -1.01 0.00 0.00 64.21 60.34 1spi n SER 159 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1spi n ASP 160 N 0.53 0.41 0.00 6.43 9.92 -1.26 -4.99 116.55 127.59 1spi n ASP 160 Ca -0.10 -1.93 0.00 0.00 -0.53 0.00 0.00 54.79 52.23 1spi n ASP 160 Cb 0.15 -0.18 0.00 0.00 -0.64 0.00 0.00 41.12 40.45 1spi n ASP 160 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1spi n HIS 161 N 0.27 0.00 -3.98 1.24 1.44 -1.26 -4.93 115.22 108.00 1spi n HIS 161 Ca -0.00 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.48 1spi n HIS 161 Cb 0.93 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 31.01 1spi n HIS 161 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1spi s ASP 162 N 0.00 6.22 -0.38 4.39 1.11 -1.26 -4.97 116.67 121.79 1spi s ASP 162 Ca 0.00 0.07 -0.03 0.00 0.18 0.00 0.00 52.55 52.76 1spi s ASP 162 Cb 0.00 -1.82 -0.13 0.00 1.07 0.00 0.00 42.92 42.04 1spi s ASP 162 CO 0.00 -0.02 0.89 -0.67 1.18 0.00 0.00 175.17 176.56 1spi n ASP 163 N -1.03 -0.72 0.00 0.27 2.03 -1.26 -4.77 116.55 111.07 1spi n ASP 163 Ca -0.08 -0.32 0.00 0.00 0.52 0.00 0.00 54.79 54.91 1spi n ASP 163 Cb 0.56 -0.25 0.00 0.00 -0.72 0.00 0.00 41.12 40.71 1spi n ASP 163 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1spi n GLU 164 N 2.44 0.00 -3.27 -0.67 2.13 -1.26 -5.13 120.64 114.88 1spi n GLU 164 Ca 0.26 0.00 -0.44 0.00 0.66 0.00 0.00 57.16 57.63 1spi n GLU 164 Cb 0.09 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.74 1spi n GLU 164 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1spi s SER 165 N 1.16 6.18 0.00 4.31 0.15 -1.26 -5.01 113.70 119.23 1spi s SER 165 Ca 0.00 -1.19 0.00 0.00 0.70 0.00 0.00 55.95 55.46 1spi s SER 165 Cb 0.00 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 1spi s SER 165 CO 0.00 -0.79 0.00 1.67 1.20 0.00 0.00 173.24 175.32 1spi n GLN 166 N 5.68 0.00 -0.89 5.44 -0.06 -1.26 -5.20 117.38 121.09 1spi n GLN 166 Ca -0.10 0.00 -0.02 0.00 -2.00 0.00 0.00 57.00 54.88 1spi n GLN 166 Cb 0.44 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 26.63 1spi n GLN 166 CO 0.00 0.00 0.00 1.47 -0.20 0.00 0.00 177.06 178.33 1spi n LEU 167 N 0.00 0.00 -4.73 1.69 -0.00 -1.26 -5.09 117.00 107.61 1spi n LEU 167 Ca 0.00 -0.20 -0.32 0.00 -0.00 0.00 0.00 56.01 55.49 1spi n LEU 167 Cb 0.00 -0.05 0.11 0.00 -0.00 0.00 0.00 43.42 43.47 1spi n LEU 167 CO 0.00 -0.54 0.72 -0.44 -0.00 0.00 0.00 177.39 177.13 1spi s SER 168 N -1.35 4.09 0.00 1.45 0.01 -1.26 -4.87 113.70 111.76 1spi s SER 168 Ca 0.06 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.39 1spi s SER 168 Cb -0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1spi s SER 168 CO 0.04 -2.32 0.00 0.00 0.41 0.00 0.00 173.24 171.37 1spi n ALA 169 N -3.35 0.00 -1.58 1.44 0.00 -1.26 -5.11 120.51 110.64 1spi n ALA 169 Ca 0.11 0.00 -0.51 0.00 0.00 0.00 0.00 53.44 53.04 1spi n ALA 169 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 1spi n ALA 169 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1spi n GLU 170 N 0.00 1.51 -0.92 0.00 2.13 -1.26 -4.75 120.64 117.35 1spi n GLU 170 Ca 0.00 0.50 -0.05 0.00 0.66 0.00 0.00 57.16 58.26 1spi n GLU 170 Cb 0.00 -2.51 0.18 0.00 0.27 0.00 0.00 31.44 29.38 1spi n GLU 170 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1spi n GLU 171 N 7.20 2.01 -4.29 5.31 -0.58 -1.26 -5.05 120.64 123.98 1spi n GLU 171 Ca 0.32 -3.35 -0.24 0.00 -0.42 0.00 0.00 57.16 53.47 1spi n GLU 171 Cb 0.25 -1.84 -0.08 0.00 -0.57 0.00 0.00 31.44 29.20 1spi n GLU 171 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1spi s GLN 172 N -3.32 2.26 0.00 3.49 2.00 -1.26 -5.02 119.66 117.81 1spi s GLN 172 Ca 0.45 -1.38 0.00 0.00 -2.00 0.00 0.00 55.36 52.42 1spi s GLN 172 Cb 0.40 -2.17 0.00 0.00 0.80 0.00 0.00 33.01 32.05 1spi s GLN 172 CO -0.02 0.38 0.00 -2.13 -0.50 0.00 0.00 175.29 173.02 1spi n ARG 173 N -0.71 2.59 0.00 1.67 3.00 -1.26 -5.14 116.66 116.82 1spi n ARG 173 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.78 1spi n ARG 173 Cb 0.58 -0.78 0.00 0.00 0.00 0.00 0.00 32.46 32.26 1spi n ARG 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1spi s VAL 175 N 0.00 4.96 0.00 0.00 1.01 -1.26 -4.91 120.40 120.20 1spi s VAL 175 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 61.98 63.57 1spi s VAL 175 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1spi s VAL 175 CO 0.00 0.15 0.00 0.52 0.00 0.00 0.00 175.10 175.77 1spi n VAL 176 N 4.17 0.00 -0.20 2.92 0.31 -1.26 -3.94 118.33 120.33 1spi n VAL 176 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1spi n VAL 176 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 1spi n VAL 176 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1spi n ASN 177 N -0.15 -0.70 -4.56 4.52 5.15 -1.26 -4.72 115.26 113.54 1spi n ASN 177 Ca 0.00 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.64 1spi n ASN 177 Cb 0.00 -0.98 -0.04 0.00 -0.53 0.00 0.00 39.78 38.23 1spi n ASN 177 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1spi n VAL 178 N -0.16 2.71 -2.11 3.44 0.24 -1.26 -4.27 118.33 116.92 1spi n VAL 178 Ca 0.00 -2.81 -0.02 0.00 -2.04 0.00 0.00 64.34 59.47 1spi n VAL 178 Cb 0.06 -2.24 -0.02 0.00 -1.47 0.00 0.00 33.84 30.16 1spi n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1spi n GLN 180 N 0.11 0.55 -0.84 0.00 0.00 -1.26 -4.04 117.38 111.90 1spi n GLN 180 Ca -0.08 -2.10 -0.12 0.00 0.00 0.00 0.00 57.00 54.69 1spi n GLN 180 Cb 0.75 -1.48 0.09 0.00 0.00 0.00 0.00 30.24 29.60 1spi n GLN 180 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1spi n PRO 181 N 2.74 -0.51 0.00 2.61 -0.04 -1.26 -2.60 135.00 135.95 1spi n PRO 181 Ca 0.18 -0.89 0.00 0.00 -0.04 0.00 0.00 63.50 62.75 1spi n PRO 181 Cb 0.56 -0.57 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1spi n PRO 181 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1spi n GLY 182 N 1.33 -0.12 0.43 0.55 0.00 -1.26 -3.69 105.19 102.43 1spi n GLY 182 Ca 0.07 -0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1spi n GLY 182 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1spi h ASP 183 N 0.00 -0.90 0.71 1.61 5.19 -1.89 -3.36 116.42 117.78 1spi h ASP 183 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1spi h ASP 183 Cb 0.00 0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1spi h ASP 183 CO 0.00 -0.57 -0.46 0.59 -3.12 0.00 0.00 179.24 175.68 1spi n ASN 184 N -5.51 0.50 -4.61 6.45 4.13 -1.07 -4.88 115.26 110.28 1spi n ASN 184 Ca -0.14 -0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.69 1spi n ASN 184 Cb 0.43 0.09 -0.03 0.00 -1.54 0.00 0.00 39.78 38.73 1spi n ASN 184 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1spi s LEU 185 N -3.43 3.61 -0.08 3.41 1.43 -1.26 -3.32 118.68 119.03 1spi s LEU 185 Ca 0.10 1.48 -0.06 0.00 -1.03 0.00 0.00 54.13 54.62 1spi s LEU 185 Cb 0.16 -3.53 -0.27 0.00 0.03 0.00 0.00 46.19 42.58 1spi s LEU 185 CO 0.68 -1.62 0.51 -0.07 0.23 0.00 0.00 176.35 176.09 1spi h LEU 186 N 13.30 0.45 -8.16 1.79 3.38 -1.67 -3.47 115.31 120.93 1spi h LEU 186 Ca -0.35 -0.86 -0.12 0.00 0.09 0.00 0.00 57.88 56.64 1spi h LEU 186 Cb 1.18 -0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.65 1spi h LEU 186 CO 1.01 1.75 -0.38 0.00 0.09 0.00 0.00 178.44 180.92 1spi s ALA 187 N -2.57 0.18 -0.19 1.53 0.00 -1.25 -4.43 121.76 115.02 1spi s ALA 187 Ca -0.18 -1.01 -0.28 0.00 0.00 0.00 0.00 51.96 50.49 1spi s ALA 187 Cb 0.06 0.88 0.11 0.00 0.00 0.00 0.00 23.12 24.18 1spi s ALA 187 CO 0.81 -0.62 0.92 0.00 0.00 0.00 0.00 175.76 176.87 1spi s ALA 188 N -3.99 -1.90 0.04 0.00 0.00 -0.45 -3.09 121.76 112.37 1spi s ALA 188 Ca 0.19 1.68 -0.27 0.00 0.00 0.00 0.00 51.96 53.55 1spi s ALA 188 Cb 0.04 -0.87 0.10 0.00 0.00 0.00 0.00 23.12 22.39 1spi s ALA 188 CO 0.01 -0.30 1.21 0.20 0.00 0.00 0.00 175.76 176.88 1spi s GLY 189 N -0.54 -0.18 0.35 0.00 0.00 -1.23 -2.08 107.32 103.64 1spi s GLY 189 Ca -0.02 0.18 0.06 0.00 0.00 0.00 0.00 44.72 44.94 1spi s GLY 189 CO 0.01 2.68 0.24 -2.52 0.00 0.00 0.00 173.10 173.50 1spi s TYR 190 N -2.29 1.74 -0.06 1.90 -0.85 -1.06 -2.48 117.35 114.26 1spi s TYR 190 Ca 0.21 -1.57 -0.03 0.00 -0.52 0.00 0.00 57.07 55.17 1spi s TYR 190 Cb 0.01 -0.82 0.04 0.00 0.38 0.00 0.00 41.96 41.57 1spi s TYR 190 CO -0.00 -0.73 0.08 0.00 -1.52 0.00 0.00 175.55 173.38 1spi s MET 192 N 2.19 4.34 -0.60 0.00 1.75 0.16 -1.93 119.30 125.21 1spi s MET 192 Ca 0.04 0.47 -0.04 0.00 -1.25 0.00 0.00 55.69 54.91 1spi s MET 192 Cb -0.12 -3.43 0.16 0.00 2.84 0.00 0.00 34.83 34.27 1spi s MET 192 CO -0.04 0.17 0.43 0.71 -0.65 0.00 0.00 175.02 175.64 1spi s TYR 193 N 0.59 3.47 0.00 4.11 2.02 -1.06 -2.60 117.35 123.88 1spi s TYR 193 Ca 0.26 -2.54 0.00 0.00 -0.37 0.00 0.00 57.07 54.42 1spi s TYR 193 Cb -0.15 -3.29 0.00 0.00 -0.40 0.00 0.00 41.96 38.12 1spi s TYR 193 CO 0.11 -0.88 0.00 -1.13 -1.57 0.00 0.00 175.55 172.07 1spi n SER 194 N 3.79 0.00 0.00 2.29 3.41 -1.26 -3.44 113.62 118.41 1spi n SER 194 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1spi n SER 194 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1spi n SER 194 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1spi n SER 195 N 0.00 0.00 -3.66 4.04 2.88 -1.26 -4.74 113.62 110.87 1spi n SER 195 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1spi n SER 195 Cb 0.00 -0.59 -0.01 0.00 -0.75 0.00 0.00 64.21 62.85 1spi n SER 195 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1spi s SER 196 N -1.97 -0.14 -0.60 -3.46 1.04 -1.26 -5.07 113.70 102.24 1spi s SER 196 Ca 0.00 -0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.27 1spi s SER 196 Cb 0.00 0.31 0.27 0.00 0.10 0.00 0.00 66.02 66.70 1spi s SER 196 CO 0.00 -0.56 0.76 0.52 0.98 0.00 0.00 173.24 174.94 1spi n VAL 197 N -0.43 2.14 -2.32 5.02 0.31 -1.26 -4.40 118.33 117.40 1spi n VAL 197 Ca -0.07 -5.16 -0.43 0.00 -0.01 0.00 0.00 64.34 58.68 1spi n VAL 197 Cb 0.61 -1.93 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 1spi n VAL 197 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1spi s ILE 198 N -2.69 3.97 0.61 2.52 1.01 -1.07 -3.41 121.20 122.14 1spi s ILE 198 Ca 0.41 1.08 -0.07 0.00 0.00 0.00 0.00 60.65 62.07 1spi s ILE 198 Cb 0.18 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1spi s ILE 198 CO -0.04 -0.46 0.93 0.12 0.00 0.00 0.00 174.94 175.49 1spi s PHE 199 N 4.80 3.23 -0.23 3.97 5.36 0.99 -0.66 117.98 135.44 1spi s PHE 199 Ca 0.62 0.68 -0.17 0.00 -0.96 0.00 0.00 56.93 57.09 1spi s PHE 199 Cb -0.19 -2.82 0.07 0.00 -0.34 0.00 0.00 43.02 39.74 1spi s PHE 199 CO 0.26 -0.92 0.59 0.08 -1.46 0.00 0.00 175.22 173.78 1spi s VAL 200 N -3.06 -0.00 0.12 3.12 1.01 -0.93 -1.55 120.40 119.11 1spi s VAL 200 Ca 0.55 0.02 -0.14 0.00 0.00 0.00 0.00 61.98 62.40 1spi s VAL 200 Cb -0.11 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.45 1spi s VAL 200 CO 0.46 0.01 0.36 -0.22 0.00 0.00 0.00 175.10 175.71 1spi s LEU 201 N 0.94 0.61 -0.02 3.92 2.96 0.15 -2.56 118.68 124.69 1spi s LEU 201 Ca -0.05 -0.41 -0.08 0.00 -0.22 0.00 0.00 54.13 53.37 1spi s LEU 201 Cb -0.05 1.67 0.01 0.00 0.50 0.00 0.00 46.19 48.31 1spi s LEU 201 CO -0.08 -0.84 0.17 -0.89 -1.32 0.00 0.00 176.35 173.39 1spi s THR 202 N -3.82 0.06 -0.01 3.68 2.01 -0.88 0.73 115.64 117.41 1spi s THR 202 Ca 0.04 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.55 1spi s THR 202 Cb 0.02 -0.41 0.01 0.00 0.01 0.00 0.00 72.50 72.14 1spi s THR 202 CO -0.11 -0.27 0.78 2.30 -0.69 0.00 0.00 174.62 176.63 1spi n ILE 203 N 1.81 0.13 0.00 1.82 -6.64 -1.26 -1.34 119.36 113.88 1spi n ILE 203 Ca -0.20 -0.15 0.00 0.00 -1.77 0.00 0.00 62.75 60.63 1spi n ILE 203 Cb 0.56 0.69 0.00 0.00 -1.44 0.00 0.00 39.64 39.45 1spi n ILE 203 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1spi n GLY 204 N -0.09 3.16 3.45 3.28 0.00 -1.26 -4.85 105.19 108.88 1spi n GLY 204 Ca 0.01 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 1spi n GLY 204 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1spi s LYS 205 N 0.00 3.71 0.56 1.61 2.20 -1.26 -4.94 119.74 121.62 1spi s LYS 205 Ca 0.00 -1.97 0.00 0.00 -0.36 0.00 0.00 55.97 53.64 1spi s LYS 205 Cb 0.00 -4.93 0.00 0.00 -1.51 0.00 0.00 37.83 31.39 1spi s LYS 205 CO 0.00 -1.75 0.00 0.41 -0.36 0.00 0.00 175.35 173.65 1spi n GLY 206 N 5.12 -3.30 3.88 5.54 0.00 -1.26 -4.92 105.19 110.26 1spi n GLY 206 Ca 0.26 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 1spi n GLY 206 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1spi s VAL 207 N -4.14 4.84 -0.04 1.61 -7.23 -1.25 -4.16 120.40 110.03 1spi s VAL 207 Ca 0.00 0.50 0.00 0.00 -1.81 0.00 0.00 61.98 60.68 1spi s VAL 207 Cb 0.00 -3.71 0.03 0.00 0.56 0.00 0.00 36.38 33.25 1spi s VAL 207 CO 0.00 -0.41 -0.01 -0.31 -0.31 0.00 0.00 175.10 174.06 1spi s TYR 208 N -2.22 0.48 -0.05 2.82 2.02 0.22 -0.11 117.35 120.51 1spi s TYR 208 Ca 0.49 -0.07 -0.02 0.00 -0.37 0.00 0.00 57.07 57.11 1spi s TYR 208 Cb -0.10 -0.55 -0.04 0.00 -0.40 0.00 0.00 41.96 40.87 1spi s TYR 208 CO 0.29 -0.18 0.05 0.00 -1.57 0.00 0.00 175.55 174.14 1spi s ALA 209 N 1.19 3.47 -0.16 3.71 0.00 0.98 -0.67 121.76 130.28 1spi s ALA 209 Ca -0.07 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1spi s ALA 209 Cb -0.13 -1.57 0.03 0.00 0.00 0.00 0.00 23.12 21.44 1spi s ALA 209 CO -0.02 0.63 -0.13 -0.06 0.00 0.00 0.00 175.76 176.18 1spi s PHE 210 N -1.04 2.25 -0.08 0.00 0.08 -0.60 -0.91 117.98 117.70 1spi s PHE 210 Ca 0.18 -1.34 -0.16 0.00 0.12 0.00 0.00 56.93 55.73 1spi s PHE 210 Cb -0.12 -1.62 -0.05 0.00 -0.57 0.00 0.00 43.02 40.67 1spi s PHE 210 CO 0.07 -0.69 0.41 0.99 -0.10 0.00 0.00 175.22 175.90 1spi s THR 211 N 1.46 5.14 -0.35 0.64 2.01 -0.74 -0.00 115.64 123.79 1spi s THR 211 Ca 0.03 0.83 -0.22 0.00 0.31 0.00 0.00 61.69 62.64 1spi s THR 211 Cb -0.14 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.64 1spi s THR 211 CO -0.10 0.44 0.74 -0.22 -0.69 0.00 0.00 174.62 174.79 1spi s LEU 212 N -0.11 4.16 -0.61 4.42 2.96 -1.22 0.30 118.68 128.57 1spi s LEU 212 Ca 0.23 0.33 -0.26 0.00 -0.22 0.00 0.00 54.13 54.21 1spi s LEU 212 Cb -0.15 -2.96 -0.03 0.00 0.50 0.00 0.00 46.19 43.55 1spi s LEU 212 CO 0.10 -0.68 1.92 -0.62 -1.32 0.00 0.00 176.35 175.76 1spi s ASP 213 N 1.80 5.17 0.02 3.68 -1.08 -0.49 -4.66 116.67 121.11 1spi s ASP 213 Ca 0.29 0.37 -0.05 0.00 -0.52 0.00 0.00 52.55 52.64 1spi s ASP 213 Cb -0.14 -2.53 -0.01 0.00 -1.46 0.00 0.00 42.92 38.78 1spi s ASP 213 CO 0.16 -2.46 1.09 -0.65 0.52 0.00 0.00 175.17 173.83 1spi h PRO 214 N 15.28 -0.02 0.00 4.34 0.11 -1.95 0.70 132.00 150.46 1spi h PRO 214 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1spi h PRO 214 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1spi h PRO 214 CO 1.21 -0.01 0.00 -1.33 -0.21 0.00 0.00 178.00 177.66 1spi n MET 215 N -3.30 0.00 -1.64 1.05 2.81 -1.26 -1.63 117.12 113.16 1spi n MET 215 Ca 0.00 0.39 -0.31 0.00 -1.81 0.00 0.00 57.70 55.97 1spi n MET 215 Cb 0.05 -0.84 -0.04 0.00 -0.71 0.00 0.00 33.22 31.67 1spi n MET 215 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1spi n TYR 216 N -0.82 1.88 0.00 2.03 4.01 -1.19 -4.92 117.16 118.15 1spi n TYR 216 Ca 0.00 -2.17 0.00 0.00 -0.16 0.00 0.00 57.90 55.57 1spi n TYR 216 Cb 0.00 -1.48 0.00 0.00 -0.31 0.00 0.00 39.34 37.55 1spi n TYR 216 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1spi n GLY 217 N 1.03 0.00 2.98 2.72 0.00 0.23 -4.78 105.19 107.37 1spi n GLY 217 Ca 0.52 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.30 1spi n GLY 217 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1spi s GLU 218 N 0.00 1.54 -0.70 1.61 0.41 -1.18 -4.88 118.70 115.49 1spi s GLU 218 Ca 0.00 -0.34 -0.26 0.00 -0.41 0.00 0.00 54.97 53.96 1spi s GLU 218 Cb 0.00 -1.35 -0.02 0.00 -1.78 0.00 0.00 34.13 30.98 1spi s GLU 218 CO 0.00 -0.04 1.84 -0.06 -0.49 0.00 0.00 175.26 176.52 1spi s PHE 219 N 0.87 1.75 -0.24 1.61 0.08 -1.26 -1.40 117.98 119.39 1spi s PHE 219 Ca -0.11 0.67 -0.17 0.00 0.12 0.00 0.00 56.93 57.44 1spi s PHE 219 Cb -0.15 -4.12 -0.03 0.00 -0.57 0.00 0.00 43.02 38.15 1spi s PHE 219 CO 0.01 -2.14 0.45 0.08 -0.10 0.00 0.00 175.22 173.52 1spi s VAL 220 N 9.07 5.13 -0.17 -0.44 1.01 0.15 0.53 120.40 135.68 1spi s VAL 220 Ca 0.66 0.78 -0.36 0.00 0.00 0.00 0.00 61.98 63.05 1spi s VAL 220 Cb -0.11 -3.78 -0.13 0.00 0.00 0.00 0.00 36.38 32.37 1spi s VAL 220 CO 0.14 0.15 1.86 -0.11 0.00 0.00 0.00 175.10 177.14 1spi n LEU 221 N 5.15 3.06 -0.01 3.92 7.94 -1.25 -1.79 117.00 134.01 1spi n LEU 221 Ca -0.06 0.97 -0.01 0.00 -1.11 0.00 0.00 56.01 55.80 1spi n LEU 221 Cb 0.50 -1.29 -0.00 0.00 0.53 0.00 0.00 43.42 43.16 1spi n LEU 221 CO 0.40 -0.20 -0.09 0.41 -1.11 0.00 0.00 177.39 176.79 1spi n THR 222 N 5.11 0.20 -4.71 1.96 -1.04 -0.09 -4.75 114.28 110.96 1spi n THR 222 Ca 0.25 0.45 -0.27 0.00 -2.04 0.00 0.00 64.05 62.44 1spi n THR 222 Cb 0.24 -1.62 -0.14 0.00 -1.82 0.00 0.00 70.33 66.99 1spi n THR 222 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1spi s SER 223 N -4.22 2.78 0.09 8.00 0.15 -1.14 -5.00 113.70 114.36 1spi s SER 223 Ca -0.04 -0.57 0.09 0.00 0.70 0.00 0.00 55.95 56.13 1spi s SER 223 Cb 0.01 -0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.05 1spi s SER 223 CO 0.06 0.19 -0.22 -1.61 1.20 0.00 0.00 173.24 172.86 1spi s GLU 224 N -1.28 1.75 -1.47 5.44 2.02 -1.26 -0.01 118.70 123.88 1spi s GLU 224 Ca 0.09 -1.16 -0.06 0.00 0.02 0.00 0.00 54.97 53.86 1spi s GLU 224 Cb -0.09 -2.04 0.05 0.00 0.10 0.00 0.00 34.13 32.14 1spi s GLU 224 CO 0.02 0.49 0.64 1.17 0.02 0.00 0.00 175.26 177.60 1spi n LYS 225 N 1.23 -3.93 -1.53 1.61 4.81 0.84 -4.84 118.16 116.35 1spi n LYS 225 Ca -0.17 0.47 -0.44 0.00 -0.87 0.00 0.00 58.31 57.30 1spi n LYS 225 Cb 0.52 -4.92 -0.01 0.00 0.02 0.00 0.00 35.03 30.64 1spi n LYS 225 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1spi n ILE 226 N -4.43 2.00 -3.70 3.15 5.41 -0.99 -4.79 119.36 116.01 1spi n ILE 226 Ca -0.17 -0.50 -0.28 0.00 1.00 0.00 0.00 62.75 62.80 1spi n ILE 226 Cb 0.62 -0.76 -0.16 0.00 -0.71 0.00 0.00 39.64 38.63 1spi n ILE 226 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1spi s GLN 227 N -1.52 0.59 0.19 0.38 -0.21 -1.25 -4.45 119.66 113.38 1spi s GLN 227 Ca 0.61 -0.61 -0.32 0.00 0.02 0.00 0.00 55.36 55.06 1spi s GLN 227 Cb -0.70 -1.94 -0.11 0.00 1.00 0.00 0.00 33.01 31.26 1spi s GLN 227 CO 0.59 -0.79 1.62 -1.50 -2.12 0.00 0.00 175.29 173.08 1spi s ILE 228 N 1.83 2.39 -0.17 1.08 2.07 0.47 -4.89 121.20 123.98 1spi s ILE 228 Ca 0.03 0.29 -0.37 0.00 -1.41 0.00 0.00 60.65 59.19 1spi s ILE 228 Cb -0.17 -3.18 -0.17 0.00 0.13 0.00 0.00 42.46 39.07 1spi s ILE 228 CO -0.17 0.02 1.10 -2.65 -1.91 0.00 0.00 174.94 171.34 1spi n PRO 229 N 3.82 0.00 0.17 3.50 -0.02 -1.26 -4.50 135.00 136.71 1spi n PRO 229 Ca 0.14 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.66 1spi n PRO 229 Cb 0.37 -1.29 0.47 0.00 -0.02 0.00 0.00 33.50 33.03 1spi n PRO 229 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1spi h LYS 230 N 3.27 0.14 0.00 -0.52 1.79 -1.97 -3.40 116.57 115.88 1spi h LYS 230 Ca -0.41 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1spi h LYS 230 Cb 1.21 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1spi h LYS 230 CO 0.67 0.25 0.00 0.00 -1.08 0.00 0.00 179.45 179.30 1spi n ALA 231 N -2.50 0.00 0.00 3.86 0.00 -1.26 -4.11 120.51 116.50 1spi n ALA 231 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1spi n ALA 231 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1spi n ALA 231 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1spi n GLY 232 N 4.27 -1.62 2.03 0.00 0.00 -1.26 -4.42 105.19 104.19 1spi n GLY 232 Ca 0.00 -1.14 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 1spi n GLY 232 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1spi n LYS 233 N 0.50 3.39 -4.10 1.61 -0.00 -1.26 -4.52 118.16 113.78 1spi n LYS 233 Ca 0.00 -4.08 -0.31 0.00 -0.00 0.00 0.00 58.31 53.91 1spi n LYS 233 Cb 0.00 -2.20 -0.16 0.00 -0.00 0.00 0.00 35.03 32.67 1spi n LYS 233 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1spi s ILE 234 N -4.48 1.78 0.07 0.58 -1.09 -1.24 0.11 121.20 116.94 1spi s ILE 234 Ca 0.49 -0.77 0.07 0.00 -2.23 0.00 0.00 60.65 58.21 1spi s ILE 234 Cb 0.40 -1.63 -0.04 0.00 -1.58 0.00 0.00 42.46 39.61 1spi s ILE 234 CO 0.03 0.49 -0.16 -0.72 -1.23 0.00 0.00 174.94 173.35 1spi s TYR 235 N 1.36 2.60 -0.30 3.97 1.13 -0.91 -2.09 117.35 123.11 1spi s TYR 235 Ca 0.04 -0.23 -0.03 0.00 -1.41 0.00 0.00 57.07 55.44 1spi s TYR 235 Cb -0.13 -1.43 0.10 0.00 -1.10 0.00 0.00 41.96 39.40 1spi s TYR 235 CO -0.11 0.33 0.12 -1.12 -2.51 0.00 0.00 175.55 172.26 1spi s SER 236 N -1.77 3.71 0.15 -0.18 0.01 -1.04 -1.35 113.70 113.23 1spi s SER 236 Ca 0.17 -1.45 0.01 0.00 1.31 0.00 0.00 55.95 55.99 1spi s SER 236 Cb -0.11 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.54 1spi s SER 236 CO 0.08 -0.43 -0.00 -0.36 0.41 0.00 0.00 173.24 172.94 1spi s PHE 237 N 1.88 1.10 -1.31 2.43 0.08 -1.26 -3.11 117.98 117.79 1spi s PHE 237 Ca 0.10 -1.04 -0.14 0.00 0.12 0.00 0.00 56.93 55.97 1spi s PHE 237 Cb -0.17 -0.63 0.11 0.00 -0.57 0.00 0.00 43.02 41.77 1spi s PHE 237 CO -0.32 -0.25 1.80 -1.71 -0.10 0.00 0.00 175.22 174.65 1spi n ASN 238 N -0.19 4.81 -0.13 1.36 2.85 -1.26 -4.77 115.26 117.94 1spi n ASN 238 Ca -0.07 -2.96 0.27 0.00 -0.11 0.00 0.00 54.58 51.71 1spi n ASN 238 Cb 0.63 -1.62 0.63 0.00 1.24 0.00 0.00 39.78 40.66 1spi n ASN 238 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1spi h GLU 239 N 6.66 0.00 0.00 1.20 5.08 -2.00 -1.77 114.58 123.75 1spi h GLU 239 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1spi h GLU 239 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1spi h GLU 239 CO 1.54 0.00 0.03 0.78 -1.00 0.00 0.00 179.01 180.36 1spi h GLY 240 N 0.00 0.00 -4.81 -3.84 0.00 -2.07 -0.15 103.07 92.20 1spi h GLY 240 Ca 0.40 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 47.21 1spi h GLY 240 CO -0.00 0.00 -0.86 1.16 0.00 0.00 0.00 176.54 176.83 1spi n ASN 241 N -2.30 3.66 0.02 0.19 6.94 -0.67 -4.79 115.26 118.32 1spi n ASN 241 Ca -0.01 -3.43 -0.18 0.00 -0.02 0.00 0.00 54.58 50.93 1spi n ASN 241 Cb 0.07 -0.50 -0.12 0.00 -2.36 0.00 0.00 39.78 36.87 1spi n ASN 241 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 1spi h TYR 242 N 2.75 0.59 0.00 -2.53 5.03 -1.20 -3.35 116.97 118.26 1spi h TYR 242 Ca 0.17 -0.36 0.00 0.00 2.58 0.00 0.00 58.73 61.12 1spi h TYR 242 Cb 0.94 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 39.17 1spi h TYR 242 CO 0.72 1.21 0.00 1.17 -1.32 0.00 0.00 178.16 179.95 1spi n LYS 243 N -4.18 0.49 -0.23 1.82 4.81 -1.26 -2.41 118.16 117.21 1spi n LYS 243 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.32 1spi n LYS 243 Cb 0.73 -1.25 0.00 0.00 0.02 0.00 0.00 35.03 34.53 1spi n LYS 243 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1spi n MET 244 N 1.29 0.00 -3.78 1.64 1.56 -1.26 -5.11 117.12 111.47 1spi n MET 244 Ca 0.00 -0.24 -0.22 0.00 -0.27 0.00 0.00 57.70 56.97 1spi n MET 244 Cb 0.25 -0.17 -0.04 0.00 2.15 0.00 0.00 33.22 35.41 1spi n MET 244 CO 0.00 0.00 0.00 -1.58 -0.73 0.00 0.00 175.97 173.66 1spi s TRP 245 N 0.00 2.72 0.31 1.12 0.51 -1.01 -2.58 118.94 120.01 1spi s TRP 245 Ca 0.00 -0.47 -0.29 0.00 -2.12 0.00 0.00 56.10 53.22 1spi s TRP 245 Cb 0.00 -2.01 -0.10 0.00 -0.81 0.00 0.00 33.47 30.55 1spi s TRP 245 CO 0.00 0.04 1.22 -1.25 -0.51 0.00 0.00 176.95 176.46 1spi s PRO 246 N -4.03 4.47 0.44 4.98 0.04 -1.26 -4.76 135.00 134.87 1spi s PRO 246 Ca 0.44 2.05 0.22 0.00 0.04 0.00 0.00 61.00 63.75 1spi s PRO 246 Cb -0.02 -3.12 1.20 0.00 0.04 0.00 0.00 34.50 32.60 1spi s PRO 246 CO 0.26 -0.03 1.81 -0.44 0.04 0.00 0.00 177.00 178.64 1spi h ASP 247 N 3.61 0.33 -0.22 6.66 5.19 -1.97 0.77 116.42 130.78 1spi h ASP 247 Ca -0.48 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.05 1spi h ASP 247 Cb 1.22 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.72 1spi h ASP 247 CO 0.66 0.08 0.18 0.11 -3.12 0.00 0.00 179.24 177.16 1spi h LYS 248 N 0.30 0.00 0.03 3.56 1.57 -1.89 -2.31 116.57 117.84 1spi h LYS 248 Ca 0.54 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.98 1spi h LYS 248 Cb 1.56 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.82 1spi h LYS 248 CO -0.20 0.00 -1.93 -0.11 -0.57 0.00 0.00 179.45 176.64 1spi n LEU 249 N -4.23 2.22 -0.02 2.94 0.00 0.12 -4.31 117.00 113.72 1spi n LEU 249 Ca 0.02 0.27 0.22 0.00 0.00 0.00 0.00 56.01 56.53 1spi n LEU 249 Cb 0.32 -0.96 0.71 0.00 0.00 0.00 0.00 43.42 43.50 1spi n LEU 249 CO 0.33 0.58 1.20 0.11 0.00 0.00 0.00 177.39 179.61 1spi h LYS 250 N -0.61 0.00 -0.31 1.96 1.57 -0.66 0.50 116.57 119.01 1spi h LYS 250 Ca -0.49 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.12 1spi h LYS 250 Cb 1.64 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.94 1spi h LYS 250 CO -0.18 0.00 -0.49 1.57 -0.57 0.00 0.00 179.45 179.78 1spi h LYS 251 N 0.00 0.86 -0.34 3.15 2.10 -1.65 -3.05 116.57 117.64 1spi h LYS 251 Ca 0.28 -0.51 0.08 0.00 -2.00 0.00 0.00 60.65 58.50 1spi h LYS 251 Cb 1.19 0.05 -0.08 0.00 -0.90 0.00 0.00 32.23 32.49 1spi h LYS 251 CO -0.00 1.15 -0.23 -0.92 -2.00 0.00 0.00 179.45 177.45 1spi h TYR 252 N 0.67 -0.59 -1.06 0.07 3.20 -0.21 0.28 116.97 119.32 1spi h TYR 252 Ca 0.03 0.04 0.28 0.00 3.14 0.00 0.00 58.73 62.23 1spi h TYR 252 Cb 1.09 0.31 -0.10 0.00 1.54 0.00 0.00 36.73 39.57 1spi h TYR 252 CO 0.07 -0.30 0.68 0.52 -1.64 0.00 0.00 178.16 177.48 1spi h MET 253 N -0.18 0.37 -0.01 1.82 0.00 -1.28 0.14 114.93 115.79 1spi h MET 253 Ca 0.17 -0.02 -0.17 0.00 0.00 0.00 0.00 59.70 59.68 1spi h MET 253 Cb 0.45 -0.08 -0.02 0.00 0.00 0.00 0.00 31.60 31.95 1spi h MET 253 CO -0.45 0.24 -0.78 0.22 0.00 0.00 0.00 176.91 176.14 1spi h ASP 254 N 0.38 0.13 -0.00 1.22 1.82 -0.49 -2.91 116.42 116.57 1spi h ASP 254 Ca 0.63 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 57.17 1spi h ASP 254 Cb 1.59 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 41.56 1spi h ASP 254 CO -0.34 0.86 0.00 0.47 -1.61 0.00 0.00 179.24 178.62 1spi n ASP 255 N -3.67 0.40 -0.08 2.28 8.00 0.48 0.28 116.55 124.23 1spi n ASP 255 Ca -0.02 -2.00 -0.10 0.00 0.71 0.00 0.00 54.79 53.38 1spi n ASP 255 Cb 0.75 -0.19 -0.09 0.00 -0.02 0.00 0.00 41.12 41.56 1spi n ASP 255 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1spi n LEU 256 N -0.30 1.80 0.08 0.64 4.32 -1.10 -4.54 117.00 117.89 1spi n LEU 256 Ca 0.00 -0.06 -0.22 0.00 -0.02 0.00 0.00 56.01 55.72 1spi n LEU 256 Cb 0.10 -0.23 -0.15 0.00 -1.62 0.00 0.00 43.42 41.51 1spi n LEU 256 CO 0.00 0.61 -0.15 0.11 -1.22 0.00 0.00 177.39 176.74 1spi h LYS 257 N 0.00 0.38 -3.17 3.23 1.57 -1.24 -3.37 116.57 113.96 1spi h LYS 257 Ca -0.38 -0.64 -0.74 0.00 -1.87 0.00 0.00 60.65 57.01 1spi h LYS 257 Cb 1.70 0.24 -0.32 0.00 0.08 0.00 0.00 32.23 33.92 1spi h LYS 257 CO -0.03 1.31 0.22 0.39 -0.57 0.00 0.00 179.45 180.76 1spi n GLU 258 N -3.94 3.32 -0.89 3.15 4.71 0.14 -4.98 120.64 122.15 1spi n GLU 258 Ca -0.17 -4.51 -0.28 0.00 -0.01 0.00 0.00 57.16 52.19 1spi n GLU 258 Cb 0.94 -2.46 0.04 0.00 -1.01 0.00 0.00 31.44 28.95 1spi n GLU 258 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 1spi n PRO 259 N 2.01 -0.20 0.18 3.49 -0.02 -1.26 -4.73 135.00 134.46 1spi n PRO 259 Ca 0.24 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1spi n PRO 259 Cb 0.37 -1.06 0.00 0.00 -0.02 0.00 0.00 33.50 32.79 1spi n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1spi n GLY 260 N 3.23 -1.11 0.14 -1.23 0.00 -1.26 -4.89 105.19 100.07 1spi n GLY 260 Ca -0.01 0.19 0.08 0.00 0.00 0.00 0.00 46.02 46.29 1spi n GLY 260 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1spi n GLU 261 N -3.33 0.11 -1.61 1.61 1.02 -1.26 -4.87 120.64 112.32 1spi n GLU 261 Ca 0.00 0.59 -0.00 0.00 -0.02 0.00 0.00 57.16 57.73 1spi n GLU 261 Cb 0.00 -1.94 -0.00 0.00 -0.02 0.00 0.00 31.44 29.48 1spi n GLU 261 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1spi n SER 262 N -2.08 -2.12 -0.09 1.62 7.64 -1.26 -5.13 113.62 112.21 1spi n SER 262 Ca -0.01 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1spi n SER 262 Cb 0.11 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 61.91 1spi n SER 262 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1spi n GLN 263 N 0.12 0.00 -2.56 1.43 3.00 -1.26 -5.16 117.38 112.96 1spi n GLN 263 Ca -0.02 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.59 1spi n GLN 263 Cb 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 30.24 30.23 1spi n GLN 263 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 1spi s LYS 264 N 0.73 4.39 0.76 -1.09 2.20 -1.26 -5.02 119.74 120.45 1spi s LYS 264 Ca 0.00 1.58 -0.11 0.00 -0.36 0.00 0.00 55.97 57.08 1spi s LYS 264 Cb 0.00 -2.80 0.05 0.00 -1.51 0.00 0.00 37.83 33.57 1spi s LYS 264 CO 0.00 0.04 1.10 -2.14 -0.36 0.00 0.00 175.35 173.99 1spi s PRO 265 N -2.07 2.29 -0.45 4.03 0.02 -1.26 -5.00 135.00 132.56 1spi s PRO 265 Ca 0.52 1.21 -0.21 0.00 0.02 0.00 0.00 61.00 62.54 1spi s PRO 265 Cb -0.25 -1.90 0.03 0.00 0.02 0.00 0.00 34.50 32.40 1spi s PRO 265 CO 0.31 -1.62 0.67 0.71 -0.33 0.00 0.00 177.00 176.74 1spi s TYR 266 N -2.82 3.04 0.59 6.54 1.51 -1.26 -4.94 117.35 120.01 1spi s TYR 266 Ca 0.62 -0.09 -0.10 0.00 -1.01 0.00 0.00 57.07 56.49 1spi s TYR 266 Cb -0.18 -3.45 -0.04 0.00 -0.11 0.00 0.00 41.96 38.18 1spi s TYR 266 CO 0.54 -0.93 0.98 0.45 -1.11 0.00 0.00 175.55 175.48 1spi s SER 267 N 2.15 6.25 0.06 2.29 0.15 0.12 -4.89 113.70 119.83 1spi s SER 267 Ca 0.23 1.33 0.00 0.00 0.70 0.00 0.00 55.95 58.21 1spi s SER 267 Cb -0.14 -2.43 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 1spi s SER 267 CO 0.19 -0.80 -0.05 -0.94 1.20 0.00 0.00 173.24 172.84 1spi s SER 268 N -4.11 0.72 -0.30 5.45 1.04 -1.26 -2.15 113.70 113.09 1spi s SER 268 Ca 0.54 -0.89 -0.15 0.00 0.48 0.00 0.00 55.95 55.92 1spi s SER 268 Cb -0.11 0.13 0.16 0.00 0.10 0.00 0.00 66.02 66.30 1spi s SER 268 CO 0.51 -0.48 0.97 0.00 0.98 0.00 0.00 173.24 175.22 1spi s ARG 269 N -3.35 0.33 -0.21 4.02 1.70 -0.46 -4.91 118.95 116.07 1spi s ARG 269 Ca 0.04 0.75 0.01 0.00 -0.47 0.00 0.00 55.73 56.07 1spi s ARG 269 Cb 0.03 0.38 0.03 0.00 -0.57 0.00 0.00 34.95 34.83 1spi s ARG 269 CO -0.06 -0.10 -0.15 -0.47 -1.08 0.00 0.00 175.30 173.44 1spi s TYR 270 N 2.22 2.98 -0.14 5.89 5.04 -1.26 -4.39 117.35 127.70 1spi s TYR 270 Ca -0.04 -1.87 -0.20 0.00 -2.44 0.00 0.00 57.07 52.52 1spi s TYR 270 Cb -0.06 -1.94 -0.18 0.00 0.35 0.00 0.00 41.96 40.13 1spi s TYR 270 CO -0.17 -0.82 0.47 0.82 -1.34 0.00 0.00 175.55 174.51 1spi h ILE 271 N 6.24 1.18 0.00 3.14 2.04 -1.98 -3.49 117.51 124.64 1spi h ILE 271 Ca -0.35 -1.95 0.00 0.00 1.00 0.00 0.00 64.86 63.56 1spi h ILE 271 Cb 1.10 2.29 0.00 0.00 -0.74 0.00 0.00 36.82 39.47 1spi h ILE 271 CO 0.57 0.40 0.00 0.61 0.00 0.00 0.00 178.15 179.73 1spi n GLY 272 N 1.63 0.09 2.85 5.37 0.00 -1.26 -5.06 105.19 108.80 1spi n GLY 272 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.77 1spi n GLY 272 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1spi s SER 273 N -0.16 0.22 0.01 1.61 0.15 -1.26 -4.78 113.70 109.50 1spi s SER 273 Ca 0.00 -0.01 -0.03 0.00 0.70 0.00 0.00 55.95 56.61 1spi s SER 273 Cb 0.00 -0.09 -0.01 0.00 -1.71 0.00 0.00 66.02 64.21 1spi s SER 273 CO 0.00 -0.05 1.05 -0.07 1.20 0.00 0.00 173.24 175.38 1spi h LEU 274 N 6.70 -0.19 -1.17 3.45 3.38 -1.97 -1.76 115.31 123.74 1spi h LEU 274 Ca -0.35 0.03 0.32 0.00 0.09 0.00 0.00 57.88 57.97 1spi h LEU 274 Cb 1.17 0.08 -0.13 0.00 0.09 0.00 0.00 40.66 41.87 1spi h LEU 274 CO 0.49 -0.03 0.65 0.58 0.09 0.00 0.00 178.44 180.22 1spi h VAL 275 N -0.02 0.35 0.18 1.22 2.07 -1.91 0.94 116.25 119.08 1spi h VAL 275 Ca 0.01 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1spi h VAL 275 Cb 0.05 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1spi h VAL 275 CO -0.07 0.06 -0.09 1.23 0.02 0.00 0.00 177.57 178.72 1spi h GLY 276 N 0.33 -0.25 0.79 2.17 0.00 -1.63 -1.02 103.07 103.45 1spi h GLY 276 Ca 0.71 0.09 -0.04 0.00 0.00 0.00 0.00 47.33 48.09 1spi h GLY 276 CO -0.48 -0.09 -0.43 -0.55 0.00 0.00 0.00 176.54 175.00 1spi h ASP 277 N -0.59 -1.04 -0.68 0.19 3.32 0.70 0.41 116.42 118.72 1spi h ASP 277 Ca -0.02 0.05 0.15 0.00 0.02 0.00 0.00 57.03 57.22 1spi h ASP 277 Cb 0.44 0.29 -0.12 0.00 0.22 0.00 0.00 39.33 40.16 1spi h ASP 277 CO 0.04 -0.69 -0.04 0.15 -1.72 0.00 0.00 179.24 176.98 1spi h PHE 278 N -1.12 -0.13 0.47 4.55 3.57 0.50 0.62 116.94 125.41 1spi h PHE 278 Ca -0.11 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1spi h PHE 278 Cb 0.88 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 1spi h PHE 278 CO -0.02 -0.23 -0.49 1.25 -2.23 0.00 0.00 178.31 176.59 1spi h HIS 279 N 0.08 -1.36 -0.11 0.41 2.76 -0.89 0.56 115.15 116.61 1spi h HIS 279 Ca 0.36 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.57 1spi h HIS 279 Cb 0.59 0.53 -0.00 0.00 1.55 0.00 0.00 27.41 30.08 1spi h HIS 279 CO -0.43 -0.65 0.27 -0.09 -1.30 0.00 0.00 177.93 175.72 1spi h ARG 280 N -0.97 0.00 0.03 5.26 2.43 0.16 -0.96 114.38 120.33 1spi h ARG 280 Ca -0.05 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 1spi h ARG 280 Cb 0.85 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.39 1spi h ARG 280 CO -0.08 0.00 -0.90 1.15 -1.51 0.00 0.00 179.97 178.63 1spi h THR 281 N 0.00 1.23 -0.50 0.20 2.02 0.21 -2.85 112.91 113.22 1spi h THR 281 Ca 0.05 -2.30 0.15 0.00 0.77 0.00 0.00 66.41 65.08 1spi h THR 281 Cb 0.58 2.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.71 1spi h THR 281 CO -0.00 0.51 0.40 0.25 0.37 0.00 0.00 175.52 177.05 1spi h LEU 282 N -0.81 0.00 0.02 2.58 5.85 0.14 0.28 115.31 123.37 1spi h LEU 282 Ca -0.22 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.15 1spi h LEU 282 Cb 1.34 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.31 1spi h LEU 282 CO -0.07 0.00 -2.11 0.18 -0.34 0.00 0.00 178.44 176.10 1spi n LEU 283 N -4.18 1.26 -0.04 2.25 4.77 -0.82 -3.96 117.00 116.28 1spi n LEU 283 Ca 0.09 0.15 0.01 0.00 -0.03 0.00 0.00 56.01 56.24 1spi n LEU 283 Cb 0.61 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.45 1spi n LEU 283 CO 0.34 0.60 -0.81 -1.22 -1.33 0.00 0.00 177.39 174.97 1spi n TYR 284 N -3.06 0.00 0.00 -1.77 4.02 -1.02 -4.82 117.16 110.50 1spi n TYR 284 Ca -0.30 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.59 1spi n TYR 284 Cb 1.08 -0.52 0.00 0.00 -0.02 0.00 0.00 39.34 39.88 1spi n TYR 284 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1spi n GLY 285 N 1.82 2.30 0.00 2.72 0.00 0.94 -4.77 105.19 108.20 1spi n GLY 285 Ca -0.12 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1spi n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1spi n GLY 286 N 1.79 0.35 2.96 -0.02 0.00 -1.26 -4.03 105.19 104.98 1spi n GLY 286 Ca 0.00 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 1spi n GLY 286 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1spi s ILE 287 N -3.57 0.13 -0.07 -0.61 1.10 -0.89 -2.37 121.20 114.93 1spi s ILE 287 Ca 0.00 -0.65 -0.20 0.00 -0.51 0.00 0.00 60.65 59.29 1spi s ILE 287 Cb 0.00 -0.23 0.04 0.00 0.15 0.00 0.00 42.46 42.42 1spi s ILE 287 CO 0.00 -0.33 0.46 -0.47 -2.11 0.00 0.00 174.94 172.48 1spi s TYR 288 N -1.01 -0.41 0.00 3.50 5.04 -0.70 -2.49 117.35 121.29 1spi s TYR 288 Ca -0.10 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 1spi s TYR 288 Cb -0.07 0.20 0.00 0.00 0.35 0.00 0.00 41.96 42.44 1spi s TYR 288 CO -0.01 -0.41 0.00 0.41 -1.34 0.00 0.00 175.55 174.21 1spi n GLY 289 N 1.64 0.34 3.65 8.97 0.00 -1.18 0.28 105.19 118.88 1spi n GLY 289 Ca -0.18 0.62 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 1spi n GLY 289 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1spi s TYR 290 N 0.00 1.74 0.62 1.61 6.14 -1.23 -4.83 117.35 121.41 1spi s TYR 290 Ca 0.00 0.04 -0.02 0.00 0.64 0.00 0.00 57.07 57.73 1spi s TYR 290 Cb 0.00 -4.02 0.05 0.00 0.42 0.00 0.00 41.96 38.41 1spi s TYR 290 CO 0.00 -4.30 0.88 -1.25 0.64 0.00 0.00 175.55 171.52 1spi s PRO 291 N 4.32 2.33 -0.02 4.97 0.04 -1.26 -2.94 135.00 142.45 1spi s PRO 291 Ca 0.79 -0.60 -0.20 0.00 0.04 0.00 0.00 61.00 61.03 1spi s PRO 291 Cb -0.35 -2.35 -0.05 0.00 0.04 0.00 0.00 34.50 31.78 1spi s PRO 291 CO 0.33 -0.98 0.56 -0.98 0.04 0.00 0.00 177.00 175.97 1spi s ARG 292 N -4.98 4.28 0.24 4.56 1.70 -1.26 -4.75 118.95 118.73 1spi s ARG 292 Ca 0.59 0.66 0.04 0.00 -0.47 0.00 0.00 55.73 56.55 1spi s ARG 292 Cb -0.10 -3.34 -0.01 0.00 -0.57 0.00 0.00 34.95 30.92 1spi s ARG 292 CO 0.41 0.38 0.14 -0.40 -1.08 0.00 0.00 175.30 174.74 1spi n ASP 293 N 2.75 0.39 0.00 -2.89 5.68 -1.22 -4.33 116.55 116.94 1spi n ASP 293 Ca -0.08 -2.43 0.00 0.00 -0.50 0.00 0.00 54.79 51.79 1spi n ASP 293 Cb 0.51 0.87 0.00 0.00 -1.14 0.00 0.00 41.12 41.36 1spi n ASP 293 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1spi n ALA 294 N -1.63 0.00 -0.33 2.12 0.00 -1.07 -2.51 120.51 117.09 1spi n ALA 294 Ca -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.32 1spi n ALA 294 Cb 0.40 0.34 0.11 0.00 0.00 0.00 0.00 19.45 20.30 1spi n ALA 294 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1spi h LYS 295 N 0.00 1.25 -2.37 0.00 1.57 -1.99 -2.95 116.57 112.08 1spi h LYS 295 Ca 0.00 -0.13 -0.81 0.00 -1.87 0.00 0.00 60.65 57.84 1spi h LYS 295 Cb 0.00 -0.26 -0.27 0.00 0.08 0.00 0.00 32.23 31.79 1spi h LYS 295 CO 0.00 0.89 1.03 -1.13 -0.57 0.00 0.00 179.45 179.67 1spi n SER 296 N -4.34 7.22 -0.45 0.86 3.41 -1.10 -4.80 113.62 114.41 1spi n SER 296 Ca 0.10 -3.63 0.38 0.00 -0.26 0.00 0.00 58.87 55.46 1spi n SER 296 Cb 0.08 -1.19 0.69 0.00 -0.26 0.00 0.00 64.21 63.52 1spi n SER 296 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1spi h LYS 297 N 4.43 0.10 -4.38 4.33 3.11 -1.31 -3.16 116.57 119.69 1spi h LYS 297 Ca 0.49 -0.01 -0.66 0.00 -2.81 0.00 0.00 60.65 57.66 1spi h LYS 297 Cb 0.37 -0.02 -0.39 0.00 -1.00 0.00 0.00 32.23 31.18 1spi h LYS 297 CO 1.22 0.06 -0.67 -0.80 -2.81 0.00 0.00 179.45 176.45 1spi s ASN 298 N -4.63 4.75 0.09 4.20 -0.87 -1.26 -4.53 114.94 112.69 1spi s ASN 298 Ca -0.07 -2.33 0.00 0.00 -1.57 0.00 0.00 52.86 48.89 1spi s ASN 298 Cb 0.27 -1.66 0.00 0.00 -0.02 0.00 0.00 41.25 39.84 1spi s ASN 298 CO 0.83 -0.37 0.00 0.61 -2.57 0.00 0.00 177.10 175.60 1spi n GLY 299 N 4.04 1.33 1.20 0.66 0.00 -1.20 -4.16 105.19 107.06 1spi n GLY 299 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1spi n GLY 299 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1spi n LYS 300 N 12.54 0.00 -1.62 1.61 0.00 -1.26 -4.75 118.16 124.67 1spi n LYS 300 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 58.31 57.83 1spi n LYS 300 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 34.98 1spi n LYS 300 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1spi n LEU 301 N -1.98 2.26 -4.76 3.14 4.77 -1.26 -4.48 117.00 114.69 1spi n LEU 301 Ca 0.00 1.12 -0.34 0.00 -0.03 0.00 0.00 56.01 56.76 1spi n LEU 301 Cb 0.00 -1.30 0.05 0.00 -2.33 0.00 0.00 43.42 39.84 1spi n LEU 301 CO 0.00 -0.80 0.76 -0.13 -1.33 0.00 0.00 177.39 175.89 1spi s ARG 302 N 0.27 2.74 0.22 3.23 0.52 -1.26 -2.55 118.95 122.12 1spi s ARG 302 Ca 0.78 1.51 -0.06 0.00 -0.52 0.00 0.00 55.73 57.44 1spi s ARG 302 Cb -0.81 -1.93 0.19 0.00 0.52 0.00 0.00 34.95 32.92 1spi s ARG 302 CO 0.46 -1.32 1.68 1.25 0.02 0.00 0.00 175.30 177.39 1spi h LEU 303 N 0.14 0.90 0.00 2.53 5.85 -0.51 -2.46 115.31 121.76 1spi h LEU 303 Ca -0.47 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1spi h LEU 303 Cb 1.26 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1spi h LEU 303 CO 0.54 0.98 0.00 0.18 -0.34 0.00 0.00 178.44 179.80 1spi n LEU 304 N -4.18 0.00 0.00 2.25 4.77 -1.26 -2.62 117.00 115.96 1spi n LEU 304 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1spi n LEU 304 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1spi n LEU 304 CO 0.43 0.00 0.00 -1.22 -1.33 0.00 0.00 177.39 175.27 1spi n TYR 305 N 0.00 0.00 -0.67 -1.77 4.02 -1.26 -1.50 117.16 115.97 1spi n TYR 305 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1spi n TYR 305 Cb 0.00 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 38.88 1spi n TYR 305 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1spi n GLU 306 N -3.03 -0.28 -0.08 -0.72 0.28 -1.24 -4.76 120.64 110.80 1spi n GLU 306 Ca 0.00 -0.19 -0.13 0.00 -0.16 0.00 0.00 57.16 56.68 1spi n GLU 306 Cb 0.00 -0.66 -0.07 0.00 1.43 0.00 0.00 31.44 32.14 1spi n GLU 306 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1spi h ALA 308 N -0.20 -0.00 -0.30 0.00 0.00 -1.19 0.66 119.26 118.22 1spi h ALA 308 Ca -0.37 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 1spi h ALA 308 Cb 1.47 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1spi h ALA 308 CO -0.12 -0.31 -0.04 -1.00 0.00 0.00 0.00 179.25 177.78 1spi h PRO 309 N -0.38 0.48 0.00 0.00 0.13 -1.86 -1.55 132.00 128.81 1spi h PRO 309 Ca -0.00 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1spi h PRO 309 Cb 0.38 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.45 1spi h PRO 309 CO 0.00 0.54 0.00 0.52 -0.23 0.00 0.00 178.00 178.83 1spi h MET 310 N 0.45 0.00 0.06 0.86 2.86 -1.77 -3.28 114.93 114.12 1spi h MET 310 Ca 0.10 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.60 1spi h MET 310 Cb 0.36 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 1spi h MET 310 CO 0.02 0.00 -0.66 0.77 1.06 0.00 0.00 176.91 178.10 1spi h SER 311 N 0.00 0.19 0.00 1.22 0.02 0.08 -3.23 113.55 111.83 1spi h SER 311 Ca 0.00 -0.89 0.00 0.00 -0.84 0.00 0.00 61.79 60.06 1spi h SER 311 Cb 0.80 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.28 1spi h SER 311 CO 0.00 1.29 0.04 0.15 -1.14 0.00 0.00 176.83 177.17 1spi h PHE 312 N -0.71 0.00 0.00 3.45 3.57 -1.43 -1.31 116.94 120.51 1spi h PHE 312 Ca -0.14 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1spi h PHE 312 Cb 1.35 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.09 1spi h PHE 312 CO 0.20 0.00 -0.08 0.82 -2.23 0.00 0.00 178.31 177.02 1spi h ILE 313 N 0.00 0.00 0.00 1.41 2.04 -1.66 -2.86 117.51 116.44 1spi h ILE 313 Ca 0.00 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.87 1spi h ILE 313 Cb 0.08 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 1spi h ILE 313 CO 0.00 0.00 0.16 1.62 0.00 0.00 0.00 178.15 179.93 1spi h VAL 314 N -0.99 0.00 0.00 1.67 3.04 -1.53 0.94 116.25 119.38 1spi h VAL 314 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1spi h VAL 314 Cb 0.08 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 29.85 1spi h VAL 314 CO 0.00 0.00 -0.96 -0.62 -1.01 0.00 0.00 177.57 174.98 1spi n GLU 315 N -2.36 0.19 0.00 4.17 1.02 -0.51 -2.60 120.64 120.54 1spi n GLU 315 Ca -0.01 -0.01 0.10 0.00 -0.02 0.00 0.00 57.16 57.21 1spi n GLU 315 Cb 0.20 -1.55 -0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1spi n GLU 315 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1spi n GLN 316 N -1.79 1.39 -0.05 3.49 1.13 0.30 -4.33 117.38 117.52 1spi n GLN 316 Ca 0.03 -0.93 0.04 0.00 -1.94 0.00 0.00 57.00 54.20 1spi n GLN 316 Cb 0.40 -1.40 0.06 0.00 0.11 0.00 0.00 30.24 29.41 1spi n GLN 316 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1spi n ALA 317 N -0.06 2.36 0.00 -1.58 0.00 0.12 -3.95 120.51 117.39 1spi n ALA 317 Ca 0.08 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1spi n ALA 317 Cb 0.42 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1spi n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1spi n GLY 318 N 0.39 3.10 0.00 0.00 0.00 -1.21 0.18 105.19 107.65 1spi n GLY 318 Ca 0.06 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1spi n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1spi n GLY 319 N 0.00 0.20 3.23 -0.02 0.00 -1.07 -4.77 105.19 102.76 1spi n GLY 319 Ca 0.00 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 1spi n GLY 319 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1spi s LYS 320 N 0.12 1.15 0.03 1.61 -0.14 -1.07 -4.13 119.74 117.30 1spi s LYS 320 Ca 0.00 -1.58 0.05 0.00 -1.36 0.00 0.00 55.97 53.08 1spi s LYS 320 Cb 0.00 -0.08 -0.02 0.00 -1.68 0.00 0.00 37.83 36.05 1spi s LYS 320 CO 0.00 -0.23 -0.15 0.20 -0.76 0.00 0.00 175.35 174.42 1spi s GLY 321 N -3.17 0.79 -0.21 -3.33 0.00 -1.26 -3.21 107.32 96.92 1spi s GLY 321 Ca 0.29 -0.79 -0.29 0.00 0.00 0.00 0.00 44.72 43.93 1spi s GLY 321 CO 0.07 -0.74 1.09 -1.35 0.00 0.00 0.00 173.10 172.17 1spi s SER 322 N -0.93 -0.30 0.00 1.64 1.04 -0.79 -1.03 113.70 113.32 1spi s SER 322 Ca 0.03 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1spi s SER 322 Cb -0.07 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1spi s SER 322 CO 0.01 -0.24 0.73 -0.90 0.98 0.00 0.00 173.24 173.82 1spi n ASP 323 N 0.98 1.97 0.00 7.02 5.75 -0.85 -2.56 116.55 128.86 1spi n ASP 323 Ca -0.09 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1spi n ASP 323 Cb 0.58 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1spi n ASP 323 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1spi n GLY 324 N 0.28 2.02 0.00 6.12 0.00 -1.26 -4.79 105.19 107.56 1spi n GLY 324 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1spi n GLY 324 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1spi n HIS 325 N 0.00 0.00 -3.15 1.61 -0.00 -1.26 -4.87 115.22 107.55 1spi n HIS 325 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.37 1spi n HIS 325 Cb 0.00 -0.18 -0.06 0.00 -0.00 0.00 0.00 29.99 29.75 1spi n HIS 325 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.34 177.48 1spi s GLN 326 N -0.62 4.16 0.09 -1.40 -2.07 -1.26 -5.01 119.66 113.55 1spi s GLN 326 Ca 0.00 0.76 -0.32 0.00 -1.82 0.00 0.00 55.36 53.99 1spi s GLN 326 Cb 0.00 -2.82 -0.11 0.00 -1.09 0.00 0.00 33.01 28.99 1spi s GLN 326 CO 0.00 0.37 1.83 -2.13 -1.32 0.00 0.00 175.29 174.04 1spi n ARG 327 N 0.56 2.66 0.00 9.60 0.63 -1.26 -2.00 116.66 126.84 1spi n ARG 327 Ca -0.02 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 57.88 1spi n ARG 327 Cb 0.51 -2.85 0.00 0.00 0.45 0.00 0.00 32.46 30.57 1spi n ARG 327 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1spi n ILE 328 N 4.72 0.36 -0.63 5.15 5.41 -0.20 -2.22 119.36 131.96 1spi n ILE 328 Ca 0.19 0.39 0.09 0.00 1.00 0.00 0.00 62.75 64.41 1spi n ILE 328 Cb 0.36 -1.39 0.37 0.00 -0.71 0.00 0.00 39.64 38.26 1spi n ILE 328 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1spi n LEU 329 N -1.01 4.90 -0.02 1.39 4.77 -1.26 -3.97 117.00 121.81 1spi n LEU 329 Ca 0.00 -2.48 0.06 0.00 -0.03 0.00 0.00 56.01 53.57 1spi n LEU 329 Cb 0.30 -0.60 -0.13 0.00 -2.33 0.00 0.00 43.42 40.65 1spi n LEU 329 CO 0.00 0.77 -0.75 0.47 -1.33 0.00 0.00 177.39 176.55 1spi n ASP 330 N 1.05 1.04 -4.57 -1.43 8.00 -0.94 -4.59 116.55 115.10 1spi n ASP 330 Ca 0.26 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.54 1spi n ASP 330 Cb 0.94 1.66 -0.07 0.00 -0.02 0.00 0.00 41.12 43.62 1spi n ASP 330 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1spi s ILE 331 N -3.08 3.31 -0.36 0.53 1.01 -1.25 -4.90 121.20 116.45 1spi s ILE 331 Ca -0.07 -0.43 -0.41 0.00 0.00 0.00 0.00 60.65 59.74 1spi s ILE 331 Cb 0.10 -4.06 -0.16 0.00 0.01 0.00 0.00 42.46 38.35 1spi s ILE 331 CO 0.71 -0.59 1.85 1.67 0.00 0.00 0.00 174.94 178.58 1spi n GLN 332 N 8.46 0.78 -1.87 2.79 7.27 -1.26 -4.76 117.38 128.79 1spi n GLN 332 Ca 0.43 0.27 -0.43 0.00 0.07 0.00 0.00 57.00 57.34 1spi n GLN 332 Cb 0.46 -1.97 -0.03 0.00 2.41 0.00 0.00 30.24 31.11 1spi n GLN 332 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1spi s PRO 333 N 4.23 3.66 -0.02 3.69 0.02 -1.26 -4.86 135.00 140.47 1spi s PRO 333 Ca 1.04 1.96 0.08 0.00 0.02 0.00 0.00 61.00 64.10 1spi s PRO 333 Cb -1.17 -4.16 0.22 0.00 0.02 0.00 0.00 34.50 29.41 1spi s PRO 333 CO 0.66 -1.48 1.18 -2.37 -0.33 0.00 0.00 177.00 174.67 1spi n THR 334 N 6.65 1.17 -4.04 0.99 5.66 -1.26 -4.56 114.28 118.88 1spi n THR 334 Ca 0.22 -1.16 -0.14 0.00 -3.05 0.00 0.00 64.05 59.92 1spi n THR 334 Cb 0.44 0.39 -0.02 0.00 -1.55 0.00 0.00 70.33 69.58 1spi n THR 334 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1spi s GLU 335 N -1.28 2.05 0.00 1.09 2.12 -1.26 -5.10 118.70 116.31 1spi s GLU 335 Ca 0.18 -1.76 0.00 0.00 0.36 0.00 0.00 54.97 53.74 1spi s GLU 335 Cb 0.11 0.48 0.00 0.00 0.26 0.00 0.00 34.13 34.98 1spi s GLU 335 CO 0.09 -0.88 0.00 0.44 -0.54 0.00 0.00 175.26 174.38 1spi n ILE 336 N -0.59 0.00 -0.89 -3.70 -5.35 -1.26 -4.12 119.36 103.45 1spi n ILE 336 Ca -0.01 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.35 1spi n ILE 336 Cb 0.61 -0.51 -0.14 0.00 -1.74 0.00 0.00 39.64 37.86 1spi n ILE 336 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1spi n HIS 337 N 0.00 0.15 -1.48 4.28 8.25 -1.26 -4.92 115.22 120.24 1spi n HIS 337 Ca 0.00 -1.41 -0.49 0.00 -0.26 0.00 0.00 57.72 55.57 1spi n HIS 337 Cb 0.00 -1.50 -0.06 0.00 1.12 0.00 0.00 29.99 29.55 1spi n HIS 337 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1spi n GLN 338 N 2.65 1.22 -3.34 -0.41 7.27 -1.26 -4.88 117.38 118.63 1spi n GLN 338 Ca 0.40 0.32 -0.36 0.00 0.07 0.00 0.00 57.00 57.43 1spi n GLN 338 Cb 0.76 -2.62 -0.06 0.00 2.41 0.00 0.00 30.24 30.73 1spi n GLN 338 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1spi s ARG 339 N 6.35 4.01 -0.20 3.69 0.52 -1.26 0.25 118.95 132.31 1spi s ARG 339 Ca 1.08 0.53 -0.11 0.00 -0.52 0.00 0.00 55.73 56.71 1spi s ARG 339 Cb -0.75 -2.96 0.06 0.00 0.52 0.00 0.00 34.95 31.82 1spi s ARG 339 CO 0.46 0.49 0.48 0.08 0.02 0.00 0.00 175.30 176.83 1spi s VAL 340 N -1.43 -0.02 0.46 3.52 1.01 -1.06 -4.55 120.40 118.34 1spi s VAL 340 Ca 0.37 0.06 -0.20 0.00 0.00 0.00 0.00 61.98 62.21 1spi s VAL 340 Cb -0.16 -0.71 -0.13 0.00 0.00 0.00 0.00 36.38 35.38 1spi s VAL 340 CO 0.19 0.03 0.21 -0.81 0.00 0.00 0.00 175.10 174.72 1spi n PRO 341 N 4.16 0.22 -3.84 2.72 -0.04 -1.26 -4.37 135.00 132.60 1spi n PRO 341 Ca -0.22 0.08 -0.12 0.00 -0.04 0.00 0.00 63.50 63.21 1spi n PRO 341 Cb 0.56 -1.24 -0.11 0.00 -0.04 0.00 0.00 33.50 32.67 1spi n PRO 341 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1spi s LEU 342 N 3.28 1.44 -0.01 1.53 0.20 -1.15 -4.37 118.68 119.60 1spi s LEU 342 Ca 0.61 0.11 -0.00 0.00 0.69 0.00 0.00 54.13 55.54 1spi s LEU 342 Cb -0.56 0.62 0.01 0.00 -0.43 0.00 0.00 46.19 45.83 1spi s LEU 342 CO 0.61 -0.19 0.02 -0.31 -0.29 0.00 0.00 176.35 176.19 1spi s TYR 343 N -0.52 -0.01 -0.10 5.38 1.51 -1.06 -3.50 117.35 119.05 1spi s TYR 343 Ca -0.06 0.07 -0.22 0.00 -1.01 0.00 0.00 57.07 55.84 1spi s TYR 343 Cb -0.04 -0.04 0.05 0.00 -0.11 0.00 0.00 41.96 41.83 1spi s TYR 343 CO 0.01 -0.02 0.53 -1.50 -1.11 0.00 0.00 175.55 173.46 1spi s ILE 344 N 0.21 0.02 -4.40 2.71 2.07 0.14 -1.89 121.20 120.05 1spi s ILE 344 Ca -0.02 -0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.10 1spi s ILE 344 Cb -0.02 -0.81 0.00 0.00 0.13 0.00 0.00 42.46 41.76 1spi s ILE 344 CO -0.01 -0.07 0.00 0.61 -1.91 0.00 0.00 174.94 173.56 1spi n GLY 345 N 1.73 0.93 3.63 1.50 0.00 -1.20 -1.72 105.19 110.06 1spi n GLY 345 Ca -0.18 -1.93 -0.48 0.00 0.00 0.00 0.00 46.02 43.44 1spi n GLY 345 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1spi n SER 346 N 0.24 2.18 -0.13 1.61 2.88 -1.00 -2.58 113.62 116.81 1spi n SER 346 Ca 0.00 1.13 -0.04 0.00 -1.33 0.00 0.00 58.87 58.62 1spi n SER 346 Cb 0.00 -1.32 0.02 0.00 -0.75 0.00 0.00 64.21 62.16 1spi n SER 346 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1spi h VAL 347 N 3.09 0.56 -0.66 2.46 2.07 -1.85 -1.94 116.25 119.98 1spi h VAL 347 Ca -0.45 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.20 1spi h VAL 347 Cb 1.30 0.56 -0.13 0.00 -1.52 0.00 0.00 31.29 31.51 1spi h VAL 347 CO 0.77 0.00 -0.19 -0.08 0.02 0.00 0.00 177.57 178.09 1spi h GLU 348 N -0.01 -0.03 0.43 1.57 4.81 -1.89 -1.36 114.58 118.10 1spi h GLU 348 Ca 0.21 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1spi h GLU 348 Cb 0.32 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1spi h GLU 348 CO -0.44 -0.02 -0.21 0.93 -0.73 0.00 0.00 179.01 178.54 1spi h GLU 349 N -0.03 -0.56 0.00 1.92 4.39 -1.61 -1.77 114.58 116.92 1spi h GLU 349 Ca 0.31 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1spi h GLU 349 Cb 0.50 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1spi h GLU 349 CO -0.69 -0.25 0.01 1.33 -1.16 0.00 0.00 179.01 178.25 1spi n VAL 350 N -5.22 0.37 -0.09 3.13 0.24 -0.97 -0.65 118.33 115.15 1spi n VAL 350 Ca -0.10 0.10 -0.15 0.00 -2.04 0.00 0.00 64.34 62.15 1spi n VAL 350 Cb 0.29 -1.10 -0.14 0.00 -1.47 0.00 0.00 33.84 31.42 1spi n VAL 350 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1spi n GLU 351 N -1.06 0.68 -0.37 7.34 -0.58 -0.55 -3.52 120.64 122.58 1spi n GLU 351 Ca 0.00 0.13 0.01 0.00 -0.42 0.00 0.00 57.16 56.88 1spi n GLU 351 Cb 0.01 -1.58 0.16 0.00 -0.57 0.00 0.00 31.44 29.45 1spi n GLU 351 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1spi h LYS 352 N 0.01 1.21 -0.02 3.49 3.64 -0.13 0.93 116.57 125.70 1spi h LYS 352 Ca -0.51 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1spi h LYS 352 Cb 2.05 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 33.60 1spi h LYS 352 CO -0.00 0.80 0.00 -0.11 -2.27 0.00 0.00 179.45 177.87 1spi n LEU 353 N -4.45 0.33 -0.00 5.20 0.00 -1.15 -3.05 117.00 113.89 1spi n LEU 353 Ca 0.14 -0.13 -0.05 0.00 0.00 0.00 0.00 56.01 55.97 1spi n LEU 353 Cb 0.11 -0.02 0.16 0.00 0.00 0.00 0.00 43.42 43.68 1spi n LEU 353 CO 0.34 0.07 0.69 1.05 0.00 0.00 0.00 177.39 179.54 1spi h GLU 354 N 0.47 0.53 0.14 1.96 4.11 0.88 -1.34 114.58 121.32 1spi h GLU 354 Ca 0.00 -0.22 -0.01 0.00 0.07 0.00 0.00 59.36 59.20 1spi h GLU 354 Cb 0.10 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1spi h GLU 354 CO 0.00 0.77 -0.07 0.87 0.07 0.00 0.00 179.01 180.65 1spi h LYS 355 N 0.46 -0.18 -1.03 1.06 1.57 -1.57 -3.30 116.57 113.57 1spi h LYS 355 Ca 0.06 0.01 0.27 0.00 -1.87 0.00 0.00 60.65 59.13 1spi h LYS 355 Cb 0.74 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 33.02 1spi h LYS 355 CO 0.06 0.08 0.70 1.88 -0.57 0.00 0.00 179.45 181.59 1spi h TYR 356 N -1.01 0.42 0.23 -1.35 -1.99 -1.62 -2.75 116.97 108.90 1spi h TYR 356 Ca -0.02 0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.73 1spi h TYR 356 Cb 0.35 -0.12 -0.04 0.00 2.00 0.00 0.00 36.73 38.91 1spi h TYR 356 CO 0.05 0.05 -0.48 1.37 -0.00 0.00 0.00 178.16 179.15 1spi h LEU 357 N 0.26 -1.39 0.00 3.88 8.10 -1.32 -3.36 115.31 121.48 1spi h LEU 357 Ca 0.55 0.14 0.00 0.00 0.11 0.00 0.00 57.88 58.68 1spi h LEU 357 Cb 1.65 0.50 0.00 0.00 -0.44 0.00 0.00 40.66 42.37 1spi h LEU 357 CO -0.18 -0.56 0.00 0.00 -4.11 0.00 0.00 178.44 173.58