#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8y n ASP 2 N 0.00 5.57 -4.88 -1.34 10.43 -1.26 -4.99 116.55 120.08 1r8y n ASP 2 Ca 0.00 -3.24 -0.32 0.00 2.57 0.00 0.00 54.79 53.80 1r8y n ASP 2 Cb 0.00 -1.23 -0.05 0.00 1.84 0.00 0.00 41.12 41.68 1r8y n ASP 2 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 1r8y s SER 3 N -0.47 6.58 -0.25 -2.24 0.15 -1.26 -5.09 113.70 111.12 1r8y s SER 3 Ca 0.31 0.79 -0.03 0.00 0.70 0.00 0.00 55.95 57.72 1r8y s SER 3 Cb -0.02 -2.17 0.08 0.00 -1.71 0.00 0.00 66.02 62.21 1r8y s SER 3 CO -0.01 -0.01 0.10 0.68 1.20 0.00 0.00 173.24 175.21 1r8y s VAL 4 N -1.73 0.20 0.00 4.45 -7.23 -1.26 -5.10 120.40 109.73 1r8y s VAL 4 Ca 0.44 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.90 1r8y s VAL 4 Cb -0.12 -1.02 0.00 0.00 0.56 0.00 0.00 36.38 35.80 1r8y s VAL 4 CO 0.22 -0.54 0.00 0.00 -0.31 0.00 0.00 175.10 174.48 1r8y n TYR 5 N 5.15 0.00 -4.01 2.82 9.36 -1.26 -4.99 117.16 124.22 1r8y n TYR 5 Ca -0.06 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.87 1r8y n TYR 5 Cb 0.44 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.10 1r8y n TYR 5 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1r8y s ARG 6 N 0.00 3.09 -0.03 2.98 0.52 -1.26 -5.05 118.95 119.20 1r8y s ARG 6 Ca 0.00 -0.67 -0.19 0.00 -0.52 0.00 0.00 55.73 54.35 1r8y s ARG 6 Cb 0.00 -2.81 -0.32 0.00 0.52 0.00 0.00 34.95 32.34 1r8y s ARG 6 CO 0.00 0.55 0.88 1.15 0.02 0.00 0.00 175.30 177.90 1r8y h THR 7 N 2.20 1.37 -4.11 0.02 2.02 -2.08 -3.47 112.91 108.87 1r8y h THR 7 Ca -0.47 -2.57 -0.13 0.00 0.77 0.00 0.00 66.41 64.01 1r8y h THR 7 Cb 1.18 3.09 -0.16 0.00 -1.74 0.00 0.00 68.15 70.51 1r8y h THR 7 CO 0.68 0.75 -0.64 0.00 0.37 0.00 0.00 175.52 176.68 1r8y s ARG 8 N -2.49 0.58 0.53 6.66 1.70 -1.26 -5.15 118.95 119.52 1r8y s ARG 8 Ca -0.13 -1.05 -0.21 0.00 -0.47 0.00 0.00 55.73 53.88 1r8y s ARG 8 Cb 0.02 0.21 -0.07 0.00 -0.57 0.00 0.00 34.95 34.54 1r8y s ARG 8 CO 0.86 -0.12 0.95 0.43 -1.08 0.00 0.00 175.30 176.34 1r8y n SER 9 N 0.41 0.83 -4.72 -2.89 7.64 -1.26 -4.92 113.62 108.72 1r8y n SER 9 Ca -0.16 0.89 -0.42 0.00 1.01 0.00 0.00 58.87 60.19 1r8y n SER 9 Cb 0.60 -1.36 -0.03 0.00 -1.01 0.00 0.00 64.21 62.41 1r8y n SER 9 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1r8y s LEU 10 N -1.22 4.37 0.00 -3.43 1.43 -1.26 -2.99 118.68 115.58 1r8y s LEU 10 Ca 0.70 2.64 0.00 0.00 -1.03 0.00 0.00 54.13 56.44 1r8y s LEU 10 Cb -0.47 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.16 1r8y s LEU 10 CO 0.52 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1r8y n GLY 11 N 3.81 0.73 3.97 -3.19 0.00 -1.26 -5.08 105.19 104.16 1r8y n GLY 11 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 1r8y n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r8y s VAL 12 N -2.58 2.26 0.03 1.61 -7.23 -1.16 -5.07 120.40 108.25 1r8y s VAL 12 Ca 0.00 -0.46 -0.02 0.00 -1.81 0.00 0.00 61.98 59.69 1r8y s VAL 12 Cb 0.00 -2.80 -0.02 0.00 0.56 0.00 0.00 36.38 34.12 1r8y s VAL 12 CO 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 175.10 174.81 1r8y s ALA 13 N -3.18 0.12 0.33 1.32 0.00 -1.26 -4.59 121.76 114.50 1r8y s ALA 13 Ca 0.64 -0.68 0.09 0.00 0.00 0.00 0.00 51.96 52.01 1r8y s ALA 13 Cb -0.07 0.20 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 1r8y s ALA 13 CO 0.44 -0.26 -0.09 0.00 0.00 0.00 0.00 175.76 175.85 1r8y s ALA 14 N -2.32 2.83 -0.02 0.00 0.00 -1.26 -5.08 121.76 115.91 1r8y s ALA 14 Ca -0.08 -2.05 -0.23 0.00 0.00 0.00 0.00 51.96 49.60 1r8y s ALA 14 Cb -0.03 -0.01 -0.16 0.00 0.00 0.00 0.00 23.12 22.91 1r8y s ALA 14 CO -0.04 0.06 1.09 0.93 0.00 0.00 0.00 175.76 177.80 1r8y h GLU 15 N 2.08 -0.28 -0.80 0.00 3.07 -2.02 -3.22 114.58 113.42 1r8y h GLU 15 Ca -0.42 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 58.62 1r8y h GLU 15 Cb 1.25 0.06 -0.10 0.00 -0.84 0.00 0.00 28.75 29.12 1r8y h GLU 15 CO 0.69 0.10 0.33 0.78 -1.40 0.00 0.00 179.01 179.52 1r8y h GLY 16 N -0.77 1.26 -4.09 -3.84 0.00 -2.08 -3.45 103.07 90.10 1r8y h GLY 16 Ca -0.03 -0.16 -0.57 0.00 0.00 0.00 0.00 47.33 46.57 1r8y h GLY 16 CO 0.05 -0.13 -0.27 1.08 0.00 0.00 0.00 176.54 177.27 1r8y s LEU 17 N -10.45 4.24 0.41 3.11 1.43 -1.22 -5.08 118.68 111.12 1r8y s LEU 17 Ca -0.12 0.66 -0.25 0.00 -1.03 0.00 0.00 54.13 53.38 1r8y s LEU 17 Cb 0.22 -3.39 -0.08 0.00 0.03 0.00 0.00 46.19 42.96 1r8y s LEU 17 CO 0.77 0.02 1.24 -2.84 0.23 0.00 0.00 176.35 175.76 1r8y s PRO 18 N -2.73 3.99 0.72 1.29 0.02 -1.26 -4.65 135.00 132.38 1r8y s PRO 18 Ca 0.42 2.00 -0.16 0.00 0.02 0.00 0.00 61.00 63.29 1r8y s PRO 18 Cb -0.12 -2.70 0.03 0.00 0.02 0.00 0.00 34.50 31.73 1r8y s PRO 18 CO 0.24 -0.43 1.26 -0.25 -0.33 0.00 0.00 177.00 177.49 1r8y n ASP 19 N 0.07 1.62 0.00 2.53 8.00 -1.26 -4.82 116.55 122.69 1r8y n ASP 19 Ca 0.04 0.72 0.00 0.00 0.71 0.00 0.00 54.79 56.26 1r8y n ASP 19 Cb 0.45 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.01 1r8y n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1r8y n GLN 20 N -2.55 0.00 -0.20 -1.24 1.13 -1.26 -0.79 117.38 112.47 1r8y n GLN 20 Ca 0.15 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.29 1r8y n GLN 20 Cb 0.49 0.00 0.12 0.00 0.11 0.00 0.00 30.24 30.96 1r8y n GLN 20 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1r8y n TYR 21 N 0.00 0.00 0.09 1.08 4.01 -1.26 -4.85 117.16 116.23 1r8y n TYR 21 Ca 0.00 -0.89 0.19 0.00 -0.16 0.00 0.00 57.90 57.04 1r8y n TYR 21 Cb 0.00 -0.14 0.75 0.00 -0.31 0.00 0.00 39.34 39.64 1r8y n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r8y h ALA 22 N 0.10 2.16 -0.38 -0.72 0.00 -1.28 -2.29 119.26 116.84 1r8y h ALA 22 Ca -0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 1r8y h ALA 22 Cb 1.07 0.03 -0.32 0.00 0.00 0.00 0.00 17.79 18.57 1r8y h ALA 22 CO 0.00 -0.56 -0.86 -0.40 0.00 0.00 0.00 179.25 177.43 1r8y n ASP 23 N -3.94 2.73 -4.89 0.00 5.75 -1.26 -4.53 116.55 110.40 1r8y n ASP 23 Ca 0.07 -3.07 -0.29 0.00 -0.01 0.00 0.00 54.79 51.49 1r8y n ASP 23 Cb 0.54 -0.41 0.02 0.00 -1.03 0.00 0.00 41.12 40.24 1r8y n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1r8y s GLY 24 N -3.32 1.61 0.18 6.12 0.00 -0.86 -4.91 107.32 106.14 1r8y s GLY 24 Ca 0.39 -0.35 -0.18 0.00 0.00 0.00 0.00 44.72 44.58 1r8y s GLY 24 CO -0.04 -0.07 1.63 -2.09 0.00 0.00 0.00 173.10 172.54 1r8y h GLU 25 N -0.29 -0.09 0.08 2.90 4.81 -1.95 -2.70 114.58 117.35 1r8y h GLU 25 Ca -0.45 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1r8y h GLU 25 Cb 1.22 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1r8y h GLU 25 CO 0.62 -0.06 -0.04 0.00 -0.73 0.00 0.00 179.01 178.80 1r8y h ALA 26 N 1.25 -0.11 -0.31 2.92 0.00 -1.94 -2.49 119.26 118.58 1r8y h ALA 26 Ca 0.22 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.16 1r8y h ALA 26 Cb 0.42 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 1r8y h ALA 26 CO -0.51 -0.55 -0.15 0.00 0.00 0.00 0.00 179.25 178.04 1r8y h ALA 27 N 0.78 0.10 -0.15 0.00 0.00 -1.81 0.16 119.26 118.35 1r8y h ALA 27 Ca -0.01 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1r8y h ALA 27 Cb 0.11 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1r8y h ALA 27 CO 0.02 -0.54 -0.51 0.00 0.00 0.00 0.00 179.25 178.22 1r8y h ARG 28 N -0.10 -0.52 -0.85 0.00 3.08 -1.26 -0.96 114.38 113.78 1r8y h ARG 28 Ca 0.16 0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.29 1r8y h ARG 28 Cb 0.34 0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.46 1r8y h ARG 28 CO -0.37 -0.34 0.56 0.28 -1.07 0.00 0.00 179.97 179.02 1r8y h VAL 29 N -0.54 1.11 -0.68 2.04 2.07 -0.92 0.36 116.25 119.68 1r8y h VAL 29 Ca 0.03 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.29 1r8y h VAL 29 Cb 0.63 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1r8y h VAL 29 CO -0.42 0.19 0.45 -0.25 0.02 0.00 0.00 177.57 177.55 1r8y h TRP 30 N 1.01 0.61 -0.59 1.57 7.01 -0.03 -2.29 115.95 123.25 1r8y h TRP 30 Ca 0.35 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.30 1r8y h TRP 30 Cb 0.10 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 1r8y h TRP 30 CO -0.00 0.30 0.10 1.96 -2.79 0.00 0.00 178.44 178.01 1r8y h GLN 31 N 0.58 0.97 -0.88 2.65 4.20 0.41 -0.86 115.11 122.19 1r8y h GLN 31 Ca 0.31 -0.26 0.14 0.00 0.06 0.00 0.00 58.65 58.89 1r8y h GLN 31 Cb 0.43 -0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.03 1r8y h GLN 31 CO -0.10 0.92 0.57 -0.07 -0.67 0.00 0.00 178.83 179.47 1r8y h LEU 32 N 0.87 0.66 0.16 1.46 3.38 -1.21 -1.05 115.31 119.58 1r8y h LEU 32 Ca 0.18 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1r8y h LEU 32 Cb 0.42 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1r8y h LEU 32 CO 0.01 0.34 -0.08 0.22 0.09 0.00 0.00 178.44 179.03 1r8y h TYR 33 N 0.70 -0.20 0.00 1.13 3.20 -0.80 -2.20 116.97 118.81 1r8y h TYR 33 Ca 0.44 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.30 1r8y h TYR 33 Cb 0.67 0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.01 1r8y h TYR 33 CO -0.00 0.21 0.00 -0.84 -1.64 0.00 0.00 178.16 175.89 1r8y h ILE 34 N -0.92 0.00 0.00 1.81 3.07 -1.12 -1.81 117.51 118.55 1r8y h ILE 34 Ca -0.02 -0.18 0.00 0.00 1.55 0.00 0.00 64.86 66.21 1r8y h ILE 34 Cb 0.50 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.08 1r8y h ILE 34 CO 0.04 0.00 -1.13 0.61 -1.05 0.00 0.00 178.15 176.62 1r8y n GLY 35 N -0.66 -1.28 2.32 0.16 0.00 -0.40 -4.56 105.19 100.78 1r8y n GLY 35 Ca -0.01 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.40 1r8y n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 36 N -2.25 4.90 -3.44 1.61 9.92 -0.68 -4.26 116.55 122.34 1r8y n ASP 36 Ca 0.01 -3.73 -0.27 0.00 -0.53 0.00 0.00 54.79 50.26 1r8y n ASP 36 Cb 0.49 -0.44 -0.10 0.00 -0.64 0.00 0.00 41.12 40.43 1r8y n ASP 36 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1r8y n THR 37 N -0.57 -0.85 -2.95 -3.53 -2.24 -1.25 -3.42 114.28 99.46 1r8y n THR 37 Ca 0.41 -3.62 -0.14 0.00 -2.27 0.00 0.00 64.05 58.43 1r8y n THR 37 Cb 0.76 -1.73 0.02 0.00 -2.10 0.00 0.00 70.33 67.28 1r8y n THR 37 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1r8y n ARG 38 N 2.66 0.91 -3.98 -0.78 0.00 -1.26 -4.79 116.66 109.43 1r8y n ARG 38 Ca 0.28 -2.56 -0.31 0.00 -0.00 0.00 0.00 57.85 55.27 1r8y n ARG 38 Cb 0.47 -1.35 -0.15 0.00 -0.00 0.00 0.00 32.46 31.43 1r8y n ARG 38 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1r8y s SER 39 N -1.70 4.58 0.07 2.89 1.04 -1.26 -5.09 113.70 114.23 1r8y s SER 39 Ca 0.32 -2.39 -0.31 0.00 0.48 0.00 0.00 55.95 54.05 1r8y s SER 39 Cb 0.28 -1.58 -0.08 0.00 0.10 0.00 0.00 66.02 64.73 1r8y s SER 39 CO -0.11 -0.34 1.70 -0.60 0.98 0.00 0.00 173.24 174.88 1r8y s ARG 40 N 0.58 4.18 0.33 4.02 3.52 -1.26 -2.57 118.95 127.76 1r8y s ARG 40 Ca 0.13 2.38 -0.29 0.00 -0.13 0.00 0.00 55.73 57.82 1r8y s ARG 40 Cb -0.21 -3.65 -0.11 0.00 -1.56 0.00 0.00 34.95 29.41 1r8y s ARG 40 CO -0.06 -0.77 1.51 0.25 -0.81 0.00 0.00 175.30 175.42 1r8y n THR 41 N 4.82 1.55 -0.18 4.11 -2.24 -0.09 -4.89 114.28 117.36 1r8y n THR 41 Ca 0.16 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.46 1r8y n THR 41 Cb 0.40 -1.92 0.01 0.00 -2.10 0.00 0.00 70.33 66.72 1r8y n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r8y h ALA 42 N 3.74 0.69 -0.44 6.98 0.00 -1.92 -2.77 119.26 125.54 1r8y h ALA 42 Ca -0.49 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.17 1r8y h ALA 42 Cb 1.24 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 1r8y h ALA 42 CO 0.71 0.51 -0.26 0.39 0.00 0.00 0.00 179.25 180.60 1r8y n GLU 43 N -4.30 -0.19 0.26 0.00 -0.58 -1.26 -1.21 120.64 113.36 1r8y n GLU 43 Ca 0.01 0.88 -0.16 0.00 -0.42 0.00 0.00 57.16 57.47 1r8y n GLU 43 Cb 0.32 -1.29 -0.08 0.00 -0.57 0.00 0.00 31.44 29.82 1r8y n GLU 43 CO 0.00 0.00 0.00 -0.92 -0.48 0.00 0.00 177.13 175.73 1r8y h TYR 44 N 0.00 -0.79 -0.32 -0.32 3.20 -1.72 -2.39 116.97 114.63 1r8y h TYR 44 Ca 0.07 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.99 1r8y h TYR 44 Cb 0.18 0.29 -0.08 0.00 1.54 0.00 0.00 36.73 38.66 1r8y h TYR 44 CO -0.65 -0.45 -0.45 -0.22 -1.64 0.00 0.00 178.16 174.75 1r8y h LYS 45 N -0.72 -0.38 -0.45 1.82 3.64 -1.18 -0.62 116.57 118.69 1r8y h LYS 45 Ca -0.04 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.45 1r8y h LYS 45 Cb 0.60 0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.44 1r8y h LYS 45 CO 0.02 -0.25 0.00 0.00 -2.27 0.00 0.00 179.45 176.96 1r8y h ALA 46 N 0.25 0.42 0.30 5.00 0.00 -1.12 -0.68 119.26 123.43 1r8y h ALA 46 Ca 0.11 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1r8y h ALA 46 Cb 0.60 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1r8y h ALA 46 CO -0.53 -0.39 -0.14 2.35 0.00 0.00 0.00 179.25 180.54 1r8y h TRP 47 N 0.12 -0.37 -0.17 0.00 7.01 -0.63 0.55 115.95 122.46 1r8y h TRP 47 Ca 0.22 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 1r8y h TRP 47 Cb 0.32 0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 1r8y h TRP 47 CO -0.29 -0.13 0.07 1.25 -2.79 0.00 0.00 178.44 176.55 1r8y h LEU 48 N -0.55 0.23 -1.43 0.65 5.85 -0.87 0.28 115.31 119.47 1r8y h LEU 48 Ca -0.04 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 1r8y h LEU 48 Cb 0.41 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1r8y h LEU 48 CO 0.07 0.33 0.06 -0.07 -0.34 0.00 0.00 178.44 178.50 1r8y h LEU 49 N 0.12 0.40 0.29 2.25 3.38 -1.20 -0.73 115.31 119.82 1r8y h LEU 49 Ca 0.06 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1r8y h LEU 49 Cb 0.17 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1r8y h LEU 49 CO -0.00 0.42 -0.14 1.23 0.09 0.00 0.00 178.44 180.03 1r8y h GLY 50 N 0.67 -0.41 0.86 0.83 0.00 0.26 -2.90 103.07 102.38 1r8y h GLY 50 Ca 0.10 0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.57 1r8y h GLY 50 CO -0.00 -0.15 -0.28 -2.00 0.00 0.00 0.00 176.54 174.11 1r8y h LEU 51 N -0.54 -0.70 -0.53 3.11 5.85 -0.20 -1.63 115.31 120.68 1r8y h LEU 51 Ca -0.04 0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.83 1r8y h LEU 51 Cb 0.40 0.21 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 1r8y h LEU 51 CO 0.07 -0.44 -0.08 -0.07 -0.34 0.00 0.00 178.44 177.57 1r8y h LEU 52 N -0.69 -0.39 -0.20 2.25 3.38 -1.20 -1.85 115.31 116.60 1r8y h LEU 52 Ca -0.05 0.15 -0.22 0.00 0.09 0.00 0.00 57.88 57.85 1r8y h LEU 52 Cb 0.57 0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1r8y h LEU 52 CO 0.04 -0.14 -0.91 0.03 0.09 0.00 0.00 178.44 177.55 1r8y h ARG 53 N 0.04 0.43 -0.35 1.13 3.08 -1.50 0.26 114.38 117.47 1r8y h ARG 53 Ca 0.26 -0.45 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 1r8y h ARG 53 Cb 0.40 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1r8y h ARG 53 CO -0.51 1.10 0.01 0.37 -1.07 0.00 0.00 179.97 179.88 1r8y h GLN 54 N 0.25 0.53 -0.24 0.04 4.15 -0.73 -0.54 115.11 118.58 1r8y h GLN 54 Ca -0.07 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.24 1r8y h GLN 54 Cb 1.54 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 29.15 1r8y h GLN 54 CO 0.16 0.55 0.00 0.72 -1.93 0.00 0.00 178.83 178.33 1r8y n HIS 55 N -4.29 0.32 -2.15 3.99 8.25 -0.75 -4.93 115.22 115.67 1r8y n HIS 55 Ca 0.02 -0.16 -0.17 0.00 -0.26 0.00 0.00 57.72 57.14 1r8y n HIS 55 Cb 0.24 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.32 1r8y n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1r8y n GLY 56 N 0.95 0.12 3.80 -1.41 0.00 -0.21 -5.00 105.19 103.44 1r8y n GLY 56 Ca 0.10 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1r8y n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y n HIS 58 N -0.79 -0.25 -2.92 0.00 -0.00 -1.26 -4.73 115.22 105.27 1r8y n HIS 58 Ca 0.08 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.84 1r8y n HIS 58 Cb 0.52 0.37 -0.05 0.00 -0.12 0.00 0.00 29.99 30.72 1r8y n HIS 58 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1r8y s ARG 59 N -1.75 3.68 -0.00 1.57 0.52 -1.26 -2.27 118.95 119.44 1r8y s ARG 59 Ca 0.00 0.26 0.08 0.00 -0.52 0.00 0.00 55.73 55.55 1r8y s ARG 59 Cb 0.00 -3.84 -0.02 0.00 0.52 0.00 0.00 34.95 31.60 1r8y s ARG 59 CO 0.00 -0.95 -0.24 0.08 0.02 0.00 0.00 175.30 174.21 1r8y s VAL 60 N 3.25 2.23 -0.21 3.52 1.01 0.13 -1.06 120.40 129.28 1r8y s VAL 60 Ca 0.33 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1r8y s VAL 60 Cb -0.12 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1r8y s VAL 60 CO 0.19 0.51 -0.14 -0.22 0.00 0.00 0.00 175.10 175.44 1r8y s LEU 61 N -0.83 2.59 -0.32 3.92 2.96 -0.57 -0.68 118.68 125.76 1r8y s LEU 61 Ca 0.11 -0.76 -0.14 0.00 -0.22 0.00 0.00 54.13 53.12 1r8y s LEU 61 Cb -0.10 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 1r8y s LEU 61 CO 0.00 -0.05 0.30 -0.62 -1.32 0.00 0.00 176.35 174.67 1r8y s ASP 62 N 1.29 6.13 0.00 3.68 -1.08 0.03 -0.98 116.67 125.75 1r8y s ASP 62 Ca 0.02 -0.14 0.17 0.00 -0.52 0.00 0.00 52.55 52.08 1r8y s ASP 62 Cb -0.15 -2.17 0.39 0.00 -1.46 0.00 0.00 42.92 39.53 1r8y s ASP 62 CO -0.09 -0.23 1.31 1.33 0.52 0.00 0.00 175.17 178.00 1r8y n VAL 63 N 5.15 0.75 -2.71 1.11 0.24 -0.70 -1.40 118.33 120.76 1r8y n VAL 63 Ca -0.11 -0.87 -0.06 0.00 -2.04 0.00 0.00 64.34 61.26 1r8y n VAL 63 Cb 0.50 0.71 0.04 0.00 -1.47 0.00 0.00 33.84 33.63 1r8y n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r8y n ALA 64 N 1.04 3.10 -0.15 2.33 0.00 -1.23 -4.70 120.51 120.91 1r8y n ALA 64 Ca 0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 53.44 50.63 1r8y n ALA 64 Cb 0.50 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.99 1r8y n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8y n GLY 66 N -1.09 1.85 0.25 0.00 0.00 -1.26 -2.22 105.19 102.73 1r8y n GLY 66 Ca 0.01 -0.55 0.06 0.00 0.00 0.00 0.00 46.02 45.54 1r8y n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r8y n THR 67 N 0.00 0.14 -1.01 2.61 -2.24 -1.26 -3.79 114.28 108.73 1r8y n THR 67 Ca 0.00 -0.17 -0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1r8y n THR 67 Cb 0.00 0.04 -0.00 0.00 -2.10 0.00 0.00 70.33 68.27 1r8y n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r8y n GLY 68 N 0.84 0.47 0.31 3.38 0.00 -0.94 -3.19 105.19 106.06 1r8y n GLY 68 Ca 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1r8y n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1r8y h VAL 69 N 0.00 1.18 -0.16 1.61 -1.51 -1.90 0.18 116.25 115.65 1r8y h VAL 69 Ca -0.01 -0.50 -0.14 0.00 -1.23 0.00 0.00 66.70 64.83 1r8y h VAL 69 Cb 0.05 0.48 0.00 0.00 -2.13 0.00 0.00 31.29 29.70 1r8y h VAL 69 CO 0.01 0.21 -0.43 0.44 -1.23 0.00 0.00 177.57 176.57 1r8y h ASP 70 N 0.76 0.65 -0.20 4.19 3.32 -1.93 -2.73 116.42 120.48 1r8y h ASP 70 Ca 0.19 -0.59 0.05 0.00 0.02 0.00 0.00 57.03 56.70 1r8y h ASP 70 Cb 0.07 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 1r8y h ASP 70 CO -0.03 1.12 -0.12 0.28 -1.72 0.00 0.00 179.24 178.77 1r8y h SER 71 N 0.21 -0.40 -0.96 6.45 0.02 -1.79 -1.52 113.55 115.57 1r8y h SER 71 Ca -0.01 0.09 0.17 0.00 -0.84 0.00 0.00 61.79 61.19 1r8y h SER 71 Cb 1.05 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 63.70 1r8y h SER 71 CO 0.09 -0.16 0.57 0.40 -1.14 0.00 0.00 176.83 176.59 1r8y h ILE 72 N -0.11 0.75 -0.83 3.27 2.04 -0.65 0.34 117.51 122.31 1r8y h ILE 72 Ca 0.11 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1r8y h ILE 72 Cb 0.28 -0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 1r8y h ILE 72 CO -0.27 0.14 0.51 -0.03 0.00 0.00 0.00 178.15 178.50 1r8y h MET 73 N 0.77 1.13 -0.03 2.37 4.05 -0.97 -1.45 114.93 120.79 1r8y h MET 73 Ca 0.53 -0.10 -0.03 0.00 -0.28 0.00 0.00 59.70 59.82 1r8y h MET 73 Cb 0.76 -0.24 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1r8y h MET 73 CO -0.36 0.79 -0.10 -0.07 0.23 0.00 0.00 176.91 177.40 1r8y h LEU 74 N 1.14 0.14 -0.73 3.39 3.38 0.03 -2.36 115.31 120.31 1r8y h LEU 74 Ca 0.30 -0.62 0.07 0.00 0.09 0.00 0.00 57.88 57.72 1r8y h LEU 74 Cb -0.06 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 40.55 1r8y h LEU 74 CO -0.06 0.74 -0.54 0.58 0.09 0.00 0.00 178.44 179.25 1r8y h VAL 75 N -0.44 0.00 -0.63 1.22 2.07 -0.31 -1.91 116.25 116.26 1r8y h VAL 75 Ca -0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1r8y h VAL 75 Cb 0.72 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 1r8y h VAL 75 CO 0.02 0.00 0.15 -0.33 0.02 0.00 0.00 177.57 177.43 1r8y h GLU 76 N -0.14 0.27 0.00 1.57 5.08 -1.30 -0.87 114.58 119.19 1r8y h GLU 76 Ca 0.12 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1r8y h GLU 76 Cb 0.45 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1r8y h GLU 76 CO -0.76 0.18 0.00 0.39 -1.00 0.00 0.00 179.01 177.82 1r8y n GLU 77 N -5.12 0.78 -0.15 2.33 -0.58 -0.76 -4.85 120.64 112.28 1r8y n GLU 77 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1r8y n GLU 77 Cb 0.35 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 29.93 1r8y n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r8y n GLY 78 N 0.45 0.62 3.70 0.62 0.00 -0.33 -5.06 105.19 105.19 1r8y n GLY 78 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1r8y n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 79 N -2.27 2.21 -0.27 1.61 0.08 -0.98 -5.02 117.98 113.34 1r8y s PHE 79 Ca 0.00 1.36 -0.07 0.00 0.12 0.00 0.00 56.93 58.34 1r8y s PHE 79 Cb 0.00 -3.16 -0.01 0.00 -0.57 0.00 0.00 43.02 39.28 1r8y s PHE 79 CO 0.00 -2.45 0.07 -1.54 -0.10 0.00 0.00 175.22 171.20 1r8y s SER 80 N -3.26 5.09 -0.05 1.36 1.04 -0.96 -4.50 113.70 112.41 1r8y s SER 80 Ca 0.64 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.64 1r8y s SER 80 Cb -0.19 -1.90 0.01 0.00 0.10 0.00 0.00 66.02 64.04 1r8y s SER 80 CO 0.57 -0.11 -0.12 0.54 0.98 0.00 0.00 173.24 175.10 1r8y s VAL 81 N 1.56 1.10 -0.18 5.02 0.11 -1.26 -0.69 120.40 126.05 1r8y s VAL 81 Ca 0.05 -0.48 -0.05 0.00 -2.93 0.00 0.00 61.98 58.56 1r8y s VAL 81 Cb -0.16 -0.99 -0.03 0.00 -1.53 0.00 0.00 36.38 33.67 1r8y s VAL 81 CO 0.03 0.34 0.01 -0.32 -3.33 0.00 0.00 175.10 171.83 1r8y s MET 82 N 0.50 3.74 -0.07 1.54 1.75 0.14 -2.40 119.30 124.50 1r8y s MET 82 Ca -0.11 -0.47 0.05 0.00 -1.25 0.00 0.00 55.69 53.91 1r8y s MET 82 Cb -0.14 -3.07 -0.00 0.00 2.84 0.00 0.00 34.83 34.46 1r8y s MET 82 CO 0.03 0.16 -0.22 -1.12 -0.65 0.00 0.00 175.02 173.22 1r8y s SER 83 N 0.62 2.76 0.13 1.11 0.01 -0.02 -0.79 113.70 117.51 1r8y s SER 83 Ca -0.00 -0.48 0.05 0.00 1.31 0.00 0.00 55.95 56.83 1r8y s SER 83 Cb -0.14 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 1r8y s SER 83 CO 0.02 0.17 -0.12 0.68 0.41 0.00 0.00 173.24 174.41 1r8y s VAL 84 N 0.15 1.18 0.18 3.43 -7.23 -0.50 -1.87 120.40 115.74 1r8y s VAL 84 Ca -0.10 -1.83 -0.17 0.00 -1.81 0.00 0.00 61.98 58.06 1r8y s VAL 84 Cb -0.15 -1.61 0.03 0.00 0.56 0.00 0.00 36.38 35.21 1r8y s VAL 84 CO 0.05 -0.58 0.49 -0.62 -0.31 0.00 0.00 175.10 174.13 1r8y s ASP 85 N -2.73 -0.25 0.00 4.85 -1.08 -1.16 -1.61 116.67 114.69 1r8y s ASP 85 Ca 0.11 -0.45 0.26 0.00 -0.52 0.00 0.00 52.55 51.95 1r8y s ASP 85 Cb -0.02 0.55 0.55 0.00 -1.46 0.00 0.00 42.92 42.55 1r8y s ASP 85 CO 0.01 -1.00 1.45 0.00 0.52 0.00 0.00 175.17 176.16 1r8y n ALA 86 N -0.31 2.77 -2.95 3.66 0.00 -0.88 -1.24 120.51 121.56 1r8y n ALA 86 Ca -0.11 -0.55 -0.39 0.00 0.00 0.00 0.00 53.44 52.39 1r8y n ALA 86 Cb 0.63 -0.98 -0.12 0.00 0.00 0.00 0.00 19.45 18.98 1r8y n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y s SER 87 N -2.15 5.52 0.40 0.00 0.15 -1.26 -4.93 113.70 111.42 1r8y s SER 87 Ca 0.29 -0.80 0.11 0.00 0.70 0.00 0.00 55.95 56.25 1r8y s SER 87 Cb 0.20 -1.97 0.83 0.00 -1.71 0.00 0.00 66.02 63.36 1r8y s SER 87 CO 0.39 -0.28 1.92 0.44 1.20 0.00 0.00 173.24 176.91 1r8y h ASP 88 N 8.35 0.15 -0.88 5.45 3.32 -1.98 0.16 116.42 130.99 1r8y h ASP 88 Ca -0.29 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1r8y h ASP 88 Cb 1.12 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.59 1r8y h ASP 88 CO 0.63 0.34 0.55 0.50 -1.72 0.00 0.00 179.24 179.54 1r8y h LYS 89 N 0.15 1.18 0.13 3.56 3.64 -2.00 -1.17 116.57 122.05 1r8y h LYS 89 Ca 0.03 -0.09 -0.35 0.00 -1.27 0.00 0.00 60.65 58.97 1r8y h LYS 89 Cb 0.39 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1r8y h LYS 89 CO 0.02 0.81 -1.87 0.52 -2.27 0.00 0.00 179.45 176.66 1r8y h MET 90 N 1.20 0.27 -0.40 1.90 2.86 -1.79 -3.35 114.93 115.62 1r8y h MET 90 Ca 0.32 -0.46 0.09 0.00 -2.06 0.00 0.00 59.70 57.58 1r8y h MET 90 Cb -0.09 0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1r8y h MET 90 CO -0.06 1.22 0.28 -0.07 1.06 0.00 0.00 176.91 179.34 1r8y h LEU 91 N -0.02 0.13 -0.87 1.22 3.38 -0.86 -0.93 115.31 117.36 1r8y h LEU 91 Ca -0.40 0.00 0.14 0.00 0.09 0.00 0.00 57.88 57.72 1r8y h LEU 91 Cb 1.98 -0.03 -0.15 0.00 0.09 0.00 0.00 40.66 42.56 1r8y h LEU 91 CO 0.08 0.08 -0.31 1.17 0.09 0.00 0.00 178.44 179.55 1r8y n LYS 92 N -4.45 -0.17 0.00 1.13 4.81 -0.45 -0.48 118.16 118.54 1r8y n LYS 92 Ca 0.06 1.35 -0.07 0.00 -0.87 0.00 0.00 58.31 58.78 1r8y n LYS 92 Cb 0.37 -2.00 0.11 0.00 0.02 0.00 0.00 35.03 33.53 1r8y n LYS 92 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1r8y h TYR 93 N 0.00 0.63 -0.09 5.64 0.05 -1.37 -0.53 116.97 121.31 1r8y h TYR 93 Ca 0.33 -0.19 -0.03 0.00 0.05 0.00 0.00 58.73 58.90 1r8y h TYR 93 Cb 0.55 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.15 1r8y h TYR 93 CO -0.74 0.86 -0.06 0.00 -1.05 0.00 0.00 178.16 177.17 1r8y h ALA 94 N 1.11 0.13 -0.84 3.88 0.00 -1.03 -2.38 119.26 120.13 1r8y h ALA 94 Ca 0.04 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1r8y h ALA 94 Cb 0.91 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 1r8y h ALA 94 CO 0.08 -0.08 0.51 -0.07 0.00 0.00 0.00 179.25 179.69 1r8y h LEU 95 N -0.20 0.78 -0.79 0.00 3.38 -0.67 -1.48 115.31 116.32 1r8y h LEU 95 Ca 0.02 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1r8y h LEU 95 Cb 0.54 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1r8y h LEU 95 CO 0.02 0.48 0.36 0.50 0.09 0.00 0.00 178.44 179.89 1r8y h LYS 96 N 0.91 1.15 -0.18 1.13 3.64 -1.08 -1.44 116.57 120.70 1r8y h LYS 96 Ca 0.38 -0.18 -0.11 0.00 -1.27 0.00 0.00 60.65 59.46 1r8y h LYS 96 Cb 0.23 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1r8y h LYS 96 CO -0.20 0.91 -0.34 1.49 -2.27 0.00 0.00 179.45 179.04 1r8y h GLU 97 N 1.13 0.54 -0.45 1.90 4.57 -0.84 -1.93 114.58 119.50 1r8y h GLU 97 Ca 0.27 -0.35 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1r8y h GLU 97 Cb 0.15 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.74 1r8y h GLU 97 CO -0.03 0.95 0.23 -0.09 -1.18 0.00 0.00 179.01 178.90 1r8y h ARG 98 N 0.19 0.45 -0.70 1.92 2.43 -1.15 -1.48 114.38 116.04 1r8y h ARG 98 Ca 0.01 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1r8y h ARG 98 Cb 0.93 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1r8y h ARG 98 CO 0.08 0.30 0.18 2.35 -1.51 0.00 0.00 179.97 181.36 1r8y h TRP 99 N 0.46 1.18 -0.09 2.20 2.91 -1.23 -1.40 115.95 119.98 1r8y h TRP 99 Ca 0.19 -0.14 0.00 0.00 1.13 0.00 0.00 58.89 60.07 1r8y h TRP 99 Cb 0.08 -0.33 -0.00 0.00 -0.51 0.00 0.00 29.16 28.40 1r8y h TRP 99 CO -0.10 0.96 0.06 -0.91 -1.03 0.00 0.00 178.44 177.42 1r8y h ASN 100 N 1.06 0.11 -0.41 2.65 2.35 -0.86 -2.51 115.58 117.96 1r8y h ASN 100 Ca 0.22 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.89 1r8y h ASN 100 Cb 0.37 -0.03 -0.05 0.00 0.05 0.00 0.00 38.32 38.66 1r8y h ASN 100 CO 0.00 0.08 0.05 0.54 -1.65 0.00 0.00 177.43 176.45 1r8y n ARG 101 N -4.52 3.08 0.28 0.81 1.74 -0.60 -4.78 116.66 112.66 1r8y n ARG 101 Ca -0.02 -2.99 0.18 0.00 -0.77 0.00 0.00 57.85 54.26 1r8y n ARG 101 Cb 0.08 -1.96 0.87 0.00 -1.02 0.00 0.00 32.46 30.44 1r8y n ARG 101 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1r8y h ARG 102 N 2.03 0.00 0.00 5.56 0.11 -0.83 -2.56 114.38 118.69 1r8y h ARG 102 Ca 0.10 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.15 1r8y h ARG 102 Cb 1.73 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.81 1r8y h ARG 102 CO 0.39 0.00 -0.37 0.87 0.10 0.00 0.00 179.97 180.97 1r8y h LYS 103 N 0.00 0.00 -6.19 0.08 1.57 -1.86 -3.40 116.57 106.77 1r8y h LYS 103 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1r8y h LYS 103 Cb 0.24 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1r8y h LYS 103 CO 0.00 0.10 0.79 -1.21 -0.57 0.00 0.00 179.45 178.56 1r8y s GLU 104 N -3.19 4.29 0.03 3.15 2.02 -0.97 -4.95 118.70 119.09 1r8y s GLU 104 Ca 0.04 1.58 -0.23 0.00 0.02 0.00 0.00 54.97 56.39 1r8y s GLU 104 Cb 0.07 -3.66 -0.15 0.00 0.10 0.00 0.00 34.13 30.48 1r8y s GLU 104 CO 0.72 -0.58 1.42 -1.35 0.02 0.00 0.00 175.26 175.49 1r8y h PRO 105 N 7.74 0.16 -0.25 0.39 0.11 -1.87 -1.15 132.00 137.13 1r8y h PRO 105 Ca -0.28 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.81 1r8y h PRO 105 Cb 1.12 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 1r8y h PRO 105 CO 0.93 0.47 -0.09 0.43 -0.21 0.00 0.00 178.00 179.54 1r8y n SER 106 N -4.80 -0.15 0.16 -2.05 7.64 -1.26 -0.83 113.62 112.33 1r8y n SER 106 Ca -0.07 0.43 0.05 0.00 1.01 0.00 0.00 58.87 60.30 1r8y n SER 106 Cb 0.23 -0.10 0.10 0.00 -1.01 0.00 0.00 64.21 63.42 1r8y n SER 106 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1r8y h PHE 107 N 0.00 0.00 -0.09 1.43 0.04 -1.51 -2.94 116.94 113.87 1r8y h PHE 107 Ca 0.09 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.84 1r8y h PHE 107 Cb 0.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 1r8y h PHE 107 CO -0.21 0.37 -0.05 0.22 -0.60 0.00 0.00 178.31 178.04 1r8y h ASP 108 N 0.00 0.12 -0.64 2.17 3.58 -0.50 -2.92 116.42 118.23 1r8y h ASP 108 Ca -0.00 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.34 1r8y h ASP 108 Cb 1.24 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 42.21 1r8y h ASP 108 CO 0.05 0.19 0.11 0.59 -2.88 0.00 0.00 179.24 177.30 1r8y n ASN 109 N -4.41 5.38 -4.73 2.28 3.02 -0.88 -4.89 115.26 111.05 1r8y n ASN 109 Ca -0.01 -3.04 -0.38 0.00 -0.03 0.00 0.00 54.58 51.11 1r8y n ASN 109 Cb 0.17 -0.71 -0.06 0.00 -0.61 0.00 0.00 39.78 38.57 1r8y n ASN 109 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1r8y s TRP 110 N -2.84 3.53 -0.23 3.10 -0.00 -1.10 -4.59 118.94 116.80 1r8y s TRP 110 Ca 0.55 0.94 -0.05 0.00 -0.00 0.00 0.00 56.10 57.53 1r8y s TRP 110 Cb 0.42 -2.57 -0.02 0.00 -0.00 0.00 0.00 33.47 31.31 1r8y s TRP 110 CO 0.15 0.18 0.01 0.08 -0.00 0.00 0.00 176.95 177.36 1r8y s VAL 111 N 0.58 3.79 -0.15 5.86 1.01 -1.01 -5.04 120.40 125.44 1r8y s VAL 111 Ca 0.27 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1r8y s VAL 111 Cb -0.15 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.47 1r8y s VAL 111 CO 0.11 0.38 -0.17 -0.63 0.00 0.00 0.00 175.10 174.79 1r8y s ILE 112 N 1.54 2.51 0.22 2.22 1.01 -1.26 -0.84 121.20 126.60 1r8y s ILE 112 Ca 0.06 -0.83 -0.15 0.00 0.00 0.00 0.00 60.65 59.73 1r8y s ILE 112 Cb -0.15 -2.04 0.01 0.00 0.01 0.00 0.00 42.46 40.29 1r8y s ILE 112 CO -0.00 0.53 0.50 -0.70 0.00 0.00 0.00 174.94 175.26 1r8y s GLU 113 N 0.78 1.47 -0.04 2.79 2.56 -0.78 -5.01 118.70 120.46 1r8y s GLU 113 Ca -0.07 -1.08 -0.17 0.00 0.00 0.00 0.00 54.97 53.66 1r8y s GLU 113 Cb -0.15 0.49 -0.05 0.00 2.00 0.00 0.00 34.13 36.42 1r8y s GLU 113 CO 0.00 -0.62 0.45 -1.21 -0.56 0.00 0.00 175.26 173.32 1r8y s GLU 114 N -3.95 4.13 -0.17 4.30 2.02 -1.26 -2.97 118.70 120.79 1r8y s GLU 114 Ca 0.16 0.45 -0.22 0.00 0.02 0.00 0.00 54.97 55.38 1r8y s GLU 114 Cb -0.01 -3.31 0.06 0.00 0.10 0.00 0.00 34.13 30.97 1r8y s GLU 114 CO 0.04 0.47 0.58 0.00 0.02 0.00 0.00 175.26 176.37 1r8y s ALA 115 N -0.38 -1.46 -0.11 5.21 0.00 -0.37 -4.85 121.76 119.80 1r8y s ALA 115 Ca 0.25 1.47 -0.01 0.00 0.00 0.00 0.00 51.96 53.66 1r8y s ALA 115 Cb -0.16 -0.67 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 1r8y s ALA 115 CO 0.12 -0.30 -0.05 1.21 0.00 0.00 0.00 175.76 176.75 1r8y s ASN 116 N -0.15 4.80 0.34 0.00 3.84 -1.26 -2.08 114.94 120.43 1r8y s ASN 116 Ca -0.04 -0.04 0.05 0.00 0.21 0.00 0.00 52.86 53.04 1r8y s ASN 116 Cb -0.03 -1.47 0.68 0.00 -0.55 0.00 0.00 41.25 39.89 1r8y s ASN 116 CO 0.03 0.29 1.94 -0.50 -2.79 0.00 0.00 177.10 176.07 1r8y h TRP 117 N 5.80 0.84 0.00 0.43 6.55 -1.94 0.52 115.95 128.15 1r8y h TRP 117 Ca -0.42 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.44 1r8y h TRP 117 Cb 1.18 -0.28 0.00 0.00 -0.86 0.00 0.00 29.16 29.21 1r8y h TRP 117 CO 0.56 0.44 0.00 1.28 -1.05 0.00 0.00 178.44 179.67 1r8y n LEU 118 N -4.48 0.20 -0.20 -4.49 4.77 -1.26 -2.85 117.00 108.69 1r8y n LEU 118 Ca 0.12 0.54 0.02 0.00 -0.03 0.00 0.00 56.01 56.66 1r8y n LEU 118 Cb 0.23 -0.50 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 1r8y n LEU 118 CO 0.33 -0.23 0.36 0.35 -1.33 0.00 0.00 177.39 176.87 1r8y n THR 119 N -1.71 0.55 -0.35 -5.08 -2.24 -0.17 -4.89 114.28 100.40 1r8y n THR 119 Ca 0.04 -0.63 0.24 0.00 -2.27 0.00 0.00 64.05 61.43 1r8y n THR 119 Cb 0.25 0.48 0.50 0.00 -2.10 0.00 0.00 70.33 69.46 1r8y n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1r8y h LEU 120 N 0.00 0.48 -2.17 3.22 5.85 0.10 0.18 115.31 122.96 1r8y h LEU 120 Ca 0.00 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1r8y h LEU 120 Cb 1.07 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 1r8y h LEU 120 CO 0.00 0.01 -0.02 -2.24 -0.34 0.00 0.00 178.44 175.85 1r8y h ASP 121 N 0.37 0.00 -0.00 1.25 -0.00 -1.85 -1.77 116.42 114.42 1r8y h ASP 121 Ca 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.70 1r8y h ASP 121 Cb 1.65 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.98 1r8y h ASP 121 CO -0.41 0.02 -0.05 0.29 -0.00 0.00 0.00 179.24 179.09 1r8y n LYS 122 N -3.17 1.54 -0.09 4.15 5.02 0.48 -4.53 118.16 121.56 1r8y n LYS 122 Ca -0.01 -0.49 -0.10 0.00 -2.02 0.00 0.00 58.31 55.68 1r8y n LYS 122 Cb 0.20 -0.94 -0.14 0.00 -0.02 0.00 0.00 35.03 34.13 1r8y n LYS 122 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1r8y n ASP 123 N -0.20 0.70 -4.18 4.39 9.92 -0.38 -4.89 116.55 121.92 1r8y n ASP 123 Ca 0.02 -0.02 -0.33 0.00 -0.53 0.00 0.00 54.79 53.93 1r8y n ASP 123 Cb 0.08 0.77 -0.16 0.00 -0.64 0.00 0.00 41.12 41.17 1r8y n ASP 123 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1r8y s VAL 124 N -2.45 2.10 -1.11 2.53 1.01 -0.71 -4.92 120.40 116.85 1r8y s VAL 124 Ca -0.12 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 60.73 1r8y s VAL 124 Cb 0.06 -1.84 0.14 0.00 0.00 0.00 0.00 36.38 34.74 1r8y s VAL 124 CO 0.72 0.55 1.36 -0.76 0.00 0.00 0.00 175.10 176.97 1r8y s LEU 125 N 0.81 4.87 0.00 3.92 1.43 -1.26 -4.69 118.68 123.75 1r8y s LEU 125 Ca -0.07 -2.55 0.01 0.00 -1.03 0.00 0.00 54.13 50.49 1r8y s LEU 125 Cb -0.16 -2.42 0.07 0.00 0.03 0.00 0.00 46.19 43.71 1r8y s LEU 125 CO -0.02 -0.93 0.64 -1.54 0.23 0.00 0.00 176.35 174.74 1r8y n SER 126 N 6.35 0.00 0.00 2.29 3.41 -1.26 -4.91 113.62 119.50 1r8y n SER 126 Ca 0.33 -1.15 0.00 0.00 -0.26 0.00 0.00 58.87 57.80 1r8y n SER 126 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1r8y n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r8y n GLY 127 N 0.10 2.69 0.20 5.00 0.00 -1.26 0.10 105.19 112.02 1r8y n GLY 127 Ca 0.01 0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.28 1r8y n GLY 127 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1r8y h ASP 128 N 0.00 0.00 -4.56 1.61 3.58 -1.97 -3.49 116.42 111.59 1r8y h ASP 128 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1r8y h ASP 128 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1r8y h ASP 128 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 1r8y n GLY 129 N 0.65 2.97 3.84 -0.78 0.00 0.28 -4.36 105.19 107.80 1r8y n GLY 129 Ca 0.03 -1.94 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 1r8y n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 130 N -2.07 3.34 0.29 1.61 0.40 0.14 -4.63 117.98 117.06 1r8y s PHE 130 Ca 0.00 0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.47 1r8y s PHE 130 Cb 0.00 -1.69 0.42 0.00 0.51 0.00 0.00 43.02 42.26 1r8y s PHE 130 CO 0.00 0.55 1.92 -0.44 0.70 0.00 0.00 175.22 177.96 1r8y h ASP 131 N 3.26 0.91 -3.67 1.36 3.32 -1.42 -2.41 116.42 117.77 1r8y h ASP 131 Ca -0.46 -0.06 -0.21 0.00 0.02 0.00 0.00 57.03 56.31 1r8y h ASP 131 Cb 1.16 -0.23 -0.28 0.00 0.22 0.00 0.00 39.33 40.20 1r8y h ASP 131 CO 0.70 0.72 -0.59 0.00 -1.72 0.00 0.00 179.24 178.36 1r8y s ALA 132 N -5.73 -0.28 -0.19 3.45 0.00 -1.02 -1.70 121.76 116.30 1r8y s ALA 132 Ca -0.11 0.44 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 1r8y s ALA 132 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 1r8y s ALA 132 CO 0.80 -0.09 -0.09 0.08 0.00 0.00 0.00 175.76 176.46 1r8y s VAL 133 N 0.41 3.07 0.05 0.00 1.01 0.18 -1.51 120.40 123.62 1r8y s VAL 133 Ca -0.03 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.40 1r8y s VAL 133 Cb -0.04 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1r8y s VAL 133 CO -0.02 0.47 -0.12 0.27 0.00 0.00 0.00 175.10 175.70 1r8y s ILE 134 N 1.14 3.25 -0.42 2.22 -4.36 -0.15 0.08 121.20 122.95 1r8y s ILE 134 Ca 0.01 -1.09 0.05 0.00 -0.26 0.00 0.00 60.65 59.36 1r8y s ILE 134 Cb -0.14 -2.44 0.17 0.00 1.25 0.00 0.00 42.46 41.30 1r8y s ILE 134 CO -0.03 0.28 0.47 0.00 0.24 0.00 0.00 174.94 175.90 1r8y s LEU 136 N 0.92 2.66 -1.21 0.00 1.43 -1.26 -2.70 118.68 118.52 1r8y s LEU 136 Ca 0.25 -1.29 -0.08 0.00 -1.03 0.00 0.00 54.13 51.98 1r8y s LEU 136 Cb -0.06 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 45.03 1r8y s LEU 136 CO -0.08 -1.07 1.06 0.61 0.23 0.00 0.00 176.35 177.10 1r8y n GLY 137 N -1.70 -0.39 2.45 -3.19 0.00 -1.26 -3.53 105.19 97.57 1r8y n GLY 137 Ca -0.04 0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1r8y n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1r8y n ASN 138 N -2.56 -5.48 0.20 1.61 5.15 -1.26 -4.88 115.26 108.05 1r8y n ASN 138 Ca -0.00 0.20 0.08 0.00 -0.60 0.00 0.00 54.58 54.26 1r8y n ASN 138 Cb 0.56 -4.68 0.40 0.00 -0.53 0.00 0.00 39.78 35.52 1r8y n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1r8y h SER 139 N 0.00 0.00 0.52 1.20 0.02 -1.82 -3.00 113.55 110.47 1r8y h SER 139 Ca -0.44 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.45 1r8y h SER 139 Cb 1.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.86 1r8y h SER 139 CO 0.57 0.30 -0.27 0.15 -1.14 0.00 0.00 176.83 176.44 1r8y h PHE 140 N 0.00 0.00 0.00 3.45 3.57 -1.88 -1.49 116.94 120.59 1r8y h PHE 140 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1r8y h PHE 140 Cb 0.81 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1r8y h PHE 140 CO 0.00 0.27 0.00 0.00 -2.23 0.00 0.00 178.31 176.35 1r8y n ALA 141 N -2.35 1.91 0.22 2.41 0.00 -1.13 -1.98 120.51 119.59 1r8y n ALA 141 Ca -0.01 -0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.44 1r8y n ALA 141 Cb 0.37 -1.26 0.48 0.00 0.00 0.00 0.00 19.45 19.05 1r8y n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8y h HIS 142 N 0.00 0.00 -3.47 0.00 3.86 -1.43 0.31 115.15 114.42 1r8y h HIS 142 Ca 0.00 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.61 1r8y h HIS 142 Cb 0.12 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.50 1r8y h HIS 142 CO 0.00 0.25 0.52 -1.17 0.86 0.00 0.00 177.93 178.39 1r8y s LEU 143 N -7.05 4.05 0.76 2.43 2.96 -0.84 -4.81 118.68 116.18 1r8y s LEU 143 Ca -0.01 0.58 -0.12 0.00 -0.22 0.00 0.00 54.13 54.37 1r8y s LEU 143 Cb 0.11 -3.18 0.05 0.00 0.50 0.00 0.00 46.19 43.67 1r8y s LEU 143 CO 0.64 -0.77 1.11 -2.16 -1.32 0.00 0.00 176.35 173.84 1r8y s PRO 144 N 3.28 2.41 -1.08 0.98 0.04 -1.26 -4.68 135.00 134.68 1r8y s PRO 144 Ca 0.36 0.50 -0.04 0.00 0.04 0.00 0.00 61.00 61.85 1r8y s PRO 144 Cb -0.13 -1.97 0.31 0.00 0.04 0.00 0.00 34.50 32.75 1r8y s PRO 144 CO 0.17 -1.36 1.50 -3.47 0.04 0.00 0.00 177.00 173.87 1r8y n ASP 145 N -3.23 6.42 0.18 6.66 2.03 -1.26 -4.82 116.55 122.52 1r8y n ASP 145 Ca 0.07 -3.41 0.02 0.00 0.52 0.00 0.00 54.79 51.99 1r8y n ASP 145 Cb 0.57 -1.28 0.34 0.00 -0.72 0.00 0.00 41.12 40.03 1r8y n ASP 145 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r8y n LYS 147 N -3.99 0.02 0.00 0.00 4.76 -1.26 -5.01 118.16 112.68 1r8y n LYS 147 Ca -0.02 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1r8y n LYS 147 Cb 0.44 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 1r8y n LYS 147 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r8y n GLY 148 N 1.49 2.47 3.77 0.72 0.00 -1.15 -4.98 105.19 107.51 1r8y n GLY 148 Ca 0.06 -0.51 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 1r8y n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1r8y s ASP 149 N 0.00 5.15 -0.09 1.61 1.47 -1.26 -4.91 116.67 118.64 1r8y s ASP 149 Ca 0.00 2.09 0.00 0.00 1.18 0.00 0.00 52.55 55.82 1r8y s ASP 149 Cb 0.00 -2.56 0.08 0.00 -0.34 0.00 0.00 42.92 40.10 1r8y s ASP 149 CO 0.00 -1.60 1.71 0.00 0.68 0.00 0.00 175.17 175.95 1r8y n GLN 150 N -2.17 1.24 -0.35 2.11 6.02 -1.26 -4.49 117.38 118.47 1r8y n GLN 150 Ca 0.11 -0.49 0.09 0.00 -0.01 0.00 0.00 57.00 56.70 1r8y n GLN 150 Cb 0.51 -1.19 0.27 0.00 1.02 0.00 0.00 30.24 30.85 1r8y n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r8y h SER 151 N 0.81 0.85 0.97 1.08 4.64 -1.94 -1.84 113.55 118.12 1r8y h SER 151 Ca 0.10 0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 61.35 1r8y h SER 151 Cb 1.08 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.06 1r8y h SER 151 CO 0.22 0.40 -0.61 -0.33 -0.87 0.00 0.00 176.83 175.64 1r8y h GLU 152 N 0.89 0.00 -0.04 4.77 5.08 -1.92 -2.18 114.58 121.18 1r8y h GLU 152 Ca 0.52 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.88 1r8y h GLU 152 Cb 0.64 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1r8y h GLU 152 CO -0.31 0.61 0.02 0.45 -1.00 0.00 0.00 179.01 178.77 1r8y h HIS 153 N 0.00 0.07 0.00 4.33 3.86 -1.70 -0.68 115.15 121.02 1r8y h HIS 153 Ca -0.01 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1r8y h HIS 153 Cb 1.26 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.71 1r8y h HIS 153 CO 0.00 0.22 -0.09 -0.09 0.86 0.00 0.00 177.93 178.83 1r8y h ARG 154 N -0.10 0.00 0.12 2.45 2.43 -1.02 0.56 114.38 118.81 1r8y h ARG 154 Ca 0.01 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.99 1r8y h ARG 154 Cb 0.18 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1r8y h ARG 154 CO -0.00 0.09 -0.90 1.25 -1.51 0.00 0.00 179.97 178.90 1r8y h LEU 155 N 0.00 0.40 -0.25 3.80 5.85 -1.33 -1.92 115.31 121.86 1r8y h LEU 155 Ca -0.00 -0.92 0.05 0.00 0.84 0.00 0.00 57.88 57.85 1r8y h LEU 155 Cb 0.17 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 1r8y h LEU 155 CO 0.01 1.42 -0.09 0.00 -0.34 0.00 0.00 178.44 179.44 1r8y h ALA 156 N 0.03 0.13 -0.21 1.25 0.00 -0.63 -1.87 119.26 117.96 1r8y h ALA 156 Ca -0.17 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1r8y h ALA 156 Cb 1.62 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 1r8y h ALA 156 CO 0.11 -0.50 -0.25 -0.07 0.00 0.00 0.00 179.25 178.54 1r8y h LEU 157 N -0.04 0.39 -0.77 0.00 3.38 -1.00 -1.63 115.31 115.64 1r8y h LEU 157 Ca 0.13 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1r8y h LEU 157 Cb 0.23 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1r8y h LEU 157 CO -0.28 0.64 0.46 0.50 0.09 0.00 0.00 178.44 179.85 1r8y h LYS 158 N 0.35 0.83 0.09 1.13 3.11 -0.78 -1.31 116.57 119.98 1r8y h LYS 158 Ca 0.05 -0.05 -0.17 0.00 -2.81 0.00 0.00 60.65 57.68 1r8y h LYS 158 Cb 0.63 -0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.68 1r8y h LYS 158 CO 0.05 0.55 -0.81 -0.91 -2.81 0.00 0.00 179.45 175.52 1r8y h ASN 159 N 0.85 0.29 -0.66 4.20 -0.26 -0.92 -1.72 115.58 117.36 1r8y h ASN 159 Ca 0.34 -0.90 0.11 0.00 -0.56 0.00 0.00 56.30 55.29 1r8y h ASN 159 Cb 0.17 -0.09 -0.12 0.00 -1.06 0.00 0.00 38.32 37.21 1r8y h ASN 159 CO -0.17 1.36 -0.35 0.40 -1.06 0.00 0.00 177.43 177.61 1r8y h ILE 160 N -0.57 0.14 -0.60 2.81 2.04 -1.34 0.11 117.51 120.10 1r8y h ILE 160 Ca -0.17 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1r8y h ILE 160 Cb 1.48 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1r8y h ILE 160 CO 0.06 0.00 0.39 0.00 0.00 0.00 0.00 178.15 178.60 1r8y h ALA 161 N 1.03 1.76 0.00 1.87 0.00 -1.16 0.24 119.26 122.99 1r8y h ALA 161 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1r8y h ALA 161 Cb 0.56 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1r8y h ALA 161 CO -0.73 0.16 0.00 0.66 0.00 0.00 0.00 179.25 179.34 1r8y h SER 162 N 0.63 0.00 1.11 0.00 4.64 0.16 -2.06 113.55 118.03 1r8y h SER 162 Ca 0.25 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.54 1r8y h SER 162 Cb 0.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1r8y h SER 162 CO -0.07 0.00 -0.15 0.24 -0.87 0.00 0.00 176.83 175.98 1r8y h MET 163 N 0.00 0.00 -6.38 4.77 2.86 -0.31 -3.45 114.93 112.42 1r8y h MET 163 Ca 0.00 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.10 1r8y h MET 163 Cb 0.24 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1r8y h MET 163 CO 0.00 0.15 0.24 0.08 1.06 0.00 0.00 176.91 178.44 1r8y s VAL 164 N -3.56 4.69 0.59 -2.22 1.01 -0.78 0.27 120.40 120.40 1r8y s VAL 164 Ca 0.02 1.80 -0.17 0.00 0.00 0.00 0.00 61.98 63.63 1r8y s VAL 164 Cb 0.09 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1r8y s VAL 164 CO 0.62 0.32 1.09 0.00 0.00 0.00 0.00 175.10 177.13 1r8y s ARG 165 N 0.13 3.21 0.28 2.72 1.70 -0.91 -4.69 118.95 121.40 1r8y s ARG 165 Ca 0.43 1.36 -0.29 0.00 -0.47 0.00 0.00 55.73 56.75 1r8y s ARG 165 Cb -0.21 -2.01 -0.13 0.00 -0.57 0.00 0.00 34.95 32.03 1r8y s ARG 165 CO 0.25 -0.92 1.23 -2.30 -1.08 0.00 0.00 175.30 172.49 1r8y n PRO 166 N -1.89 1.81 -1.42 3.89 -0.02 -1.26 -0.18 135.00 135.93 1r8y n PRO 166 Ca 0.10 0.64 -0.14 0.00 -2.02 0.00 0.00 63.50 62.08 1r8y n PRO 166 Cb 0.52 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.77 1r8y n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r8y n GLY 167 N 1.38 1.38 3.08 -1.23 0.00 0.11 -4.99 105.19 104.91 1r8y n GLY 167 Ca 0.09 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 1r8y n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 168 N -1.31 2.57 3.40 -0.02 0.00 0.75 -4.79 105.19 105.79 1r8y n GLY 168 Ca -0.14 -2.26 -0.32 0.00 0.00 0.00 0.00 46.02 43.30 1r8y n GLY 168 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r8y s LEU 169 N 0.00 2.53 -0.17 0.99 1.02 -0.69 -1.76 118.68 120.61 1r8y s LEU 169 Ca 0.31 -0.31 -0.01 0.00 0.02 0.00 0.00 54.13 54.15 1r8y s LEU 169 Cb -0.02 -1.51 -0.00 0.00 0.02 0.00 0.00 46.19 44.67 1r8y s LEU 169 CO 0.20 0.29 -0.13 -0.22 0.02 0.00 0.00 176.35 176.51 1r8y s LEU 170 N -0.40 2.59 -0.29 1.79 2.96 -1.14 0.51 118.68 124.69 1r8y s LEU 170 Ca 0.04 -0.44 -0.03 0.00 -0.22 0.00 0.00 54.13 53.48 1r8y s LEU 170 Cb -0.12 -1.61 0.04 0.00 0.50 0.00 0.00 46.19 45.00 1r8y s LEU 170 CO 0.02 0.07 0.01 -0.69 -1.32 0.00 0.00 176.35 174.44 1r8y s VAL 171 N 0.92 3.23 -0.02 1.68 1.01 0.11 -0.37 120.40 126.96 1r8y s VAL 171 Ca -0.03 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.82 1r8y s VAL 171 Cb -0.15 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1r8y s VAL 171 CO -0.01 -0.00 -0.01 -0.51 0.00 0.00 0.00 175.10 174.57 1r8y s ILE 172 N 1.33 0.18 0.40 2.22 2.07 -0.03 -0.76 121.20 126.62 1r8y s ILE 172 Ca -0.02 0.03 0.06 0.00 -1.41 0.00 0.00 60.65 59.31 1r8y s ILE 172 Cb -0.18 -0.24 -0.07 0.00 0.13 0.00 0.00 42.46 42.09 1r8y s ILE 172 CO -0.01 0.12 0.02 1.51 -1.91 0.00 0.00 174.94 174.67 1r8y s ASP 173 N 0.71 3.67 -0.05 4.50 -4.77 -1.10 -0.53 116.67 119.11 1r8y s ASP 173 Ca -0.07 -1.39 -0.31 0.00 -3.30 0.00 0.00 52.55 47.48 1r8y s ASP 173 Cb -0.10 -0.30 0.07 0.00 -1.09 0.00 0.00 42.92 41.51 1r8y s ASP 173 CO -0.01 -0.50 0.70 -1.38 0.70 0.00 0.00 175.17 174.67 1r8y s HIS 174 N -2.81 -0.64 0.73 2.11 -3.43 -0.48 -4.32 115.29 106.45 1r8y s HIS 174 Ca 0.33 1.06 -0.16 0.00 -0.80 0.00 0.00 55.06 55.50 1r8y s HIS 174 Cb 0.09 0.42 0.03 0.00 -1.43 0.00 0.00 32.58 31.69 1r8y s HIS 174 CO 0.17 -0.61 1.15 -2.13 -2.00 0.00 0.00 174.74 171.32 1r8y n ARG 175 N 0.83 0.59 -2.27 -0.38 0.63 -1.26 -0.40 116.66 114.40 1r8y n ARG 175 Ca -0.18 0.26 -0.33 0.00 -0.92 0.00 0.00 57.85 56.68 1r8y n ARG 175 Cb 0.57 -2.40 -0.04 0.00 0.45 0.00 0.00 32.46 31.05 1r8y n ARG 175 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1r8y s ASN 176 N -1.72 5.74 0.11 6.15 3.84 -0.52 -4.70 114.94 123.83 1r8y s ASN 176 Ca 0.76 -1.52 0.26 0.00 0.21 0.00 0.00 52.86 52.58 1r8y s ASN 176 Cb -0.34 -2.58 0.81 0.00 -0.55 0.00 0.00 41.25 38.59 1r8y s ASN 176 CO 0.47 -2.27 1.69 -1.22 -2.79 0.00 0.00 177.10 172.98 1r8y n TYR 177 N 11.91 0.50 -0.21 0.43 4.01 -1.26 -2.07 117.16 130.47 1r8y n TYR 177 Ca 0.42 0.15 -0.07 0.00 -0.16 0.00 0.00 57.90 58.24 1r8y n TYR 177 Cb 0.47 -0.69 0.03 0.00 -0.31 0.00 0.00 39.34 38.84 1r8y n TYR 177 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1r8y h ASP 178 N 0.00 0.76 0.24 7.72 3.32 -1.84 -0.14 116.42 126.48 1r8y h ASP 178 Ca 0.00 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1r8y h ASP 178 Cb 0.65 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1r8y h ASP 178 CO 0.00 0.68 -0.11 0.22 -1.72 0.00 0.00 179.24 178.30 1r8y h TYR 179 N 0.80 -0.30 -0.46 4.55 3.20 -1.88 -2.47 116.97 120.40 1r8y h TYR 179 Ca 0.20 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.10 1r8y h TYR 179 Cb 0.11 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 1r8y h TYR 179 CO -0.00 0.02 0.23 0.82 -1.64 0.00 0.00 178.16 177.58 1r8y h ILE 180 N -0.63 0.96 -0.60 1.81 2.04 -1.27 -0.35 117.51 119.48 1r8y h ILE 180 Ca -0.03 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1r8y h ILE 180 Cb 0.45 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1r8y h ILE 180 CO 0.05 0.08 0.26 -0.07 0.00 0.00 0.00 178.15 178.48 1r8y h LEU 181 N 0.45 0.82 -1.26 1.44 3.38 -1.09 1.72 115.31 120.77 1r8y h LEU 181 Ca 0.20 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1r8y h LEU 181 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1r8y h LEU 181 CO -0.15 0.75 -0.31 0.77 0.09 0.00 0.00 178.44 179.59 1r8y h SER 182 N 0.83 0.00 0.10 -0.43 4.64 -0.83 -3.05 113.55 114.81 1r8y h SER 182 Ca 0.20 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.19 1r8y h SER 182 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1r8y h SER 182 CO -0.02 0.31 -1.83 0.74 -0.87 0.00 0.00 176.83 175.15 1r8y h THR 183 N 0.00 0.70 0.00 2.95 2.02 -0.97 -3.49 112.91 114.13 1r8y h THR 183 Ca -0.00 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.86 1r8y h THR 183 Cb 0.70 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.57 1r8y h THR 183 CO 0.04 0.78 0.00 0.61 0.37 0.00 0.00 175.52 177.32 1r8y n GLY 184 N 1.87 0.84 3.20 2.16 0.00 0.58 -5.03 105.19 108.81 1r8y n GLY 184 Ca -0.32 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1r8y n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r8y s ALA 186 N -0.32 3.29 0.41 0.00 0.00 -1.26 -4.52 121.76 119.35 1r8y s ALA 186 Ca 0.04 -2.31 -0.26 0.00 0.00 0.00 0.00 51.96 49.42 1r8y s ALA 186 Cb -0.09 -2.65 -0.09 0.00 0.00 0.00 0.00 23.12 20.29 1r8y s ALA 186 CO 0.00 -1.74 1.34 -2.14 0.00 0.00 0.00 175.76 173.22 1r8y s PRO 187 N 1.36 3.96 0.34 0.00 0.02 -1.26 -4.91 135.00 134.51 1r8y s PRO 187 Ca 0.04 2.24 -0.20 0.00 0.02 0.00 0.00 61.00 63.09 1r8y s PRO 187 Cb -0.24 -2.78 -0.10 0.00 0.02 0.00 0.00 34.50 31.41 1r8y s PRO 187 CO 0.00 -0.53 0.85 -1.25 -0.33 0.00 0.00 177.00 175.75 1r8y s PRO 188 N -2.23 4.27 -0.81 5.54 0.04 -1.26 -4.43 135.00 136.11 1r8y s PRO 188 Ca 0.57 1.01 -0.02 0.00 0.04 0.00 0.00 61.00 62.60 1r8y s PRO 188 Cb -0.40 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.62 1r8y s PRO 188 CO 0.52 0.17 0.69 0.41 0.04 0.00 0.00 177.00 178.82 1r8y n GLY 189 N -0.02 -0.07 0.00 0.56 0.00 -1.26 -4.93 105.19 99.47 1r8y n GLY 189 Ca 0.03 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 46.00 1r8y n GLY 189 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r8y n LYS 190 N -3.15 3.18 -1.12 1.61 4.01 -1.26 -4.97 118.16 116.46 1r8y n LYS 190 Ca -0.14 -0.02 -0.48 0.00 -0.51 0.00 0.00 58.31 57.16 1r8y n LYS 190 Cb 0.59 -0.98 -0.08 0.00 -0.51 0.00 0.00 35.03 34.05 1r8y n LYS 190 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1r8y n ASN 191 N -1.36 0.72 -0.02 4.39 2.85 -1.26 -4.82 115.26 115.77 1r8y n ASN 191 Ca 0.01 0.69 0.13 0.00 -0.11 0.00 0.00 54.58 55.29 1r8y n ASN 191 Cb 0.16 -0.68 0.34 0.00 1.24 0.00 0.00 39.78 40.84 1r8y n ASN 191 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1r8y n ILE 192 N 4.11 0.00 -0.08 -1.44 -5.35 -1.26 -4.00 119.36 111.33 1r8y n ILE 192 Ca 0.34 -0.01 -0.23 0.00 -0.27 0.00 0.00 62.75 62.58 1r8y n ILE 192 Cb -0.04 0.09 -0.12 0.00 -1.74 0.00 0.00 39.64 37.84 1r8y n ILE 192 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1r8y n TYR 193 N -1.44 0.68 -3.84 4.28 4.01 -1.26 -4.40 117.16 115.19 1r8y n TYR 193 Ca 0.06 0.21 -0.25 0.00 -0.16 0.00 0.00 57.90 57.76 1r8y n TYR 193 Cb 0.33 -1.08 -0.17 0.00 -0.31 0.00 0.00 39.34 38.11 1r8y n TYR 193 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1r8y s TYR 194 N -2.48 1.16 -0.13 -0.72 2.02 -1.26 -0.91 117.35 115.02 1r8y s TYR 194 Ca -0.30 -0.55 -0.29 0.00 -0.37 0.00 0.00 57.07 55.56 1r8y s TYR 194 Cb 0.09 -1.06 -0.04 0.00 -0.40 0.00 0.00 41.96 40.55 1r8y s TYR 194 CO 0.62 -0.45 1.61 -1.59 -1.57 0.00 0.00 175.55 174.17 1r8y s LYS 195 N 1.82 4.02 0.26 -0.62 -2.85 -1.06 -4.68 119.74 116.63 1r8y s LYS 195 Ca 0.04 1.94 -0.29 0.00 -1.00 0.00 0.00 55.97 56.65 1r8y s LYS 195 Cb -0.13 -3.99 -0.09 0.00 -2.06 0.00 0.00 37.83 31.56 1r8y s LYS 195 CO -0.07 -1.02 1.24 -1.12 0.10 0.00 0.00 175.35 174.48 1r8y s SER 196 N 3.63 6.98 0.23 0.03 0.01 -1.26 -4.27 113.70 119.04 1r8y s SER 196 Ca 0.71 2.44 0.21 0.00 1.31 0.00 0.00 55.95 60.62 1r8y s SER 196 Cb -0.29 -2.63 0.04 0.00 0.21 0.00 0.00 66.02 63.36 1r8y s SER 196 CO 0.28 -0.41 1.14 0.44 0.41 0.00 0.00 173.24 175.10 1r8y h ASP 197 N 4.31 0.00 -3.59 2.44 3.32 -1.93 -3.47 116.42 117.50 1r8y h ASP 197 Ca -0.47 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.07 1r8y h ASP 197 Cb 1.22 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1r8y h ASP 197 CO 0.70 0.15 0.30 -0.22 -1.72 0.00 0.00 179.24 178.45 1r8y s LEU 198 N -5.69 4.55 -1.04 1.55 2.96 -1.26 -5.01 118.68 114.74 1r8y s LEU 198 Ca 0.01 1.76 -0.19 0.00 -0.22 0.00 0.00 54.13 55.49 1r8y s LEU 198 Cb 0.08 -3.50 0.11 0.00 0.50 0.00 0.00 46.19 43.38 1r8y s LEU 198 CO 0.77 0.05 1.33 0.42 -1.32 0.00 0.00 176.35 177.60 1r8y s THR 199 N -0.50 4.47 0.59 3.68 -4.23 -1.26 -4.99 115.64 113.40 1r8y s THR 199 Ca 0.42 -1.53 -0.16 0.00 -1.18 0.00 0.00 61.69 59.24 1r8y s THR 199 Cb -0.24 -4.93 -0.03 0.00 1.34 0.00 0.00 72.50 68.64 1r8y s THR 199 CO 0.29 -1.71 1.08 -0.54 -0.54 0.00 0.00 174.62 173.20 1r8y s LYS 200 N 3.36 3.24 -0.09 3.99 1.02 -1.26 -4.30 119.74 125.70 1r8y s LYS 200 Ca 0.40 1.30 0.03 0.00 0.02 0.00 0.00 55.97 57.72 1r8y s LYS 200 Cb -0.02 -2.02 0.01 0.00 -0.52 0.00 0.00 37.83 35.28 1r8y s LYS 200 CO -0.06 -0.89 -0.17 0.34 -0.92 0.00 0.00 175.35 173.65 1r8y s ASP 201 N -2.56 2.46 -0.08 2.83 -1.08 0.19 -4.94 116.67 113.48 1r8y s ASP 201 Ca 0.66 -0.44 0.03 0.00 -0.52 0.00 0.00 52.55 52.28 1r8y s ASP 201 Cb -0.18 -1.12 0.01 0.00 -1.46 0.00 0.00 42.92 40.17 1r8y s ASP 201 CO 0.35 0.07 -0.17 -0.63 0.52 0.00 0.00 175.17 175.32 1r8y s ILE 202 N 0.67 1.50 -0.24 4.11 1.01 -1.26 0.53 121.20 127.53 1r8y s ILE 202 Ca -0.13 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 59.80 1r8y s ILE 202 Cb -0.16 -1.33 0.01 0.00 0.01 0.00 0.00 42.46 40.99 1r8y s ILE 202 CO 0.03 0.44 -0.06 -0.89 0.00 0.00 0.00 174.94 174.46 1r8y s THR 203 N 0.53 2.99 -0.28 2.92 2.01 -1.13 -4.97 115.64 117.70 1r8y s THR 203 Ca -0.16 -0.85 -0.18 0.00 0.31 0.00 0.00 61.69 60.81 1r8y s THR 203 Cb -0.17 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.88 1r8y s THR 203 CO 0.06 0.29 0.51 -0.89 -0.69 0.00 0.00 174.62 173.90 1r8y s THR 204 N 1.37 5.06 -0.17 -0.82 2.01 -1.26 -2.00 115.64 119.83 1r8y s THR 204 Ca 0.02 0.73 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 1r8y s THR 204 Cb -0.16 -3.86 -0.00 0.00 0.01 0.00 0.00 72.50 68.50 1r8y s THR 204 CO -0.05 0.01 -0.12 -0.44 -0.69 0.00 0.00 174.62 173.34 1r8y s SER 205 N 1.61 3.88 -0.18 3.53 0.01 0.50 -4.89 113.70 118.16 1r8y s SER 205 Ca 0.20 -0.43 -0.08 0.00 1.31 0.00 0.00 55.95 56.95 1r8y s SER 205 Cb -0.16 -1.62 -0.04 0.00 0.21 0.00 0.00 66.02 64.41 1r8y s SER 205 CO 0.10 0.06 0.09 -0.69 0.41 0.00 0.00 173.24 173.22 1r8y s VAL 206 N 0.95 5.08 -0.24 3.43 1.01 -1.26 -0.90 120.40 128.46 1r8y s VAL 206 Ca -0.02 0.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.93 1r8y s VAL 206 Cb -0.15 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 1r8y s VAL 206 CO -0.01 0.48 0.12 -0.22 0.00 0.00 0.00 175.10 175.47 1r8y s LEU 207 N 0.16 3.83 -0.29 3.92 2.96 -0.14 -5.00 118.68 124.12 1r8y s LEU 207 Ca 0.07 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 1r8y s LEU 207 Cb -0.12 -2.03 0.07 0.00 0.50 0.00 0.00 46.19 44.62 1r8y s LEU 207 CO -0.00 0.02 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.11 1r8y s THR 208 N 1.28 2.30 -0.20 3.68 2.01 -1.26 -0.94 115.64 122.51 1r8y s THR 208 Ca 0.06 -1.81 -0.17 0.00 0.31 0.00 0.00 61.69 60.08 1r8y s THR 208 Cb -0.14 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.88 1r8y s THR 208 CO 0.05 -0.20 0.43 -0.69 -0.69 0.00 0.00 174.62 173.53 1r8y s VAL 209 N 1.06 5.17 -1.56 3.82 1.01 -0.94 -4.47 120.40 124.49 1r8y s VAL 209 Ca -0.03 0.78 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 1r8y s VAL 209 Cb -0.20 -3.76 0.02 0.00 0.00 0.00 0.00 36.38 32.44 1r8y s VAL 209 CO -0.05 0.23 0.11 0.59 0.00 0.00 0.00 175.10 175.98 1r8y n ASN 210 N 4.54 0.52 0.00 3.32 3.02 -1.26 -0.17 115.26 125.23 1r8y n ASN 210 Ca -0.07 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.24 1r8y n ASN 210 Cb 0.51 -1.78 0.00 0.00 -0.61 0.00 0.00 39.78 37.89 1r8y n ASN 210 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1r8y n ASN 211 N -2.86 -3.77 -4.23 6.41 2.85 -1.26 -4.99 115.26 107.41 1r8y n ASN 211 Ca -0.29 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 53.85 1r8y n ASN 211 Cb 0.68 -1.51 -0.15 0.00 1.24 0.00 0.00 39.78 40.04 1r8y n ASN 211 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1r8y s LYS 212 N -0.68 3.17 0.30 1.20 2.20 0.76 -5.09 119.74 121.61 1r8y s LYS 212 Ca 0.00 -0.76 -0.29 0.00 -0.36 0.00 0.00 55.97 54.56 1r8y s LYS 212 Cb 0.00 -2.67 -0.13 0.00 -1.51 0.00 0.00 37.83 33.52 1r8y s LYS 212 CO 0.00 -0.08 1.28 0.00 -0.36 0.00 0.00 175.35 176.18 1r8y n ALA 213 N 4.34 0.94 0.00 3.13 0.00 -1.26 -2.22 120.51 125.44 1r8y n ALA 213 Ca -0.19 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1r8y n ALA 213 Cb 0.51 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1r8y n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1r8y n HIS 214 N 0.84 0.00 -3.67 0.00 -0.00 -0.11 -4.85 115.22 107.43 1r8y n HIS 214 Ca 0.08 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.11 1r8y n HIS 214 Cb 0.34 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.13 1r8y n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1r8y s MET 215 N -1.22 0.75 -0.17 1.57 1.75 -1.14 -4.66 119.30 116.18 1r8y s MET 215 Ca 0.00 0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.81 1r8y s MET 215 Cb 0.00 0.35 0.03 0.00 2.84 0.00 0.00 34.83 38.05 1r8y s MET 215 CO 0.00 -0.17 -0.15 0.08 -0.65 0.00 0.00 175.02 174.13 1r8y s VAL 216 N -0.54 1.74 -0.13 10.11 1.01 0.20 -0.97 120.40 131.82 1r8y s VAL 216 Ca -0.07 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1r8y s VAL 216 Cb -0.03 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1r8y s VAL 216 CO 0.04 0.40 -0.12 -0.89 0.00 0.00 0.00 175.10 174.53 1r8y s THR 217 N 1.40 3.12 -0.09 3.92 2.01 -0.08 -0.12 115.64 125.80 1r8y s THR 217 Ca 0.03 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.41 1r8y s THR 217 Cb -0.14 -2.32 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 1r8y s THR 217 CO -0.11 0.52 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.45 1r8y s LEU 218 N 0.36 2.71 -0.41 4.42 1.43 0.05 -0.37 118.68 126.87 1r8y s LEU 218 Ca -0.10 -0.27 -0.07 0.00 -1.03 0.00 0.00 54.13 52.66 1r8y s LEU 218 Cb -0.16 -1.58 0.09 0.00 0.03 0.00 0.00 46.19 44.57 1r8y s LEU 218 CO 0.05 0.26 0.23 -1.81 0.23 0.00 0.00 176.35 175.31 1r8y s ASP 219 N -0.20 5.48 0.05 2.29 1.01 -0.85 -1.46 116.67 122.99 1r8y s ASP 219 Ca 0.00 -1.65 -0.30 0.00 0.71 0.00 0.00 52.55 51.31 1r8y s ASP 219 Cb -0.13 -1.92 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 1r8y s ASP 219 CO 0.03 -0.53 0.99 -0.31 0.21 0.00 0.00 175.17 175.57 1r8y s TYR 220 N 1.33 3.70 -0.13 4.23 1.51 0.18 -2.84 117.35 125.32 1r8y s TYR 220 Ca 0.04 1.70 0.00 0.00 -1.01 0.00 0.00 57.07 57.81 1r8y s TYR 220 Cb -0.23 -3.12 -0.01 0.00 -0.11 0.00 0.00 41.96 38.49 1r8y s TYR 220 CO -0.00 -0.04 -0.15 0.99 -1.11 0.00 0.00 175.55 175.24 1r8y s THR 221 N 0.62 2.87 -0.03 -0.71 2.01 0.19 -1.02 115.64 119.57 1r8y s THR 221 Ca 0.51 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.82 1r8y s THR 221 Cb -0.23 -2.20 -0.00 0.00 0.01 0.00 0.00 72.50 70.09 1r8y s THR 221 CO 0.29 0.53 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.94 1r8y s VAL 222 N 0.43 0.96 0.35 3.82 1.01 0.63 0.53 120.40 128.12 1r8y s VAL 222 Ca -0.11 -0.47 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 1r8y s VAL 222 Cb -0.16 -0.83 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 1r8y s VAL 222 CO 0.05 0.29 1.17 -1.58 0.00 0.00 0.00 175.10 175.03 1r8y s GLN 223 N 0.07 4.31 0.00 2.72 0.74 -1.26 -1.65 119.66 124.58 1r8y s GLN 223 Ca -0.02 1.89 0.00 0.00 0.05 0.00 0.00 55.36 57.28 1r8y s GLN 223 Cb -0.08 -2.91 0.00 0.00 1.10 0.00 0.00 33.01 31.12 1r8y s GLN 223 CO 0.01 -0.11 0.00 1.55 -0.55 0.00 0.00 175.29 176.18 1r8y n VAL 224 N 0.56 0.00 0.00 1.34 3.14 -1.26 -4.96 118.33 117.16 1r8y n VAL 224 Ca 0.02 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 1r8y n VAL 224 Cb 0.45 -0.05 0.00 0.00 -1.06 0.00 0.00 33.84 33.18 1r8y n VAL 224 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1r8y n GLY 234 N -0.83 -0.07 3.21 7.55 0.00 -1.26 -5.07 105.19 108.72 1r8y n GLY 234 Ca 0.00 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1r8y n GLY 234 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8y s PHE 235 N 0.00 3.28 0.08 1.61 0.40 -1.26 -4.86 117.98 117.23 1r8y s PHE 235 Ca 0.00 -1.74 0.09 0.00 -0.60 0.00 0.00 56.93 54.68 1r8y s PHE 235 Cb 0.00 -2.26 -0.03 0.00 0.51 0.00 0.00 43.02 41.24 1r8y s PHE 235 CO 0.00 -0.79 -0.23 -1.12 0.70 0.00 0.00 175.22 173.78 1r8y s SER 236 N 1.36 3.49 0.08 1.36 0.01 -0.66 -4.91 113.70 114.43 1r8y s SER 236 Ca -0.03 -0.58 0.08 0.00 1.31 0.00 0.00 55.95 56.74 1r8y s SER 236 Cb -0.20 -0.40 -0.04 0.00 0.21 0.00 0.00 66.02 65.59 1r8y s SER 236 CO 0.00 0.23 -0.20 -0.54 0.41 0.00 0.00 173.24 173.14 1r8y s LYS 237 N -1.63 1.86 0.16 12.44 1.02 -1.26 -0.27 119.74 132.06 1r8y s LYS 237 Ca 0.14 -1.11 -0.03 0.00 0.02 0.00 0.00 55.97 54.99 1r8y s LYS 237 Cb -0.10 -2.10 -0.03 0.00 -0.52 0.00 0.00 37.83 35.07 1r8y s LYS 237 CO 0.05 0.51 0.13 -0.59 -0.92 0.00 0.00 175.35 174.53 1r8y s PHE 238 N -1.00 0.84 -0.00 3.18 -0.71 -0.19 -4.41 117.98 115.69 1r8y s PHE 238 Ca 0.15 -1.17 0.01 0.00 -1.04 0.00 0.00 56.93 54.88 1r8y s PHE 238 Cb -0.10 -0.40 -0.00 0.00 -1.21 0.00 0.00 43.02 41.30 1r8y s PHE 238 CO 0.07 -0.61 -0.04 0.50 -1.34 0.00 0.00 175.22 173.80 1r8y s ARG 239 N -4.06 0.35 0.05 1.99 3.52 -1.26 0.49 118.95 120.03 1r8y s ARG 239 Ca 0.27 -0.15 0.01 0.00 -0.13 0.00 0.00 55.73 55.73 1r8y s ARG 239 Cb 0.06 -0.35 -0.03 0.00 -1.56 0.00 0.00 34.95 33.07 1r8y s ARG 239 CO 0.05 0.08 -0.05 -0.51 -0.81 0.00 0.00 175.30 174.05 1r8y s LEU 240 N -0.05 2.36 0.15 -0.88 1.43 -0.54 -5.01 118.68 116.15 1r8y s LEU 240 Ca 0.01 -0.74 0.05 0.00 -1.03 0.00 0.00 54.13 52.42 1r8y s LEU 240 Cb -0.02 -0.01 -0.04 0.00 0.03 0.00 0.00 46.19 46.14 1r8y s LEU 240 CO -0.00 -0.37 -0.11 -0.44 0.23 0.00 0.00 176.35 175.66 1r8y s SER 241 N -2.18 1.89 0.01 2.29 0.01 -1.26 -0.77 113.70 113.69 1r8y s SER 241 Ca -0.03 -1.00 -0.04 0.00 1.31 0.00 0.00 55.95 56.19 1r8y s SER 241 Cb -0.03 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.17 1r8y s SER 241 CO -0.03 -0.30 0.07 -0.31 0.41 0.00 0.00 173.24 173.08 1r8y s TYR 242 N -3.21 0.11 -0.23 2.43 1.51 0.83 -4.70 117.35 114.10 1r8y s TYR 242 Ca 0.17 -0.25 -0.20 0.00 -1.01 0.00 0.00 57.07 55.78 1r8y s TYR 242 Cb 0.02 -0.09 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 1r8y s TYR 242 CO 0.01 -0.23 0.60 -0.47 -1.11 0.00 0.00 175.55 174.35 1r8y s TYR 243 N -1.29 3.33 -1.27 2.71 5.04 0.11 -0.62 117.35 125.34 1r8y s TYR 243 Ca -0.14 0.82 -0.19 0.00 -2.44 0.00 0.00 57.07 55.12 1r8y s TYR 243 Cb -0.08 -2.78 0.03 0.00 0.35 0.00 0.00 41.96 39.48 1r8y s TYR 243 CO 0.01 -0.23 1.81 -0.35 -1.34 0.00 0.00 175.55 175.44 1r8y n PRO 244 N 5.31 2.78 -2.00 4.97 -0.04 -1.26 -4.75 135.00 140.01 1r8y n PRO 244 Ca -0.02 -3.04 -0.43 0.00 -0.04 0.00 0.00 63.50 59.98 1r8y n PRO 244 Cb 0.50 -3.54 -0.03 0.00 -0.04 0.00 0.00 33.50 30.39 1r8y n PRO 244 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1r8y s HIS 245 N 5.80 1.89 0.42 0.54 3.76 -1.26 -4.96 115.29 121.48 1r8y s HIS 245 Ca 0.57 0.43 -0.22 0.00 -0.15 0.00 0.00 55.06 55.69 1r8y s HIS 245 Cb 0.04 -4.01 -0.11 0.00 1.11 0.00 0.00 32.58 29.61 1r8y s HIS 245 CO 0.09 -3.39 0.96 0.00 -0.85 0.00 0.00 174.74 171.55 1r8y h LEU 247 N 2.08 0.75 0.29 0.00 5.85 -1.94 -1.25 115.31 121.08 1r8y h LEU 247 Ca -0.49 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.24 1r8y h LEU 247 Cb 1.19 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1r8y h LEU 247 CO 0.61 0.50 -0.24 0.00 -0.34 0.00 0.00 178.44 178.97 1r8y h ALA 248 N 1.34 -0.53 0.42 1.25 0.00 -2.00 -2.03 119.26 117.71 1r8y h ALA 248 Ca 0.31 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1r8y h ALA 248 Cb 0.08 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1r8y h ALA 248 CO -0.14 -0.82 -0.20 0.77 0.00 0.00 0.00 179.25 178.86 1r8y h SER 249 N -0.54 -0.47 -0.53 0.00 0.02 -1.81 -2.03 113.55 108.19 1r8y h SER 249 Ca -0.02 -0.06 0.11 0.00 -0.84 0.00 0.00 61.79 60.98 1r8y h SER 249 Cb 0.49 0.12 -0.09 0.00 0.14 0.00 0.00 62.40 63.05 1r8y h SER 249 CO -0.02 -0.23 -0.07 0.15 -1.14 0.00 0.00 176.83 175.52 1r8y h PHE 250 N -0.70 -0.16 -0.48 3.45 3.57 -1.29 0.30 116.94 121.62 1r8y h PHE 250 Ca -0.06 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1r8y h PHE 250 Cb 0.50 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 39.31 1r8y h PHE 250 CO -0.01 -0.18 -0.54 1.15 -2.23 0.00 0.00 178.31 176.49 1r8y h THR 251 N 0.05 0.00 -0.77 4.41 2.02 -1.13 0.16 112.91 117.66 1r8y h THR 251 Ca 0.26 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.53 1r8y h THR 251 Cb 0.40 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.70 1r8y h THR 251 CO -0.49 0.00 -0.51 -0.33 0.37 0.00 0.00 175.52 174.55 1r8y h GLU 252 N -0.32 -0.14 -0.00 6.66 4.39 -0.29 -1.37 114.58 123.51 1r8y h GLU 252 Ca 0.08 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.81 1r8y h GLU 252 Cb 0.54 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 1r8y h GLU 252 CO -0.63 -0.09 -0.10 -0.07 -1.16 0.00 0.00 179.01 176.96 1r8y h LEU 253 N -0.14 -0.30 -0.48 1.33 3.38 0.12 -0.55 115.31 118.67 1r8y h LEU 253 Ca 0.17 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1r8y h LEU 253 Cb 0.52 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1r8y h LEU 253 CO -0.81 -0.15 -0.16 1.62 0.09 0.00 0.00 178.44 179.03 1r8y h VAL 254 N -0.18 1.27 -0.12 1.22 3.04 -0.64 -2.11 116.25 118.73 1r8y h VAL 254 Ca 0.04 -1.30 0.01 0.00 -1.01 0.00 0.00 66.70 64.44 1r8y h VAL 254 Cb 0.23 1.11 -0.02 0.00 -2.01 0.00 0.00 31.29 30.60 1r8y h VAL 254 CO -0.11 0.45 0.02 0.03 -1.01 0.00 0.00 177.57 176.96 1r8y h ARG 255 N 0.80 0.07 -0.38 4.17 3.08 -1.05 -2.14 114.38 118.92 1r8y h ARG 255 Ca 0.12 -0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.23 1r8y h ARG 255 Cb 0.72 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 1r8y h ARG 255 CO 0.06 0.05 0.26 0.00 -1.07 0.00 0.00 179.97 179.27 1r8y h ALA 256 N 1.09 2.10 0.00 0.04 0.00 -0.92 -1.43 119.26 120.14 1r8y h ALA 256 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1r8y h ALA 256 Cb 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1r8y h ALA 256 CO -0.07 -0.18 -0.06 0.00 0.00 0.00 0.00 179.25 178.93 1r8y h ALA 257 N 1.80 1.39 -0.01 0.00 0.00 -0.68 0.20 119.26 121.96 1r8y h ALA 257 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1r8y h ALA 257 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1r8y h ALA 257 CO -0.03 0.08 -0.48 1.19 0.00 0.00 0.00 179.25 180.01 1r8y n PHE 258 N -3.73 0.00 -2.09 0.00 3.72 -0.55 -4.73 117.46 110.07 1r8y n PHE 258 Ca -0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 1r8y n PHE 258 Cb 0.16 -0.10 -0.00 0.00 -0.94 0.00 0.00 39.48 38.60 1r8y n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r8y n GLY 259 N 1.42 0.12 3.33 1.37 0.00 0.69 -3.86 105.19 108.25 1r8y n GLY 259 Ca 0.09 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1r8y n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8y n GLY 260 N -1.05 1.62 3.57 -0.02 0.00 -1.13 -4.91 105.19 103.27 1r8y n GLY 260 Ca -0.08 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1r8y n GLY 260 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1r8y s ARG 261 N 0.00 3.65 0.24 1.61 3.03 -1.25 -4.84 118.95 121.39 1r8y s ARG 261 Ca 0.00 -1.44 -0.10 0.00 2.03 0.00 0.00 55.73 56.22 1r8y s ARG 261 Cb 0.00 -5.41 -0.01 0.00 -1.03 0.00 0.00 34.95 28.50 1r8y s ARG 261 CO 0.00 -2.38 0.41 0.00 -1.13 0.00 0.00 175.30 172.20 1r8y s GLN 263 N -4.02 1.87 -0.06 0.00 0.74 0.10 -4.72 119.66 113.58 1r8y s GLN 263 Ca 0.26 -0.57 0.01 0.00 0.05 0.00 0.00 55.36 55.10 1r8y s GLN 263 Cb 0.01 -1.57 0.02 0.00 1.10 0.00 0.00 33.01 32.57 1r8y s GLN 263 CO 0.10 0.17 -0.05 -1.58 -0.55 0.00 0.00 175.29 173.38 1r8y s HIS 264 N 0.26 0.88 0.00 1.67 5.65 -1.26 0.49 115.29 122.98 1r8y s HIS 264 Ca -0.09 -0.29 0.06 0.00 0.25 0.00 0.00 55.06 54.99 1r8y s HIS 264 Cb -0.13 -0.79 -0.02 0.00 -1.18 0.00 0.00 32.58 30.46 1r8y s HIS 264 CO 0.03 -0.26 -0.18 -1.12 -0.65 0.00 0.00 174.74 172.56 1r8y s SER 265 N 1.18 2.10 -0.27 9.88 0.01 -0.82 -5.03 113.70 120.74 1r8y s SER 265 Ca -0.07 -0.37 -0.10 0.00 1.31 0.00 0.00 55.95 56.72 1r8y s SER 265 Cb -0.14 -0.21 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 1r8y s SER 265 CO -0.01 0.19 0.15 0.68 0.41 0.00 0.00 173.24 174.66 1r8y s VAL 266 N -0.53 5.02 0.16 3.43 -7.23 -1.26 -1.82 120.40 118.17 1r8y s VAL 266 Ca 0.06 0.07 -0.10 0.00 -1.81 0.00 0.00 61.98 60.20 1r8y s VAL 266 Cb -0.07 -3.38 -0.07 0.00 0.56 0.00 0.00 36.38 33.42 1r8y s VAL 266 CO -0.00 0.28 0.49 -0.76 -0.31 0.00 0.00 175.10 174.80 1r8y s LEU 267 N 1.72 4.27 0.00 1.32 1.43 0.25 -2.61 118.68 125.05 1r8y s LEU 267 Ca 0.07 0.89 0.00 0.00 -1.03 0.00 0.00 54.13 54.06 1r8y s LEU 267 Cb -0.16 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.70 1r8y s LEU 267 CO 0.09 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.32 1r8y n GLY 268 N 0.39 1.13 0.08 -3.19 0.00 1.09 -2.47 105.19 102.21 1r8y n GLY 268 Ca -0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.01 1r8y n GLY 268 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r8y n ASP 269 N 0.00 0.58 0.00 1.61 8.00 -1.26 -4.30 116.55 121.17 1r8y n ASP 269 Ca 0.00 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.75 1r8y n ASP 269 Cb 0.00 0.66 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1r8y n ASP 269 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1r8y n PHE 270 N -2.72 0.00 -3.14 1.24 0.99 -1.26 -4.87 117.46 107.69 1r8y n PHE 270 Ca -0.11 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.06 1r8y n PHE 270 Cb 0.80 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 39.25 1r8y n PHE 270 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1r8y s LYS 271 N 0.00 3.63 0.96 -1.08 -0.14 -1.26 -5.00 119.74 116.84 1r8y s LYS 271 Ca 0.00 0.08 -0.11 0.00 -1.36 0.00 0.00 55.97 54.58 1r8y s LYS 271 Cb 0.00 -2.56 0.15 0.00 -1.68 0.00 0.00 37.83 33.74 1r8y s LYS 271 CO 0.00 0.09 1.02 -2.30 -0.76 0.00 0.00 175.35 173.40 1r8y n PRO 272 N -1.32 -0.71 -3.93 -1.68 -0.02 -1.26 0.35 135.00 126.43 1r8y n PRO 272 Ca -0.01 -0.15 -0.30 0.00 -2.02 0.00 0.00 63.50 61.02 1r8y n PRO 272 Cb 0.54 -2.28 -0.16 0.00 -0.02 0.00 0.00 33.50 31.59 1r8y n PRO 272 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1r8y s TYR 273 N -2.57 2.35 0.14 6.00 5.04 -1.07 -3.95 117.35 123.28 1r8y s TYR 273 Ca 0.66 -1.72 -0.20 0.00 -2.44 0.00 0.00 57.07 53.37 1r8y s TYR 273 Cb -0.23 -1.56 -0.07 0.00 0.35 0.00 0.00 41.96 40.45 1r8y s TYR 273 CO 0.60 -0.77 0.64 -1.59 -1.34 0.00 0.00 175.55 173.10 1r8y s LYS 274 N 1.41 4.26 0.14 4.97 -2.85 -1.26 -4.87 119.74 121.54 1r8y s LYS 274 Ca -0.06 0.82 -0.31 0.00 -1.00 0.00 0.00 55.97 55.42 1r8y s LYS 274 Cb -0.19 -3.12 -0.10 0.00 -2.06 0.00 0.00 37.83 32.36 1r8y s LYS 274 CO -0.06 0.55 1.69 -2.14 0.10 0.00 0.00 175.35 175.49 1r8y s PRO 275 N -1.43 4.17 -0.10 1.78 0.02 -1.26 -3.12 135.00 135.06 1r8y s PRO 275 Ca 0.35 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.84 1r8y s PRO 275 Cb -0.19 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 30.98 1r8y s PRO 275 CO 0.21 -0.73 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 1r8y n GLY 276 N 3.99 0.40 3.48 0.52 0.00 -1.26 -5.04 105.19 107.28 1r8y n GLY 276 Ca 0.16 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1r8y n GLY 276 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1r8y s GLN 277 N -2.88 -1.51 -0.03 1.61 -2.07 -1.18 -4.99 119.66 108.62 1r8y s GLN 277 Ca 0.00 0.30 -0.23 0.00 -1.82 0.00 0.00 55.36 53.62 1r8y s GLN 277 Cb 0.00 -1.53 -0.16 0.00 -1.09 0.00 0.00 33.01 30.23 1r8y s GLN 277 CO 0.00 -3.98 1.02 0.00 -1.32 0.00 0.00 175.29 171.01 1r8y h ALA 278 N -2.78 -0.30 -2.61 2.60 0.00 -1.96 -3.45 119.26 110.76 1r8y h ALA 278 Ca -0.51 -0.21 -0.52 0.00 0.00 0.00 0.00 54.91 53.67 1r8y h ALA 278 Cb 1.33 0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.25 1r8y h ALA 278 CO 0.40 -0.41 0.57 -0.47 0.00 0.00 0.00 179.25 179.34 1r8y s TYR 279 N -3.93 3.42 -0.24 0.00 5.04 -1.26 -5.05 117.35 115.34 1r8y s TYR 279 Ca -0.13 1.37 -0.05 0.00 -2.44 0.00 0.00 57.07 55.82 1r8y s TYR 279 Cb 0.01 -3.44 -0.01 0.00 0.35 0.00 0.00 41.96 38.87 1r8y s TYR 279 CO 0.50 -1.28 0.01 0.14 -1.34 0.00 0.00 175.55 173.58 1r8y s VAL 280 N 0.26 3.76 0.66 3.14 -7.23 -1.26 -5.04 120.40 114.69 1r8y s VAL 280 Ca 0.55 -0.39 -0.11 0.00 -1.81 0.00 0.00 61.98 60.22 1r8y s VAL 280 Cb -0.32 -2.75 -0.01 0.00 0.56 0.00 0.00 36.38 33.86 1r8y s VAL 280 CO 0.34 0.37 1.05 -2.84 -0.31 0.00 0.00 175.10 173.71 1r8y s PRO 281 N 1.53 3.19 -0.12 4.82 0.02 -1.26 -5.00 135.00 138.18 1r8y s PRO 281 Ca 0.06 0.90 -0.03 0.00 0.02 0.00 0.00 61.00 61.94 1r8y s PRO 281 Cb -0.15 -2.02 -0.25 0.00 0.02 0.00 0.00 34.50 32.09 1r8y s PRO 281 CO -0.00 -0.90 0.37 0.00 -0.33 0.00 0.00 177.00 176.15 1r8y s TYR 283 N -2.56 2.41 -0.19 0.00 1.51 -1.26 -1.44 117.35 115.82 1r8y s TYR 283 Ca -0.20 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.55 1r8y s TYR 283 Cb 0.07 -1.14 0.02 0.00 -0.11 0.00 0.00 41.96 40.80 1r8y s TYR 283 CO 0.77 0.57 -0.17 -0.06 -1.11 0.00 0.00 175.55 175.55 1r8y s PHE 284 N -1.95 2.84 -0.21 2.71 0.08 0.47 -4.34 117.98 117.57 1r8y s PHE 284 Ca 0.25 -1.59 -0.08 0.00 0.12 0.00 0.00 56.93 55.63 1r8y s PHE 284 Cb -0.07 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 1r8y s PHE 284 CO 0.13 -0.78 0.08 0.42 -0.10 0.00 0.00 175.22 174.98 1r8y s ILE 285 N 1.31 4.76 -0.23 0.64 1.01 -1.03 -1.39 121.20 126.26 1r8y s ILE 285 Ca 0.04 -0.04 -0.10 0.00 0.00 0.00 0.00 60.65 60.56 1r8y s ILE 285 Cb -0.14 -3.18 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 1r8y s ILE 285 CO -0.11 0.41 0.14 -1.00 0.00 0.00 0.00 174.94 174.38 1r8y s HIS 286 N 0.80 3.29 -0.14 3.97 3.76 0.31 0.87 115.29 128.15 1r8y s HIS 286 Ca 0.04 0.16 0.02 0.00 -0.15 0.00 0.00 55.06 55.14 1r8y s HIS 286 Cb -0.13 -2.24 0.01 0.00 1.11 0.00 0.00 32.58 31.33 1r8y s HIS 286 CO 0.02 0.05 -0.21 0.54 -0.85 0.00 0.00 174.74 174.29 1r8y s VAL 287 N 1.00 2.02 0.29 -0.90 0.11 -0.76 -0.85 120.40 121.30 1r8y s VAL 287 Ca 0.07 -0.95 0.10 0.00 -2.93 0.00 0.00 61.98 58.27 1r8y s VAL 287 Cb -0.13 -1.79 -0.05 0.00 -1.53 0.00 0.00 36.38 32.88 1r8y s VAL 287 CO 0.04 0.54 -0.06 -0.76 -3.33 0.00 0.00 175.10 171.53 1r8y s LEU 288 N 0.90 2.96 -0.22 2.54 1.02 0.50 -1.95 118.68 124.43 1r8y s LEU 288 Ca -0.05 -0.84 -0.03 0.00 0.02 0.00 0.00 54.13 53.23 1r8y s LEU 288 Cb -0.15 -1.44 0.07 0.00 0.02 0.00 0.00 46.19 44.68 1r8y s LEU 288 CO -0.04 -0.04 0.06 -0.54 0.02 0.00 0.00 176.35 175.81 1r8y s LYS 289 N -3.63 0.54 -0.48 1.70 -0.14 0.18 -2.89 119.74 115.01 1r8y s LYS 289 Ca 0.32 -0.48 -0.27 0.00 -1.36 0.00 0.00 55.97 54.18 1r8y s LYS 289 Cb -0.05 -1.97 -0.04 0.00 -1.68 0.00 0.00 37.83 34.10 1r8y s LYS 289 CO 0.18 -0.73 2.07 0.21 -0.76 0.00 0.00 175.35 176.32 1r8y s LYS 290 N 1.89 2.63 0.00 1.68 2.20 -0.72 0.00 119.74 127.42 1r8y s LYS 290 Ca 0.02 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 1r8y s LYS 290 Cb -0.17 -4.42 0.00 0.00 -1.51 0.00 0.00 37.83 31.73 1r8y s LYS 290 CO -0.13 -2.69 0.00 0.25 -0.36 0.00 0.00 175.35 172.41 1r8y n THR 291 N 7.56 0.00 -1.02 3.43 -2.24 -1.21 0.04 114.28 120.85 1r8y n THR 291 Ca 0.27 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1r8y n THR 291 Cb 0.51 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1r8y n THR 291 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60