#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9o s VAL 2 N 0.00 5.28 0.71 9.51 1.01 -1.26 -2.09 120.40 133.56 3i9o s VAL 2 Ca 0.00 0.56 -0.13 0.00 0.00 0.00 0.00 61.98 62.41 3i9o s VAL 2 Cb 0.00 -3.65 0.03 0.00 0.00 0.00 0.00 36.38 32.76 3i9o s VAL 2 CO 0.00 0.35 1.11 -2.16 0.00 0.00 0.00 175.10 174.40 3i9o s PRO 3 N 0.74 2.54 0.16 2.72 0.04 -1.26 -4.82 135.00 135.12 3i9o s PRO 3 Ca 0.16 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 3i9o s PRO 3 Cb -0.13 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 3i9o s PRO 3 CO 0.05 -1.44 1.51 0.99 0.04 0.00 0.00 177.00 178.15 3i9o s THR 4 N -2.54 2.81 0.62 1.26 2.01 0.35 -4.95 115.64 115.20 3i9o s THR 4 Ca 0.65 0.59 -0.18 0.00 0.31 0.00 0.00 61.69 63.06 3i9o s THR 4 Cb -0.20 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 3i9o s THR 4 CO 0.47 0.05 1.17 -0.13 -0.69 0.00 0.00 174.62 175.50 3i9o s ARG 5 N 1.05 2.88 -1.30 4.92 0.52 -1.26 -3.76 118.95 122.01 3i9o s ARG 5 Ca 0.68 1.69 -0.17 0.00 -0.52 0.00 0.00 55.73 57.41 3i9o s ARG 5 Cb -0.42 -1.93 0.01 0.00 0.52 0.00 0.00 34.95 33.13 3i9o s ARG 5 CO 0.31 -1.25 0.53 0.39 0.02 0.00 0.00 175.30 175.31 3i9o n GLU 6 N -1.87 -1.30 0.05 3.54 1.02 -1.26 -4.80 120.64 116.03 3i9o n GLU 6 Ca 0.13 0.25 -0.11 0.00 -0.02 0.00 0.00 57.16 57.40 3i9o n GLU 6 Cb 0.50 -3.57 -0.04 0.00 -0.02 0.00 0.00 31.44 28.31 3i9o n GLU 6 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3i9o h LEU 7 N -2.12 -0.73 -0.89 -4.62 5.85 -1.98 -2.22 115.31 108.60 3i9o h LEU 7 Ca -0.67 0.10 0.16 0.00 0.84 0.00 0.00 57.88 58.31 3i9o h LEU 7 Cb 1.39 0.30 -0.10 0.00 0.37 0.00 0.00 40.66 42.62 3i9o h LEU 7 CO 0.57 -0.31 0.48 -0.08 -0.34 0.00 0.00 178.44 178.75 3i9o h GLU 8 N -0.38 0.63 -0.17 1.25 4.81 -1.93 -0.02 114.58 118.77 3i9o h GLU 8 Ca 0.07 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 3i9o h GLU 8 Cb 0.46 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3i9o h GLU 8 CO -0.23 0.42 -0.55 -0.91 -0.73 0.00 0.00 179.01 177.01 3i9o h ASN 9 N 0.65 0.55 -0.16 1.04 2.35 -1.77 -1.67 115.58 116.56 3i9o h ASN 9 Ca 0.50 -0.30 -0.19 0.00 -0.55 0.00 0.00 56.30 55.77 3i9o h ASN 9 Cb 0.74 -0.16 0.01 0.00 0.05 0.00 0.00 38.32 38.96 3i9o h ASN 9 CO -0.38 0.99 -0.63 0.58 -1.65 0.00 0.00 177.43 176.35 3i9o h VAL 10 N 0.38 1.31 0.03 2.81 2.07 -0.92 -1.42 116.25 120.51 3i9o h VAL 10 Ca 0.01 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.68 3i9o h VAL 10 Cb 1.08 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.82 3i9o h VAL 10 CO 0.10 0.58 -0.06 0.15 0.02 0.00 0.00 177.57 178.36 3i9o h PHE 11 N 0.42 -0.15 0.00 1.57 3.04 -0.94 -0.92 116.94 119.95 3i9o h PHE 11 Ca -0.03 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.83 3i9o h PHE 11 Cb 1.25 0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.81 3i9o h PHE 11 CO 0.09 -0.09 -0.44 -0.07 -2.02 0.00 0.00 178.31 175.78 3i9o h LEU 12 N -0.12 0.00 0.01 0.59 3.38 -1.18 -1.48 115.31 116.51 3i9o h LEU 12 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 3i9o h LEU 12 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.89 3i9o h LEU 12 CO -0.04 0.44 -0.53 1.23 0.09 0.00 0.00 178.44 179.63 3i9o h GLY 13 N 1.51 0.38 1.43 0.83 0.00 -1.04 -1.54 103.07 104.64 3i9o h GLY 13 Ca -0.00 -0.69 0.01 0.00 0.00 0.00 0.00 47.33 46.64 3i9o h GLY 13 CO 0.06 0.61 0.38 3.21 0.00 0.00 0.00 176.54 180.80 3i9o h ARG 14 N -0.22 0.76 -0.33 4.80 3.08 -1.05 -0.14 114.38 121.27 3i9o h ARG 14 Ca -0.07 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.80 3i9o h ARG 14 Cb 1.26 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 3i9o h ARG 14 CO 0.10 0.50 -0.31 0.00 -1.07 0.00 0.00 179.97 179.19 3i9o h LYS 16 N 0.56 0.71 -0.88 0.00 1.63 -0.71 -0.73 116.57 117.15 3i9o h LYS 16 Ca 0.05 -0.38 0.06 0.00 -0.85 0.00 0.00 60.65 59.53 3i9o h LYS 16 Cb 0.89 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 32.48 3i9o h LYS 16 CO 0.08 1.00 0.57 0.22 -3.45 0.00 0.00 179.45 177.87 3i9o h ASP 17 N 0.45 0.89 0.14 4.20 3.58 -0.92 -2.67 116.42 122.08 3i9o h ASP 17 Ca 0.04 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 3i9o h ASP 17 Cb 0.88 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.74 3i9o h ASP 17 CO 0.07 0.58 -0.07 0.22 -2.88 0.00 0.00 179.24 177.17 3i9o h TYR 18 N 1.01 -0.17 -1.03 0.28 5.03 -0.96 -1.74 116.97 119.39 3i9o h TYR 18 Ca 0.37 -0.00 0.42 0.00 2.58 0.00 0.00 58.73 62.10 3i9o h TYR 18 Cb 0.16 0.06 -0.17 0.00 1.55 0.00 0.00 36.73 38.33 3i9o h TYR 18 CO -0.00 0.29 0.57 -1.91 -1.32 0.00 0.00 178.16 175.79 3i9o n GLU 19 N -4.89 -0.06 -0.00 1.82 2.13 -0.30 -2.58 120.64 116.76 3i9o n GLU 19 Ca -0.07 1.35 0.05 0.00 0.66 0.00 0.00 57.16 59.14 3i9o n GLU 19 Cb 0.27 -2.44 -0.08 0.00 0.27 0.00 0.00 31.44 29.45 3i9o n GLU 19 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 3i9o n ILE 20 N -5.17 0.00 0.00 6.31 2.08 -1.02 -4.82 119.36 116.74 3i9o n ILE 20 Ca 0.38 -0.24 0.00 0.00 0.56 0.00 0.00 62.75 63.45 3i9o n ILE 20 Cb 1.30 0.28 0.00 0.00 -0.75 0.00 0.00 39.64 40.48 3i9o n ILE 20 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 3i9o n THR 21 N -1.84 0.00 -3.95 1.39 -2.24 -0.66 -5.06 114.28 101.92 3i9o n THR 21 Ca -0.02 -0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.42 3i9o n THR 21 Cb 0.27 0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 3i9o n THR 21 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3i9o s ARG 22 N -0.32 3.35 -1.46 -0.78 1.81 -1.06 -4.51 118.95 115.97 3i9o s ARG 22 Ca 0.00 -0.31 -0.04 0.00 -1.72 0.00 0.00 55.73 53.66 3i9o s ARG 22 Cb 0.00 -3.07 0.00 0.00 -0.45 0.00 0.00 34.95 31.44 3i9o s ARG 22 CO 0.00 0.70 0.21 0.66 -0.68 0.00 0.00 175.30 176.19 3i9o n TYR 23 N 1.28 -1.41 0.02 -0.53 4.02 -1.26 -4.85 117.16 114.43 3i9o n TYR 23 Ca -0.14 0.59 -0.18 0.00 -0.01 0.00 0.00 57.90 58.16 3i9o n TYR 23 Cb 0.53 -3.10 -0.11 0.00 -0.02 0.00 0.00 39.34 36.64 3i9o n TYR 23 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 3i9o h LEU 24 N -1.89 0.60 -0.82 7.72 3.38 -1.83 -1.43 115.31 121.04 3i9o h LEU 24 Ca -0.66 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 56.54 3i9o h LEU 24 Cb 1.39 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3i9o h LEU 24 CO 0.66 1.30 -0.05 0.47 0.09 0.00 0.00 178.44 180.91 3i9o n ASP 25 N -4.14 1.32 -0.10 -0.43 8.00 -1.26 -4.42 116.55 115.53 3i9o n ASP 25 Ca -0.11 -1.35 -0.18 0.00 0.71 0.00 0.00 54.79 53.87 3i9o n ASP 25 Cb 0.73 0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.77 3i9o n ASP 25 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3i9o n ILE 26 N -0.05 1.07 -4.74 0.53 5.41 -1.10 -5.01 119.36 115.47 3i9o n ILE 26 Ca 0.18 -0.33 -0.27 0.00 1.00 0.00 0.00 62.75 63.33 3i9o n ILE 26 Cb 0.34 -1.50 -0.14 0.00 -0.71 0.00 0.00 39.64 37.62 3i9o n ILE 26 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3i9o s LEU 27 N -6.64 2.17 0.62 1.39 1.43 -0.56 -4.69 118.68 112.40 3i9o s LEU 27 Ca -0.26 -0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 52.14 3i9o s LEU 27 Cb 0.09 -1.10 -0.03 0.00 0.03 0.00 0.00 46.19 45.18 3i9o s LEU 27 CO 0.38 0.20 1.05 -2.16 0.23 0.00 0.00 176.35 176.05 3i9o s PRO 28 N -1.23 3.25 0.52 1.29 0.04 -1.26 -4.65 135.00 132.96 3i9o s PRO 28 Ca 0.09 1.11 -0.20 0.00 0.04 0.00 0.00 61.00 62.04 3i9o s PRO 28 Cb -0.09 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.36 3i9o s PRO 28 CO 0.02 -0.86 1.16 1.03 0.04 0.00 0.00 177.00 178.39 3i9o s ARG 29 N -4.35 3.43 0.62 4.56 1.81 -1.26 -4.91 118.95 118.84 3i9o s ARG 29 Ca 0.62 1.70 -0.06 0.00 -1.72 0.00 0.00 55.73 56.26 3i9o s ARG 29 Cb -0.15 -2.13 0.02 0.00 -0.45 0.00 0.00 34.95 32.24 3i9o s ARG 29 CO 0.42 -0.81 0.94 0.54 -0.68 0.00 0.00 175.30 175.71 3i9o s VAL 30 N -1.67 3.42 -0.20 3.52 0.11 -1.26 -5.01 120.40 119.31 3i9o s VAL 30 Ca 0.70 0.00 0.09 0.00 -2.93 0.00 0.00 61.98 59.84 3i9o s VAL 30 Cb -0.26 -3.38 -0.22 0.00 -1.53 0.00 0.00 36.38 30.99 3i9o s VAL 30 CO 0.30 -0.41 0.05 -1.14 -3.33 0.00 0.00 175.10 170.58 3i9o n ARG 31 N -2.67 0.68 -2.10 1.54 0.63 -1.26 -4.89 116.66 108.58 3i9o n ARG 31 Ca 0.05 0.11 -0.38 0.00 -0.92 0.00 0.00 57.85 56.71 3i9o n ARG 31 Cb 0.58 -1.57 0.00 0.00 0.45 0.00 0.00 32.46 31.92 3i9o n ARG 31 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 3i9o s SER 32 N -6.11 6.11 1.08 6.15 0.01 -1.26 -5.05 113.70 114.64 3i9o s SER 32 Ca -0.20 2.53 -0.10 0.00 1.31 0.00 0.00 55.95 59.49 3i9o s SER 32 Cb 0.07 -2.62 0.14 0.00 0.21 0.00 0.00 66.02 63.82 3i9o s SER 32 CO 0.73 -0.97 0.62 -0.90 0.41 0.00 0.00 173.24 173.13 3i9o n ASP 33 N -0.26 -0.96 -0.02 2.44 3.85 -1.26 -4.82 116.55 115.52 3i9o n ASP 33 Ca 0.06 -1.00 -0.16 0.00 -0.71 0.00 0.00 54.79 52.98 3i9o n ASP 33 Cb 0.45 -0.53 -0.09 0.00 -1.35 0.00 0.00 41.12 39.61 3i9o n ASP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3i9o h SER 35 N 0.03 0.00 0.12 0.00 4.64 -1.97 -0.45 113.55 115.91 3i9o h SER 35 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3i9o h SER 35 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 3i9o h SER 35 CO 0.11 0.19 -0.11 0.00 -0.87 0.00 0.00 176.83 176.15 3i9o h ALA 36 N 1.81 -0.22 0.27 5.18 0.00 -1.92 -1.70 119.26 122.67 3i9o h ALA 36 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3i9o h ALA 36 Cb 0.93 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3i9o h ALA 36 CO 0.02 -0.64 -0.13 -0.07 0.00 0.00 0.00 179.25 178.44 3i9o h LEU 37 N -0.25 -0.30 -0.24 0.00 3.38 -0.59 -2.89 115.31 114.41 3i9o h LEU 37 Ca 0.00 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3i9o h LEU 37 Cb 0.24 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 3i9o h LEU 37 CO -0.03 -0.19 -0.29 -0.25 0.09 0.00 0.00 178.44 177.77 3i9o h TRP 38 N -0.38 -0.78 -0.99 1.13 2.91 -1.18 -0.29 115.95 116.37 3i9o h TRP 38 Ca -0.04 0.04 0.17 0.00 1.13 0.00 0.00 58.89 60.20 3i9o h TRP 38 Cb 0.29 0.38 -0.17 0.00 -0.51 0.00 0.00 29.16 29.15 3i9o h TRP 38 CO -0.05 -0.36 -0.33 -0.22 -1.03 0.00 0.00 178.44 176.45 3i9o h LYS 39 N -0.30 -0.00 -0.38 2.65 3.64 -1.14 0.56 116.57 121.60 3i9o h LYS 39 Ca 0.13 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.41 3i9o h LYS 39 Cb 0.51 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 3i9o h LYS 39 CO -0.41 -0.00 -0.17 -0.44 -2.27 0.00 0.00 179.45 176.16 3i9o h ASP 40 N -0.00 0.81 0.12 4.20 3.32 -1.20 -1.61 116.42 122.06 3i9o h ASP 40 Ca 0.40 -0.40 0.01 0.00 0.02 0.00 0.00 57.03 57.06 3i9o h ASP 40 Cb 0.65 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 3i9o h ASP 40 CO -1.00 1.02 -0.21 0.15 -1.72 0.00 0.00 179.24 177.49 3i9o h PHE 41 N 0.58 -0.54 -0.80 4.55 3.57 0.12 -2.57 116.94 121.85 3i9o h PHE 41 Ca 0.09 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.62 3i9o h PHE 41 Cb 0.71 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.63 3i9o h PHE 41 CO 0.06 -0.30 0.52 0.35 -2.23 0.00 0.00 178.31 176.70 3i9o h PHE 42 N -0.40 0.97 -0.66 0.41 3.57 0.09 -2.65 116.94 118.28 3i9o h PHE 42 Ca 0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.56 3i9o h PHE 42 Cb 0.41 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 3i9o h PHE 42 CO -0.19 0.57 0.43 1.57 -2.23 0.00 0.00 178.31 178.46 3i9o h LYS 43 N 1.02 0.85 -0.91 1.11 2.10 -1.07 -0.91 116.57 118.76 3i9o h LYS 43 Ca 0.31 -0.05 0.15 0.00 -2.00 0.00 0.00 60.65 59.07 3i9o h LYS 43 Cb -0.02 -0.19 -0.16 0.00 -0.90 0.00 0.00 32.23 30.96 3i9o h LYS 43 CO -0.10 0.56 -0.32 0.00 -2.00 0.00 0.00 179.45 177.59 3i9o n ALA 44 N -2.28 -0.01 -0.01 0.07 0.00 -0.99 -3.72 120.51 113.57 3i9o n ALA 44 Ca 0.06 0.94 0.00 0.00 0.00 0.00 0.00 53.44 54.44 3i9o n ALA 44 Cb 0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 3i9o n ALA 44 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3i9o n PHE 45 N -5.39 0.00 -1.45 0.00 -1.74 -1.03 -4.83 117.46 103.02 3i9o n PHE 45 Ca 0.11 0.00 -0.37 0.00 -0.56 0.00 0.00 57.45 56.63 3i9o n PHE 45 Cb 0.39 -0.19 0.06 0.00 1.52 0.00 0.00 39.48 41.27 3i9o n PHE 45 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 3i9o n SER 46 N -1.93 -0.05 -0.02 5.98 3.41 -0.38 -3.26 113.62 117.38 3i9o n SER 46 Ca -0.05 0.71 -0.00 0.00 -0.26 0.00 0.00 58.87 59.27 3i9o n SER 46 Cb 0.39 -1.32 -0.00 0.00 -0.26 0.00 0.00 64.21 63.02 3i9o n SER 46 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3i9o n PHE 47 N -2.08 0.00 -4.30 7.33 3.72 0.62 -4.90 117.46 117.85 3i9o n PHE 47 Ca 0.13 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.28 3i9o n PHE 47 Cb 0.49 -1.61 -0.08 0.00 -0.94 0.00 0.00 39.48 37.33 3i9o n PHE 47 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3i9o s LYS 48 N -1.62 2.13 0.80 -1.08 1.02 -1.18 -4.23 119.74 115.59 3i9o s LYS 48 Ca 0.00 -1.70 -0.15 0.00 0.02 0.00 0.00 55.97 54.13 3i9o s LYS 48 Cb 0.00 -1.98 -0.04 0.00 -0.52 0.00 0.00 37.83 35.30 3i9o s LYS 48 CO 0.00 0.14 0.33 0.09 -0.92 0.00 0.00 175.35 174.99 3i9o n ASN 49 N -0.98 -2.06 -0.10 2.83 5.03 -1.26 -1.48 115.26 117.24 3i9o n ASN 49 Ca -0.04 0.48 -0.06 0.00 0.87 0.00 0.00 54.58 55.83 3i9o n ASN 49 Cb 0.62 -1.15 0.01 0.00 -1.02 0.00 0.00 39.78 38.25 3i9o n ASN 49 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 3i9o h PRO 50 N -0.74 0.12 -0.96 3.52 0.13 -1.90 -2.55 132.00 129.62 3i9o h PRO 50 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3i9o h PRO 50 Cb 1.33 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3i9o h PRO 50 CO 0.38 0.08 0.00 0.00 -0.23 0.00 0.00 178.00 178.23 3i9o n ASP 52 N 0.04 5.04 -4.54 0.00 -0.08 -0.96 -4.83 116.55 111.22 3i9o n ASP 52 Ca 0.02 -3.75 -0.30 0.00 -1.51 0.00 0.00 54.79 49.25 3i9o n ASP 52 Cb 0.32 -0.75 -0.11 0.00 2.34 0.00 0.00 41.12 42.92 3i9o n ASP 52 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3i9o s LEU 53 N -3.53 2.90 0.00 -2.67 1.43 -1.26 -4.93 118.68 110.62 3i9o s LEU 53 Ca 0.56 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 3i9o s LEU 53 Cb 0.46 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.97 3i9o s LEU 53 CO 0.03 0.20 0.00 -0.90 0.23 0.00 0.00 176.35 175.91 3i9o n ASP 54 N 0.93 1.53 0.00 2.29 5.68 -1.26 -2.31 116.55 123.41 3i9o n ASP 54 Ca -0.15 -0.94 0.10 0.00 -0.50 0.00 0.00 54.79 53.31 3i9o n ASP 54 Cb 0.52 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 40.98 3i9o n ASP 54 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3i9o n LEU 55 N 0.00 0.00 -0.17 -2.12 7.94 -1.25 -2.40 117.00 119.00 3i9o n LEU 55 Ca 0.00 0.38 0.11 0.00 -1.11 0.00 0.00 56.01 55.38 3i9o n LEU 55 Cb 0.00 -0.38 -0.04 0.00 0.53 0.00 0.00 43.42 43.54 3i9o n LEU 55 CO 0.00 -0.12 0.13 0.61 -1.11 0.00 0.00 177.39 176.90 3i9o n GLY 56 N 0.47 -0.67 0.22 -3.96 0.00 -1.26 -4.58 105.19 95.41 3i9o n GLY 56 Ca 0.08 -0.59 0.05 0.00 0.00 0.00 0.00 46.02 45.56 3i9o n GLY 56 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3i9o h SER 57 N 0.83 0.01 -0.36 1.61 0.02 -1.83 -0.81 113.55 113.03 3i9o h SER 57 Ca 0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3i9o h SER 57 Cb 0.58 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 3i9o h SER 57 CO 0.00 0.21 0.00 -1.22 -1.14 0.00 0.00 176.83 174.68 3i9o n TYR 58 N -4.30 1.21 -0.15 3.45 4.01 -1.26 -4.19 117.16 115.93 3i9o n TYR 58 Ca -0.02 -0.81 -0.05 0.00 -0.16 0.00 0.00 57.90 56.86 3i9o n TYR 58 Cb 0.26 -0.34 0.01 0.00 -0.31 0.00 0.00 39.34 38.96 3i9o n TYR 58 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3i9o h LYS 59 N 2.45 -0.16 -0.48 -0.72 3.64 -1.40 -1.58 116.57 118.31 3i9o h LYS 59 Ca 0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3i9o h LYS 59 Cb 1.53 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.36 3i9o h LYS 59 CO 0.27 -0.10 0.26 -0.44 -2.27 0.00 0.00 179.45 177.17 3i9o h ASP 60 N -0.16 0.61 0.45 4.20 3.32 -1.85 -0.18 116.42 122.80 3i9o h ASP 60 Ca 0.21 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 3i9o h ASP 60 Cb 0.50 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3i9o h ASP 60 CO -0.57 0.53 -0.46 0.15 -1.72 0.00 0.00 179.24 177.16 3i9o h PHE 61 N 0.64 -1.28 0.00 4.55 3.57 -1.74 0.10 116.94 122.78 3i9o h PHE 61 Ca 0.17 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3i9o h PHE 61 Cb 0.06 0.50 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3i9o h PHE 61 CO -0.02 -0.62 0.00 0.74 -2.23 0.00 0.00 178.31 176.18 3i9o h PHE 62 N -0.93 0.00 0.13 0.41 0.04 -1.09 0.14 116.94 115.65 3i9o h PHE 62 Ca -0.05 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 3i9o h PHE 62 Cb 0.82 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.97 3i9o h PHE 62 CO -0.25 0.00 -0.06 1.15 -0.60 0.00 0.00 178.31 178.55 3i9o h THR 63 N 0.00 1.02 -0.35 -1.55 2.02 0.41 -2.99 112.91 111.47 3i9o h THR 63 Ca 0.00 -1.11 -0.04 0.00 0.77 0.00 0.00 66.41 66.03 3i9o h THR 63 Cb 0.14 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 3i9o h THR 63 CO 0.00 0.24 0.04 0.28 0.37 0.00 0.00 175.52 176.45 3i9o h SER 64 N -0.74 0.49 -0.10 4.18 0.02 0.56 -3.21 113.55 114.75 3i9o h SER 64 Ca -0.02 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 3i9o h SER 64 Cb 0.53 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3i9o h SER 64 CO 0.03 0.53 0.00 0.00 -1.14 0.00 0.00 176.83 176.25 3i9o n ALA 65 N -2.48 2.52 -2.02 3.77 0.00 0.33 -4.44 120.51 118.19 3i9o n ALA 65 Ca 0.02 -0.58 -0.41 0.00 0.00 0.00 0.00 53.44 52.47 3i9o n ALA 65 Cb 0.22 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.59 3i9o n ALA 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3i9o s GLN 66 N -1.90 4.59 0.00 0.00 2.00 -1.13 -4.46 119.66 118.77 3i9o s GLN 66 Ca 0.34 1.74 0.08 0.00 -2.00 0.00 0.00 55.36 55.52 3i9o s GLN 66 Cb 0.20 -3.26 -0.02 0.00 0.80 0.00 0.00 33.01 30.72 3i9o s GLN 66 CO 0.31 0.08 -0.25 -0.65 -0.50 0.00 0.00 175.29 174.29 3i9o s GLN 67 N -0.50 2.04 0.42 1.67 -0.21 -1.26 -4.90 119.66 116.92 3i9o s GLN 67 Ca 0.49 -0.97 -0.26 0.00 0.02 0.00 0.00 55.36 54.63 3i9o s GLN 67 Cb -0.30 -2.06 -0.09 0.00 1.00 0.00 0.00 33.01 31.56 3i9o s GLN 67 CO 0.36 0.55 1.44 -1.14 -2.12 0.00 0.00 175.29 174.38 3i9o s GLN 68 N -0.88 3.86 -0.03 2.91 0.74 -1.26 -5.01 119.66 120.00 3i9o s GLN 68 Ca 0.11 2.46 0.03 0.00 0.05 0.00 0.00 55.36 58.01 3i9o s GLN 68 Cb -0.10 -2.78 -0.03 0.00 1.10 0.00 0.00 33.01 31.20 3i9o s GLN 68 CO 0.01 -0.69 -0.11 -0.51 -0.55 0.00 0.00 175.29 173.44 3i9o s LEU 69 N -2.46 2.93 0.10 3.68 1.43 -1.26 -4.39 118.68 118.71 3i9o s LEU 69 Ca 0.58 -0.17 -0.35 0.00 -1.03 0.00 0.00 54.13 53.16 3i9o s LEU 69 Cb -0.44 -1.65 -0.14 0.00 0.03 0.00 0.00 46.19 43.98 3i9o s LEU 69 CO 0.58 0.32 1.57 -0.81 0.23 0.00 0.00 176.35 178.24 3i9o n PRO 70 N 1.99 1.91 -1.49 1.29 -0.04 -1.26 -4.70 135.00 132.69 3i9o n PRO 70 Ca -0.17 0.69 -0.59 0.00 -0.04 0.00 0.00 63.50 63.40 3i9o n PRO 70 Cb 0.52 -2.44 -0.08 0.00 -0.04 0.00 0.00 33.50 31.47 3i9o n PRO 70 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3i9o n LYS 71 N 3.64 0.00 -1.04 0.54 4.81 -1.26 -2.03 118.16 122.82 3i9o n LYS 71 Ca 0.18 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.61 3i9o n LYS 71 Cb 0.26 -1.48 -0.01 0.00 0.02 0.00 0.00 35.03 33.82 3i9o n LYS 71 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3i9o n ASN 72 N 1.55 -5.91 -0.40 3.14 3.02 -0.61 -4.80 115.26 111.26 3i9o n ASN 72 Ca 0.20 0.04 0.05 0.00 -0.03 0.00 0.00 54.58 54.84 3i9o n ASN 72 Cb 0.08 -3.58 0.05 0.00 -0.61 0.00 0.00 39.78 35.72 3i9o n ASN 72 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3i9o n LYS 73 N 0.73 0.72 -2.50 3.52 5.02 -0.86 -4.73 118.16 120.05 3i9o n LYS 73 Ca -0.02 -1.20 -0.42 0.00 -2.02 0.00 0.00 58.31 54.65 3i9o n LYS 73 Cb 0.51 -1.18 -0.03 0.00 -0.02 0.00 0.00 35.03 34.31 3i9o n LYS 73 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3i9o s VAL 74 N -0.81 4.31 0.22 -0.18 1.01 -1.26 0.69 120.40 124.39 3i9o s VAL 74 Ca 0.12 1.65 0.09 0.00 0.00 0.00 0.00 61.98 63.85 3i9o s VAL 74 Cb 0.08 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3i9o s VAL 74 CO 0.12 0.07 -0.08 -0.32 0.00 0.00 0.00 175.10 174.89 3i9o s MET 75 N 1.54 2.08 0.19 2.72 0.00 0.29 -1.92 119.30 124.20 3i9o s MET 75 Ca 0.56 -1.38 0.02 0.00 0.00 0.00 0.00 55.69 54.89 3i9o s MET 75 Cb -0.25 -2.11 -0.05 0.00 0.00 0.00 0.00 34.83 32.42 3i9o s MET 75 CO 0.26 0.40 0.02 -0.06 0.00 0.00 0.00 175.02 175.64 3i9o s PHE 76 N -1.98 1.26 0.19 4.11 0.08 0.03 -4.54 117.98 117.13 3i9o s PHE 76 Ca 0.27 -1.06 -0.22 0.00 0.12 0.00 0.00 56.93 56.04 3i9o s PHE 76 Cb -0.08 -0.72 0.05 0.00 -0.57 0.00 0.00 43.02 41.71 3i9o s PHE 76 CO 0.16 -0.25 0.62 1.67 -0.10 0.00 0.00 175.22 177.33 3i9o s TRP 77 N -3.69 -0.41 -0.21 0.36 1.48 -1.26 -1.30 118.94 113.91 3i9o s TRP 77 Ca 0.27 0.11 -0.06 0.00 -1.06 0.00 0.00 56.10 55.36 3i9o s TRP 77 Cb 0.06 0.58 0.10 0.00 -1.16 0.00 0.00 33.47 33.06 3i9o s TRP 77 CO 0.06 -0.96 0.41 -1.12 -4.06 0.00 0.00 176.95 171.28 3i9o s SER 78 N -2.81 -0.16 -1.50 -2.66 0.01 -0.41 -4.72 113.70 101.45 3i9o s SER 78 Ca 0.04 0.84 0.00 0.00 1.31 0.00 0.00 55.95 58.14 3i9o s SER 78 Cb -0.02 1.30 0.00 0.00 0.21 0.00 0.00 66.02 67.51 3i9o s SER 78 CO -0.07 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 173.95 3i9o n GLY 79 N 5.39 1.12 2.66 3.44 0.00 -1.26 -3.51 105.19 113.02 3i9o n GLY 79 Ca -0.07 -0.31 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 3i9o n GLY 79 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3i9o n VAL 80 N -2.90 1.54 -0.13 1.61 0.24 -1.26 -4.75 118.33 112.68 3i9o n VAL 80 Ca -0.15 -3.22 -0.10 0.00 -2.04 0.00 0.00 64.34 58.82 3i9o n VAL 80 Cb 0.52 0.75 -0.05 0.00 -1.47 0.00 0.00 33.84 33.58 3i9o n VAL 80 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 3i9o h TYR 81 N 2.52 -1.33 -0.16 6.34 5.03 -1.98 -0.43 116.97 126.97 3i9o h TYR 81 Ca -0.03 0.07 0.01 0.00 2.58 0.00 0.00 58.73 61.37 3i9o h TYR 81 Cb 1.32 0.64 -0.01 0.00 1.55 0.00 0.00 36.73 40.23 3i9o h TYR 81 CO 0.58 -0.45 0.07 -0.44 -1.32 0.00 0.00 178.16 176.60 3i9o h ASP 82 N -0.33 0.10 -0.07 -2.11 3.32 -1.99 -1.36 116.42 113.98 3i9o h ASP 82 Ca 0.13 0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.99 3i9o h ASP 82 Cb 0.59 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.13 3i9o h ASP 82 CO -0.59 0.08 -0.69 -0.33 -1.72 0.00 0.00 179.24 176.00 3i9o h GLU 83 N 0.16 0.70 -0.55 3.56 3.07 -1.80 -0.95 114.58 118.76 3i9o h GLU 83 Ca 0.06 -0.52 -0.02 0.00 -0.50 0.00 0.00 59.36 58.38 3i9o h GLU 83 Cb 0.02 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 27.99 3i9o h GLU 83 CO -0.05 1.14 0.25 0.00 -1.40 0.00 0.00 179.01 178.95 3i9o h ALA 84 N 0.72 1.40 0.00 3.43 0.00 -0.96 -0.41 119.26 123.45 3i9o h ALA 84 Ca -0.03 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 3i9o h ALA 84 Cb 1.29 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3i9o h ALA 84 CO 0.14 0.47 -0.86 0.45 0.00 0.00 0.00 179.25 179.44 3i9o h HIS 85 N 0.78 0.00 -0.12 0.00 3.86 -0.85 -2.19 115.15 116.63 3i9o h HIS 85 Ca 0.19 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.36 3i9o h HIS 85 Cb 0.11 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.57 3i9o h HIS 85 CO 0.01 0.69 -0.10 -0.44 0.86 0.00 0.00 177.93 178.94 3i9o h ASP 86 N 0.00 0.30 -0.28 2.45 3.32 -0.83 -2.03 116.42 119.35 3i9o h ASP 86 Ca -0.05 -0.47 -0.07 0.00 0.02 0.00 0.00 57.03 56.47 3i9o h ASP 86 Cb 1.56 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 3i9o h ASP 86 CO 0.08 0.70 -0.04 0.22 -1.72 0.00 0.00 179.24 178.48 3i9o h TYR 87 N -0.10 0.68 -0.06 4.55 3.20 -1.12 -2.82 116.97 121.30 3i9o h TYR 87 Ca 0.02 -0.09 -0.11 0.00 3.14 0.00 0.00 58.73 61.69 3i9o h TYR 87 Cb 0.61 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 3i9o h TYR 87 CO 0.08 0.68 -0.47 0.00 -1.64 0.00 0.00 178.16 176.81 3i9o h ALA 88 N 1.36 1.11 -4.61 1.82 0.00 -1.28 -3.43 119.26 114.23 3i9o h ALA 88 Ca 0.12 -0.44 -0.22 0.00 0.00 0.00 0.00 54.91 54.37 3i9o h ALA 88 Cb 0.44 -0.08 0.12 0.00 0.00 0.00 0.00 17.79 18.27 3i9o h ALA 88 CO 0.02 0.62 -0.56 -1.71 0.00 0.00 0.00 179.25 177.62 3i9o n ASN 89 N -3.98 -2.87 -3.83 0.00 5.15 -0.77 -1.43 115.26 107.52 3i9o n ASN 89 Ca -0.02 -0.45 -0.37 0.00 -0.60 0.00 0.00 54.58 53.14 3i9o n ASN 89 Cb 0.51 -3.77 0.03 0.00 -0.53 0.00 0.00 39.78 36.02 3i9o n ASN 89 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 3i9o n THR 90 N -3.07 -4.65 0.00 -0.44 -1.04 -1.26 -1.70 114.28 102.12 3i9o n THR 90 Ca -0.16 -0.81 0.00 0.00 -2.04 0.00 0.00 64.05 61.04 3i9o n THR 90 Cb 0.61 -3.55 0.00 0.00 -1.82 0.00 0.00 70.33 65.57 3i9o n THR 90 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i9o n GLY 91 N -1.84 2.55 0.14 3.41 0.00 -1.18 -4.83 105.19 103.43 3i9o n GLY 91 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 3i9o n GLY 91 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i9o h ARG 92 N 0.88 -0.26 0.00 1.61 3.08 -1.37 -3.38 114.38 114.94 3i9o h ARG 92 Ca 0.00 0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 3i9o h ARG 92 Cb 0.00 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3i9o h ARG 92 CO 0.00 -0.09 -0.64 -0.22 -1.07 0.00 0.00 179.97 177.95 3i9o h LYS 93 N -0.37 0.00 -5.22 0.04 3.64 -1.44 -3.50 116.57 109.72 3i9o h LYS 93 Ca -0.03 0.00 -0.41 0.00 -1.27 0.00 0.00 60.65 58.94 3i9o h LYS 93 Cb 0.28 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 31.96 3i9o h LYS 93 CO 0.04 0.31 -0.66 0.71 -2.27 0.00 0.00 179.45 177.58 3i9o s TYR 94 N -2.20 1.68 -0.18 1.91 2.02 -0.72 -4.94 117.35 114.93 3i9o s TYR 94 Ca -0.17 -0.85 -0.12 0.00 -0.37 0.00 0.00 57.07 55.56 3i9o s TYR 94 Cb 0.03 -0.97 -0.05 0.00 -0.40 0.00 0.00 41.96 40.57 3i9o s TYR 94 CO 0.32 0.07 0.22 0.42 -1.57 0.00 0.00 175.55 175.00 3i9o s ILE 95 N -3.28 5.35 0.29 2.71 -1.09 0.22 -3.12 121.20 122.28 3i9o s ILE 95 Ca 0.28 0.38 0.08 0.00 -2.23 0.00 0.00 60.65 59.17 3i9o s ILE 95 Cb 0.05 -3.56 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 3i9o s ILE 95 CO 0.09 0.41 0.12 0.42 -1.23 0.00 0.00 174.94 174.75 3i9o s THR 96 N 0.42 3.58 0.37 2.92 -4.23 -1.26 -0.54 115.64 116.90 3i9o s THR 96 Ca 0.13 -1.67 0.11 0.00 -1.18 0.00 0.00 61.69 59.08 3i9o s THR 96 Cb -0.12 -3.05 0.34 0.00 1.34 0.00 0.00 72.50 71.00 3i9o s THR 96 CO 0.01 -0.30 1.86 0.25 -0.54 0.00 0.00 174.62 175.91 3i9o h LEU 97 N 1.63 0.58 0.00 4.79 5.85 -1.98 -0.98 115.31 125.21 3i9o h LEU 97 Ca -0.45 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.31 3i9o h LEU 97 Cb 1.25 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3i9o h LEU 97 CO 0.61 0.27 0.00 -0.62 -0.34 0.00 0.00 178.44 178.36 3i9o n GLU 98 N -4.56 0.02 -0.00 1.25 4.71 -1.26 -1.58 120.64 119.21 3i9o n GLU 98 Ca 0.18 0.20 0.08 0.00 -0.01 0.00 0.00 57.16 57.61 3i9o n GLU 98 Cb 0.54 -1.50 -0.11 0.00 -1.01 0.00 0.00 31.44 29.35 3i9o n GLU 98 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3i9o n ASP 99 N -1.20 0.98 -4.86 1.62 8.00 -0.37 -3.52 116.55 117.20 3i9o n ASP 99 Ca 0.00 -0.42 -0.32 0.00 0.71 0.00 0.00 54.79 54.77 3i9o n ASP 99 Cb 0.01 1.41 -0.05 0.00 -0.02 0.00 0.00 41.12 42.46 3i9o n ASP 99 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3i9o s THR 100 N -2.87 4.70 0.14 -3.53 -4.23 -0.62 -4.80 115.64 104.44 3i9o s THR 100 Ca -0.00 0.87 -0.20 0.00 -1.18 0.00 0.00 61.69 61.18 3i9o s THR 100 Cb 0.11 -3.64 0.04 0.00 1.34 0.00 0.00 72.50 70.35 3i9o s THR 100 CO 0.68 -0.29 1.19 -0.11 -0.54 0.00 0.00 174.62 175.56 3i9o n LEU 101 N -0.65 -0.69 -0.04 4.79 7.94 -1.26 -0.30 117.00 126.79 3i9o n LEU 101 Ca 0.03 1.36 -0.06 0.00 -1.11 0.00 0.00 56.01 56.23 3i9o n LEU 101 Cb 0.53 -0.23 0.13 0.00 0.53 0.00 0.00 43.42 44.39 3i9o n LEU 101 CO 0.43 -1.15 0.70 1.55 -1.11 0.00 0.00 177.39 177.81 3i9o h PRO 102 N 0.00 0.65 -0.43 1.96 0.13 -1.89 -0.11 132.00 132.31 3i9o h PRO 102 Ca 0.18 -0.26 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 3i9o h PRO 102 Cb 0.37 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.46 3i9o h PRO 102 CO -0.74 0.84 -0.16 0.78 -0.23 0.00 0.00 178.00 178.49 3i9o h GLY 103 N 1.00 0.89 0.87 1.56 0.00 -1.19 -2.57 103.07 103.62 3i9o h GLY 103 Ca 0.08 -0.72 -0.10 0.00 0.00 0.00 0.00 47.33 46.58 3i9o h GLY 103 CO 0.06 0.66 -0.28 -1.82 0.00 0.00 0.00 176.54 175.16 3i9o h TYR 104 N 0.73 0.67 -0.57 5.60 5.03 -0.24 -1.49 116.97 126.69 3i9o h TYR 104 Ca 0.11 -0.22 -0.01 0.00 2.58 0.00 0.00 58.73 61.19 3i9o h TYR 104 Cb 0.67 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.79 3i9o h TYR 104 CO 0.04 0.93 0.30 0.52 -1.32 0.00 0.00 178.16 178.62 3i9o h MET 105 N 0.21 0.80 0.00 1.82 2.86 -1.03 -3.30 114.93 116.29 3i9o h MET 105 Ca 0.02 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3i9o h MET 105 Cb 0.85 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.36 3i9o h MET 105 CO 0.07 0.63 -0.89 1.28 1.06 0.00 0.00 176.91 179.05 3i9o n LEU 106 N -4.58 0.85 -4.52 1.22 7.99 -0.97 -4.88 117.00 112.11 3i9o n LEU 106 Ca 0.03 -0.35 -0.55 0.00 -0.01 0.00 0.00 56.01 55.13 3i9o n LEU 106 Cb 0.10 -0.07 -0.08 0.00 -0.11 0.00 0.00 43.42 43.26 3i9o n LEU 106 CO 0.37 0.21 1.61 -3.20 -1.51 0.00 0.00 177.39 174.87 3i9o n ASN 107 N -1.52 2.06 0.00 -1.43 5.15 -0.57 -1.72 115.26 117.23 3i9o n ASN 107 Ca 0.04 0.71 0.00 0.00 -0.60 0.00 0.00 54.58 54.73 3i9o n ASN 107 Cb 0.34 -1.17 0.00 0.00 -0.53 0.00 0.00 39.78 38.42 3i9o n ASN 107 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3i9o n SER 108 N 7.81 0.00 -4.84 1.20 7.64 -1.26 -5.01 113.62 119.16 3i9o n SER 108 Ca 0.37 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.93 3i9o n SER 108 Cb 0.15 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.30 3i9o n SER 108 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3i9o s LEU 109 N 0.00 3.97 -0.15 -3.43 1.43 -0.70 -5.04 118.68 114.77 3i9o s LEU 109 Ca 0.00 1.41 0.01 0.00 -1.03 0.00 0.00 54.13 54.52 3i9o s LEU 109 Cb 0.00 -4.24 0.00 0.00 0.03 0.00 0.00 46.19 41.98 3i9o s LEU 109 CO 0.00 -0.30 -0.18 -0.69 0.23 0.00 0.00 176.35 175.41 3i9o s VAL 110 N -2.13 2.40 0.13 -1.59 1.01 -1.26 -4.99 120.40 113.98 3i9o s VAL 110 Ca 0.57 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.60 3i9o s VAL 110 Cb -0.10 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 3i9o s VAL 110 CO 0.18 0.53 0.24 -1.66 0.00 0.00 0.00 175.10 174.39 3i9o s TRP 111 N 0.80 0.32 0.11 5.22 -2.14 -1.26 -0.49 118.94 121.50 3i9o s TRP 111 Ca -0.06 -0.71 -0.25 0.00 2.66 0.00 0.00 56.10 57.73 3i9o s TRP 111 Cb -0.15 -0.07 0.08 0.00 -3.10 0.00 0.00 33.47 30.22 3i9o s TRP 111 CO -0.01 -0.65 0.80 0.00 -2.66 0.00 0.00 176.95 174.44 3i9o s GLY 113 N -2.70 1.60 0.07 0.00 0.00 -1.26 -1.97 107.32 103.06 3i9o s GLY 113 Ca 0.06 -0.37 -0.07 0.00 0.00 0.00 0.00 44.72 44.33 3i9o s GLY 113 CO -0.06 -0.10 0.15 -0.86 0.00 0.00 0.00 173.10 172.23 3i9o s GLN 114 N -5.08 0.78 0.02 2.90 -2.07 -0.12 -3.10 119.66 112.98 3i9o s GLN 114 Ca 0.54 -0.95 -0.10 0.00 -1.82 0.00 0.00 55.36 53.03 3i9o s GLN 114 Cb -0.11 0.31 -0.31 0.00 -1.09 0.00 0.00 33.01 31.81 3i9o s GLN 114 CO 0.49 -0.23 0.93 0.00 -1.32 0.00 0.00 175.29 175.16 3i9o h ARG 115 N 2.94 0.39 -6.83 9.60 3.08 -1.73 -2.37 114.38 119.46 3i9o h ARG 115 Ca -0.34 -0.67 -0.50 0.00 0.07 0.00 0.00 59.98 58.54 3i9o h ARG 115 Cb 1.19 0.25 0.02 0.00 0.08 0.00 0.00 29.97 31.50 3i9o h ARG 115 CO 0.57 1.30 0.46 0.00 -1.07 0.00 0.00 179.97 181.23 3i9o s ALA 116 N -2.61 3.36 0.18 0.04 0.00 -1.26 -4.61 121.76 116.86 3i9o s ALA 116 Ca -0.09 0.87 -0.27 0.00 0.00 0.00 0.00 51.96 52.47 3i9o s ALA 116 Cb 0.06 -3.32 -0.16 0.00 0.00 0.00 0.00 23.12 19.70 3i9o s ALA 116 CO 0.89 -0.16 0.50 0.09 0.00 0.00 0.00 175.76 177.08 3i9o n ASN 117 N 1.01 -1.15 -0.42 0.00 3.02 -1.26 -1.90 115.26 114.56 3i9o n ASN 117 Ca -0.00 1.06 0.02 0.00 -0.03 0.00 0.00 54.58 55.63 3i9o n ASN 117 Cb 0.45 -0.89 0.07 0.00 -0.61 0.00 0.00 39.78 38.80 3i9o n ASN 117 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3i9o n PRO 118 N 0.95 1.46 0.00 3.52 -0.04 -1.26 -4.85 135.00 134.79 3i9o n PRO 118 Ca 0.17 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 63.10 3i9o n PRO 118 Cb 0.23 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 3i9o n PRO 118 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i9o n GLY 119 N 0.52 0.88 3.28 0.55 0.00 -0.80 -4.84 105.19 104.78 3i9o n GLY 119 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 3i9o n GLY 119 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i9o s PHE 120 N -2.25 0.39 -0.27 1.61 -0.71 -1.26 -0.28 117.98 115.21 3i9o s PHE 120 Ca 0.00 -0.77 -0.07 0.00 -1.04 0.00 0.00 56.93 55.05 3i9o s PHE 120 Cb 0.00 -0.11 -0.01 0.00 -1.21 0.00 0.00 43.02 41.70 3i9o s PHE 120 CO 0.00 -0.65 0.07 1.21 -1.34 0.00 0.00 175.22 174.51 3i9o s ASN 121 N -2.95 5.06 0.00 1.98 3.84 -0.83 -4.68 114.94 117.37 3i9o s ASN 121 Ca 0.15 -0.47 0.25 0.00 0.21 0.00 0.00 52.86 52.99 3i9o s ASN 121 Cb 0.04 -1.89 0.37 0.00 -0.55 0.00 0.00 41.25 39.22 3i9o s ASN 121 CO -0.03 -0.11 1.33 -0.62 -2.79 0.00 0.00 177.10 174.88 3i9o n GLU 122 N 4.89 1.29 -0.10 0.43 1.02 -1.26 -4.31 120.64 122.60 3i9o n GLU 122 Ca -0.16 -0.96 -0.18 0.00 -0.02 0.00 0.00 57.16 55.84 3i9o n GLU 122 Cb 0.50 -1.48 -0.09 0.00 -0.02 0.00 0.00 31.44 30.35 3i9o n GLU 122 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3i9o n LYS 123 N -0.02 0.54 -3.76 3.49 5.02 -1.26 -4.61 118.16 117.56 3i9o n LYS 123 Ca 0.12 0.54 -0.13 0.00 -2.02 0.00 0.00 58.31 56.82 3i9o n LYS 123 Cb 0.44 -1.71 -0.08 0.00 -0.02 0.00 0.00 35.03 33.65 3i9o n LYS 123 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3i9o s VAL 124 N -2.36 0.06 0.01 -0.18 0.11 -1.26 -4.22 120.40 112.57 3i9o s VAL 124 Ca -0.26 -0.52 0.06 0.00 -2.93 0.00 0.00 61.98 58.33 3i9o s VAL 124 Cb 0.06 -0.67 -0.02 0.00 -1.53 0.00 0.00 36.38 34.22 3i9o s VAL 124 CO 0.49 -0.28 -0.19 0.00 -3.33 0.00 0.00 175.10 171.79 3i9o s PRO 126 N -0.76 1.26 0.38 0.00 0.04 -1.26 -4.21 135.00 130.44 3i9o s PRO 126 Ca 0.07 1.24 0.14 0.00 0.04 0.00 0.00 61.00 62.49 3i9o s PRO 126 Cb -0.08 -1.78 0.98 0.00 0.04 0.00 0.00 34.50 33.67 3i9o s PRO 126 CO 0.00 -2.36 1.81 -0.44 0.04 0.00 0.00 177.00 176.04 3i9o h ASP 127 N -1.66 0.54 0.00 6.66 5.19 -1.97 -3.45 116.42 121.72 3i9o h ASP 127 Ca -0.46 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 3i9o h ASP 127 Cb 1.27 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.75 3i9o h ASP 127 CO 0.48 0.18 0.00 0.49 -3.12 0.00 0.00 179.24 177.26 3i9o n PHE 128 N -4.62 0.00 1.04 4.55 0.99 -1.26 -4.62 117.46 113.54 3i9o n PHE 128 Ca 0.22 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.70 3i9o n PHE 128 Cb 0.71 0.00 0.16 0.00 -1.00 0.00 0.00 39.48 39.36 3i9o n PHE 128 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.76 177.12 3i9o n LYS 129 N 0.00 0.52 0.00 -1.08 2.85 -1.26 -1.07 118.16 118.12 3i9o n LYS 129 Ca 0.00 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.37 3i9o n LYS 129 Cb 0.00 -1.16 0.02 0.00 -0.65 0.00 0.00 35.03 33.24 3i9o n LYS 129 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 3i9o n THR 130 N -0.66 0.00 -3.46 0.58 5.66 -1.26 -5.00 114.28 110.14 3i9o n THR 130 Ca 0.04 -0.19 -0.26 0.00 -3.05 0.00 0.00 64.05 60.59 3i9o n THR 130 Cb 0.02 1.09 -0.02 0.00 -1.55 0.00 0.00 70.33 69.86 3i9o n THR 130 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3i9o n PRO 132 N -1.19 0.17 -0.13 0.00 -0.02 -1.26 -4.63 135.00 127.93 3i9o n PRO 132 Ca -0.04 0.10 -0.05 0.00 -2.02 0.00 0.00 63.50 61.48 3i9o n PRO 132 Cb 0.55 -1.75 0.03 0.00 -0.02 0.00 0.00 33.50 32.31 3i9o n PRO 132 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3i9o h VAL 133 N -0.59 0.90 -0.36 -1.45 3.04 -1.97 -1.75 116.25 114.07 3i9o h VAL 133 Ca -0.45 -0.12 0.04 0.00 -1.01 0.00 0.00 66.70 65.16 3i9o h VAL 133 Cb 1.34 0.53 -0.02 0.00 -2.01 0.00 0.00 31.29 31.13 3i9o h VAL 133 CO 0.40 0.06 0.24 0.06 -1.01 0.00 0.00 177.57 177.33 3i9o h GLN 134 N 0.34 0.31 0.10 4.17 -0.00 -1.90 -0.72 115.11 117.42 3i9o h GLN 134 Ca 0.19 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.65 58.82 3i9o h GLN 134 Cb 0.15 -0.07 0.00 0.00 -0.00 0.00 0.00 27.48 27.56 3i9o h GLN 134 CO -0.18 0.21 -0.05 0.00 -0.00 0.00 0.00 178.83 178.82 3i9o h ALA 135 N 1.80 -0.48 -0.36 0.06 0.00 -1.15 -0.90 119.26 118.23 3i9o h ALA 135 Ca 0.15 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.16 3i9o h ALA 135 Cb 0.20 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 3i9o h ALA 135 CO -0.03 -0.47 0.12 0.54 0.00 0.00 0.00 179.25 179.41 3i9o n ARG 136 N -2.69 -0.02 0.00 0.00 1.74 -0.69 0.36 116.66 115.35 3i9o n ARG 136 Ca -0.02 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 3i9o n ARG 136 Cb 0.05 -0.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 3i9o n ARG 136 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3i9o n GLU 137 N -4.00 2.43 -0.24 5.56 1.02 -0.31 -4.72 120.64 120.39 3i9o n GLU 137 Ca 0.12 -1.35 -0.06 0.00 -0.02 0.00 0.00 57.16 55.84 3i9o n GLU 137 Cb 0.39 -0.99 -0.06 0.00 -0.02 0.00 0.00 31.44 30.76 3i9o n GLU 137 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3i9o n SER 138 N -0.43 -0.59 0.07 1.62 2.88 0.16 -1.41 113.62 115.92 3i9o n SER 138 Ca 0.00 1.20 -0.06 0.00 -1.33 0.00 0.00 58.87 58.67 3i9o n SER 138 Cb 0.22 -0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 3i9o n SER 138 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 3i9o h PHE 139 N 0.00 -0.26 -0.06 0.66 3.57 -1.85 -3.10 116.94 115.91 3i9o h PHE 139 Ca 0.09 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.46 3i9o h PHE 139 Cb 0.23 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 3i9o h PHE 139 CO -0.76 -0.04 -0.54 -1.49 -2.23 0.00 0.00 178.31 173.24 3i9o h TRP 140 N -1.04 0.22 0.27 0.41 4.06 -1.89 0.31 115.95 118.29 3i9o h TRP 140 Ca -0.03 -0.08 -0.01 0.00 2.06 0.00 0.00 58.89 60.84 3i9o h TRP 140 Cb 0.33 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.44 3i9o h TRP 140 CO 0.03 0.68 -0.19 0.78 -3.56 0.00 0.00 178.44 176.18 3i9o h GLY 141 N 1.46 -0.47 1.43 1.49 0.00 -1.40 0.65 103.07 106.23 3i9o h GLY 141 Ca 0.00 0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 3i9o h GLY 141 CO 0.08 -0.19 0.22 1.98 0.00 0.00 0.00 176.54 178.63 3i9o h MET 142 N -0.46 0.74 -0.33 4.80 1.85 -1.45 -1.12 114.93 118.95 3i9o h MET 142 Ca -0.02 -0.10 0.03 0.00 -0.61 0.00 0.00 59.70 59.00 3i9o h MET 142 Cb 0.40 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 32.26 3i9o h MET 142 CO 0.01 0.60 0.15 0.00 -0.40 0.00 0.00 176.91 177.27 3i9o h ALA 143 N 1.51 0.40 -0.21 0.39 0.00 -0.58 -1.79 119.26 118.98 3i9o h ALA 143 Ca 0.18 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3i9o h ALA 143 Cb 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3i9o h ALA 143 CO -0.02 -0.23 -0.30 0.77 0.00 0.00 0.00 179.25 179.47 3i9o h SER 144 N 0.32 0.44 -0.05 0.00 0.02 -0.15 -1.56 113.55 112.56 3i9o h SER 144 Ca 0.14 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 3i9o h SER 144 Cb 0.07 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3i9o h SER 144 CO -0.11 0.72 0.03 0.28 -1.14 0.00 0.00 176.83 176.61 3i9o h SER 145 N 0.37 0.06 -0.60 3.07 0.02 -0.95 0.17 113.55 115.70 3i9o h SER 145 Ca 0.05 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 3i9o h SER 145 Cb 0.72 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 3i9o h SER 145 CO 0.05 0.12 0.21 -1.28 -1.14 0.00 0.00 176.83 174.79 3i9o h SER 146 N -0.00 0.85 0.81 3.07 0.87 -1.16 0.22 113.55 118.21 3i9o h SER 146 Ca 0.02 -0.19 -0.04 0.00 -1.23 0.00 0.00 61.79 60.34 3i9o h SER 146 Cb 0.07 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3i9o h SER 146 CO -0.00 0.82 -0.39 0.22 -0.53 0.00 0.00 176.83 176.95 3i9o h TYR 147 N 0.84 -1.01 -0.49 2.24 3.20 -1.19 -2.14 116.97 118.42 3i9o h TYR 147 Ca 0.20 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.05 3i9o h TYR 147 Cb 0.26 0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 3i9o h TYR 147 CO 0.02 -0.62 0.33 0.00 -1.64 0.00 0.00 178.16 176.24 3i9o h ALA 148 N -0.95 1.65 -0.27 1.82 0.00 -0.38 -1.86 119.26 119.27 3i9o h ALA 148 Ca -0.11 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 3i9o h ALA 148 Cb 0.84 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3i9o h ALA 148 CO 0.18 0.32 -0.33 1.25 0.00 0.00 0.00 179.25 180.68 3i9o h HIS 149 N 0.66 0.68 -0.27 0.00 -0.00 -0.81 -2.30 115.15 113.11 3i9o h HIS 149 Ca 0.18 -0.17 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 3i9o h HIS 149 Cb -0.07 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.18 3i9o h HIS 149 CO -0.00 0.84 0.00 0.43 -0.00 0.00 0.00 177.93 179.20 3i9o n SER 150 N -4.07 2.24 -4.75 3.26 7.64 -0.71 -4.60 113.62 112.64 3i9o n SER 150 Ca -0.01 -2.18 -0.40 0.00 1.01 0.00 0.00 58.87 57.29 3i9o n SER 150 Cb 0.47 -0.38 -0.06 0.00 -1.01 0.00 0.00 64.21 63.23 3i9o n SER 150 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i9o s ALA 151 N -1.65 3.33 0.06 -0.43 0.00 -0.86 -4.21 121.76 118.00 3i9o s ALA 151 Ca 0.21 0.60 0.06 0.00 0.00 0.00 0.00 51.96 52.84 3i9o s ALA 151 Cb 0.14 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 3i9o s ALA 151 CO 0.10 0.19 -0.17 -1.21 0.00 0.00 0.00 175.76 174.67 3i9o s GLU 152 N -1.04 1.02 3.88 0.00 2.02 -1.26 -4.41 118.70 118.91 3i9o s GLU 152 Ca 0.41 -0.93 0.00 0.00 0.02 0.00 0.00 54.97 54.47 3i9o s GLU 152 Cb -0.26 -1.11 0.00 0.00 0.10 0.00 0.00 34.13 32.87 3i9o s GLU 152 CO 0.31 0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.27 3i9o n GLY 153 N 1.54 0.48 3.83 -1.39 0.00 -0.09 -1.58 105.19 107.97 3i9o n GLY 153 Ca -0.19 -0.97 -0.37 0.00 0.00 0.00 0.00 46.02 44.49 3i9o n GLY 153 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i9o s GLU 154 N 0.00 4.11 0.15 1.61 2.02 -1.26 0.26 118.70 125.59 3i9o s GLU 154 Ca 0.00 0.65 0.08 0.00 0.02 0.00 0.00 54.97 55.72 3i9o s GLU 154 Cb 0.00 -3.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.16 3i9o s GLU 154 CO 0.00 0.52 -0.18 0.14 0.02 0.00 0.00 175.26 175.76 3i9o s VAL 155 N -1.35 1.76 0.04 2.63 -7.23 -0.64 -3.54 120.40 112.07 3i9o s VAL 155 Ca 0.36 -1.83 0.08 0.00 -1.81 0.00 0.00 61.98 58.77 3i9o s VAL 155 Cb -0.17 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 34.98 3i9o s VAL 155 CO 0.19 -0.28 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.60 3i9o s THR 156 N -1.90 1.74 -0.07 5.32 2.01 -0.81 -0.49 115.64 121.44 3i9o s THR 156 Ca 0.13 -1.23 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 3i9o s THR 156 Cb -0.06 -1.51 0.02 0.00 0.01 0.00 0.00 72.50 70.96 3i9o s THR 156 CO 0.06 0.23 -0.04 -0.47 -0.69 0.00 0.00 174.62 173.70 3i9o s TYR 157 N -0.80 0.98 -0.15 4.92 5.04 0.05 -0.79 117.35 126.59 3i9o s TYR 157 Ca 0.08 -0.37 -0.05 0.00 -2.44 0.00 0.00 57.07 54.30 3i9o s TYR 157 Cb -0.09 -0.90 -0.03 0.00 0.35 0.00 0.00 41.96 41.28 3i9o s TYR 157 CO 0.02 -0.33 -0.00 1.41 -1.34 0.00 0.00 175.55 175.30 3i9o s MET 158 N 1.48 3.67 0.32 4.97 -2.45 -0.42 -0.47 119.30 126.39 3i9o s MET 158 Ca -0.01 -0.45 0.04 0.00 -1.25 0.00 0.00 55.69 54.01 3i9o s MET 158 Cb -0.13 -2.99 -0.06 0.00 1.25 0.00 0.00 34.83 32.90 3i9o s MET 158 CO -0.04 0.32 0.06 0.14 1.05 0.00 0.00 175.02 176.55 3i9o s VAL 159 N 0.18 1.14 -0.30 10.11 -7.23 -0.17 -1.29 120.40 122.84 3i9o s VAL 159 Ca 0.00 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.12 3i9o s VAL 159 Cb -0.13 -2.77 0.03 0.00 0.56 0.00 0.00 36.38 34.06 3i9o s VAL 159 CO 0.02 -0.01 0.05 -0.62 -0.31 0.00 0.00 175.10 174.23 3i9o s ASP 160 N -3.47 5.02 -0.14 4.85 2.15 -1.23 -1.02 116.67 122.84 3i9o s ASP 160 Ca 0.36 -0.93 0.17 0.00 0.43 0.00 0.00 52.55 52.59 3i9o s ASP 160 Cb 0.09 -1.82 0.73 0.00 -0.30 0.00 0.00 42.92 41.62 3i9o s ASP 160 CO 0.15 -0.23 1.65 0.61 -0.17 0.00 0.00 175.17 177.18 3i9o n GLY 161 N 4.79 2.85 0.79 2.66 0.00 -0.44 -4.16 105.19 111.67 3i9o n GLY 161 Ca -0.14 -0.87 0.02 0.00 0.00 0.00 0.00 46.02 45.03 3i9o n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3i9o n SER 162 N 0.98 2.15 -4.01 1.61 7.64 -1.26 -1.20 113.62 119.53 3i9o n SER 162 Ca 0.26 -3.89 -0.31 0.00 1.01 0.00 0.00 58.87 55.94 3i9o n SER 162 Cb 0.95 -0.50 -0.15 0.00 -1.01 0.00 0.00 64.21 63.49 3i9o n SER 162 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3i9o s ASN 163 N -3.29 4.24 0.20 6.43 3.84 -1.26 -4.91 114.94 120.20 3i9o s ASN 163 Ca 0.40 -1.40 -0.10 0.00 0.21 0.00 0.00 52.86 51.97 3i9o s ASN 163 Cb 0.38 -1.40 0.24 0.00 -0.55 0.00 0.00 41.25 39.92 3i9o s ASN 163 CO -0.06 -0.23 1.77 1.55 -2.79 0.00 0.00 177.10 177.35 3i9o h PRO 164 N 7.83 0.51 0.00 0.43 0.13 -1.95 -3.14 132.00 135.81 3i9o h PRO 164 Ca -0.17 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3i9o h PRO 164 Cb 1.05 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3i9o h PRO 164 CO 0.45 0.34 -0.00 0.87 -0.23 0.00 0.00 178.00 179.43 3i9o h LYS 165 N 0.53 -0.00 -4.71 0.86 1.57 -2.03 -3.43 116.57 109.36 3i9o h LYS 165 Ca 0.29 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.39 3i9o h LYS 165 Cb 0.27 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.38 3i9o h LYS 165 CO -0.23 0.68 -0.50 0.08 -0.57 0.00 0.00 179.45 178.91 3i9o s VAL 166 N -3.46 5.07 0.73 0.50 1.01 -1.19 -5.08 120.40 117.99 3i9o s VAL 166 Ca -0.17 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.34 3i9o s VAL 166 Cb -0.00 -3.62 0.04 0.00 0.00 0.00 0.00 36.38 32.79 3i9o s VAL 166 CO 0.68 -0.02 1.14 -2.84 0.00 0.00 0.00 175.10 174.06 3i9o s PRO 167 N 1.68 2.28 0.20 2.72 0.02 -1.26 -4.43 135.00 136.21 3i9o s PRO 167 Ca 0.05 1.49 -0.11 0.00 0.02 0.00 0.00 61.00 62.45 3i9o s PRO 167 Cb -0.17 -1.88 0.26 0.00 0.02 0.00 0.00 34.50 32.73 3i9o s PRO 167 CO 0.09 -1.67 1.72 0.00 -0.33 0.00 0.00 177.00 176.81 3i9o h ALA 168 N -0.51 0.70 -4.27 -1.55 0.00 -1.89 -3.40 119.26 108.34 3i9o h ALA 168 Ca -0.46 0.10 -0.63 0.00 0.00 0.00 0.00 54.91 53.92 3i9o h ALA 168 Cb 1.26 0.11 -0.30 0.00 0.00 0.00 0.00 17.79 18.86 3i9o h ALA 168 CO 0.51 -0.26 -0.86 -0.47 0.00 0.00 0.00 179.25 178.16 3i9o s TYR 169 N -6.11 2.04 -0.07 0.00 5.04 -1.26 -4.69 117.35 112.31 3i9o s TYR 169 Ca -0.13 -0.48 -0.04 0.00 -2.44 0.00 0.00 57.07 53.98 3i9o s TYR 169 Cb 0.17 -1.33 0.03 0.00 0.35 0.00 0.00 41.96 41.18 3i9o s TYR 169 CO 0.74 -0.10 0.16 1.03 -1.34 0.00 0.00 175.55 176.04 3i9o s ARG 170 N -0.34 0.14 0.00 4.97 0.52 -1.26 -4.81 118.95 118.17 3i9o s ARG 170 Ca 0.04 0.34 0.23 0.00 -0.52 0.00 0.00 55.73 55.81 3i9o s ARG 170 Cb -0.10 -0.07 1.21 0.00 0.52 0.00 0.00 34.95 36.50 3i9o s ARG 170 CO 0.01 -0.11 1.75 -2.30 0.02 0.00 0.00 175.30 174.67 3i9o n PRO 171 N 3.76 0.41 -0.27 3.54 -0.02 -1.26 -2.33 135.00 138.83 3i9o n PRO 171 Ca -0.21 0.06 0.07 0.00 -2.02 0.00 0.00 63.50 61.39 3i9o n PRO 171 Cb 0.55 -1.50 0.19 0.00 -0.02 0.00 0.00 33.50 32.71 3i9o n PRO 171 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3i9o n ASP 172 N -1.22 3.22 -4.78 2.55 5.75 -1.26 -3.29 116.55 117.51 3i9o n ASP 172 Ca 0.12 -2.54 -0.31 0.00 -0.01 0.00 0.00 54.79 52.05 3i9o n ASP 172 Cb 0.16 -0.37 0.09 0.00 -1.03 0.00 0.00 41.12 39.97 3i9o n ASP 172 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3i9o s SER 173 N -1.57 4.57 0.24 -1.12 1.04 -0.98 -4.76 113.70 111.11 3i9o s SER 173 Ca 0.30 1.61 -0.04 0.00 0.48 0.00 0.00 55.95 58.30 3i9o s SER 173 Cb 0.22 -2.37 0.41 0.00 0.10 0.00 0.00 66.02 64.39 3i9o s SER 173 CO 0.10 -1.96 1.78 -0.26 0.98 0.00 0.00 173.24 173.88 3i9o h PHE 174 N -1.08 0.72 -0.32 5.02 -1.00 -1.92 0.39 116.94 118.75 3i9o h PHE 174 Ca -0.45 0.03 0.07 0.00 2.81 0.00 0.00 57.97 60.43 3i9o h PHE 174 Cb 1.24 -0.21 -0.08 0.00 3.61 0.00 0.00 35.95 40.51 3i9o h PHE 174 CO 0.54 0.24 -0.32 0.35 -1.61 0.00 0.00 178.31 177.51 3i9o h PHE 175 N 0.65 -0.88 0.00 -0.55 3.57 -1.91 0.20 116.94 118.02 3i9o h PHE 175 Ca 0.40 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.95 3i9o h PHE 175 Cb 0.46 0.44 0.00 0.00 2.79 0.00 0.00 35.95 39.64 3i9o h PHE 175 CO -0.09 -0.38 0.00 0.78 -2.23 0.00 0.00 178.31 176.38 3i9o h GLY 176 N -0.29 0.00 0.08 2.40 0.00 -1.41 0.38 103.07 104.23 3i9o h GLY 176 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.17 3i9o h GLY 176 CO -0.48 0.00 -1.71 0.28 0.00 0.00 0.00 176.54 174.63 3i9o n LYS 177 N -2.86 0.60 -0.00 4.80 5.02 0.13 -4.58 118.16 121.27 3i9o n LYS 177 Ca 0.03 0.45 -0.00 0.00 -2.02 0.00 0.00 58.31 56.77 3i9o n LYS 177 Cb 0.44 -1.67 -0.00 0.00 -0.02 0.00 0.00 35.03 33.77 3i9o n LYS 177 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3i9o n TYR 178 N -4.22 0.00 -0.01 2.13 4.01 -0.01 -4.82 117.16 114.23 3i9o n TYR 178 Ca -0.38 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.36 3i9o n TYR 178 Cb 0.79 -0.02 -0.00 0.00 -0.31 0.00 0.00 39.34 39.80 3i9o n TYR 178 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 3i9o h GLU 179 N 0.00 0.00 0.07 -0.72 5.08 -0.47 -3.37 114.58 115.18 3i9o h GLU 179 Ca -0.01 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3i9o h GLU 179 Cb 0.86 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.06 3i9o h GLU 179 CO 0.00 0.00 -0.38 1.25 -1.00 0.00 0.00 179.01 178.88 3i9o h LEU 180 N -0.27 -1.13 0.00 1.33 5.85 -0.60 -1.69 115.31 118.81 3i9o h LEU 180 Ca 0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3i9o h LEU 180 Cb 0.03 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3i9o h LEU 180 CO 0.00 -0.45 0.00 -0.81 -0.34 0.00 0.00 178.44 176.84 3i9o n PRO 181 N -5.44 0.07 -0.00 5.25 -0.04 -1.26 -2.48 135.00 131.09 3i9o n PRO 181 Ca -0.06 0.14 0.07 0.00 -0.04 0.00 0.00 63.50 63.60 3i9o n PRO 181 Cb 0.36 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.24 3i9o n PRO 181 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3i9o n ASN 182 N -1.15 0.91 -4.64 3.54 3.02 -0.64 -4.98 115.26 111.31 3i9o n ASN 182 Ca 0.02 -0.63 -0.45 0.00 -0.03 0.00 0.00 54.58 53.49 3i9o n ASN 182 Cb 0.02 1.15 -0.02 0.00 -0.61 0.00 0.00 39.78 40.31 3i9o n ASN 182 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3i9o n LEU 183 N -1.47 2.67 -4.97 3.41 4.77 -1.03 -4.18 117.00 116.20 3i9o n LEU 183 Ca 0.01 1.16 -0.21 0.00 -0.03 0.00 0.00 56.01 56.94 3i9o n LEU 183 Cb 0.25 -1.37 0.02 0.00 -2.33 0.00 0.00 43.42 39.98 3i9o n LEU 183 CO 0.28 -0.78 0.18 0.42 -1.33 0.00 0.00 177.39 176.15 3i9o s THR 184 N -0.40 2.23 -0.79 -5.08 -4.23 -1.26 -4.98 115.64 101.13 3i9o s THR 184 Ca 0.66 -1.19 0.09 0.00 -1.18 0.00 0.00 61.69 60.07 3i9o s THR 184 Cb -0.68 -2.42 0.09 0.00 1.34 0.00 0.00 72.50 70.83 3i9o s THR 184 CO 0.54 0.00 1.29 -0.46 -0.54 0.00 0.00 174.62 175.45 3i9o n ASN 185 N -1.94 0.17 0.16 3.99 0.23 -1.26 -0.79 115.26 115.82 3i9o n ASN 185 Ca 0.08 0.57 0.13 0.00 -0.53 0.00 0.00 54.58 54.83 3i9o n ASN 185 Cb 0.62 -0.59 0.49 0.00 -2.08 0.00 0.00 39.78 38.21 3i9o n ASN 185 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 3i9o h LYS 186 N 0.00 0.00 -6.35 -3.83 6.56 -1.94 -3.43 116.57 107.58 3i9o h LYS 186 Ca 0.00 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.04 3i9o h LYS 186 Cb 0.08 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.70 3i9o h LYS 186 CO 0.00 0.00 0.07 0.08 -2.06 0.00 0.00 179.45 177.54 3i9o s VAL 187 N -3.33 4.59 -0.05 0.50 1.01 0.02 -0.91 120.40 122.23 3i9o s VAL 187 Ca 0.05 1.45 0.11 0.00 0.00 0.00 0.00 61.98 63.59 3i9o s VAL 187 Cb 0.10 -4.02 -0.16 0.00 0.00 0.00 0.00 36.38 32.30 3i9o s VAL 187 CO 0.49 0.52 0.25 0.35 0.00 0.00 0.00 175.10 176.71 3i9o n THR 188 N 1.79 0.00 -3.58 3.92 -2.24 0.14 -4.83 114.28 109.48 3i9o n THR 188 Ca -0.08 -0.24 -0.07 0.00 -2.27 0.00 0.00 64.05 61.39 3i9o n THR 188 Cb 0.50 0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 3i9o n THR 188 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3i9o s ARG 189 N -2.69 0.90 -0.23 -0.78 3.52 -1.24 -1.58 118.95 116.86 3i9o s ARG 189 Ca -0.03 -0.39 -0.03 0.00 -0.13 0.00 0.00 55.73 55.14 3i9o s ARG 189 Cb 0.07 0.38 0.07 0.00 -1.56 0.00 0.00 34.95 33.91 3i9o s ARG 189 CO 0.44 -0.40 0.07 0.08 -0.81 0.00 0.00 175.30 174.68 3i9o s VAL 190 N -3.13 0.42 -0.15 7.11 1.01 -1.22 -1.62 120.40 122.81 3i9o s VAL 190 Ca 0.07 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 3i9o s VAL 190 Cb -0.01 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 3i9o s VAL 190 CO -0.06 -0.39 0.66 -0.54 0.00 0.00 0.00 175.10 174.77 3i9o s LYS 191 N 1.89 4.30 -0.08 2.72 1.02 0.35 -2.58 119.74 127.36 3i9o s LYS 191 Ca 0.03 0.73 -0.01 0.00 0.02 0.00 0.00 55.97 56.74 3i9o s LYS 191 Cb -0.17 -3.52 -0.03 0.00 -0.52 0.00 0.00 37.83 33.59 3i9o s LYS 191 CO -0.16 -0.12 -0.03 0.08 -0.92 0.00 0.00 175.35 174.20 3i9o s VAL 192 N 1.47 4.02 -0.20 3.17 1.01 0.62 -0.77 120.40 129.72 3i9o s VAL 192 Ca 0.32 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.96 3i9o s VAL 192 Cb -0.16 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.57 3i9o s VAL 192 CO 0.13 0.60 -0.16 -0.63 0.00 0.00 0.00 175.10 175.03 3i9o s ILE 193 N -0.77 1.98 -0.34 2.22 1.01 0.38 -1.61 121.20 124.07 3i9o s ILE 193 Ca 0.12 -1.07 -0.12 0.00 0.00 0.00 0.00 60.65 59.58 3i9o s ILE 193 Cb -0.11 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 3i9o s ILE 193 CO 0.02 0.36 0.23 -0.69 0.00 0.00 0.00 174.94 174.86 3i9o s VAL 194 N 1.28 5.19 -0.03 2.92 1.01 -0.17 -1.00 120.40 129.60 3i9o s VAL 194 Ca 0.01 -0.26 -0.26 0.00 0.00 0.00 0.00 61.98 61.47 3i9o s VAL 194 Cb -0.15 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 3i9o s VAL 194 CO -0.10 -0.01 0.81 -0.22 0.00 0.00 0.00 175.10 175.58 3i9o s LEU 195 N 1.71 4.35 -0.60 3.92 2.96 -0.19 -2.21 118.68 128.62 3i9o s LEU 195 Ca 0.06 1.39 0.00 0.00 -0.22 0.00 0.00 54.13 55.36 3i9o s LEU 195 Cb -0.17 -3.28 0.15 0.00 0.50 0.00 0.00 46.19 43.38 3i9o s LEU 195 CO 0.10 -0.16 0.38 -1.00 -1.32 0.00 0.00 176.35 174.35 3i9o s HIS 196 N 0.81 3.33 0.39 5.38 3.76 -1.26 -1.33 115.29 126.36 3i9o s HIS 196 Ca 0.43 -2.94 -0.23 0.00 -0.15 0.00 0.00 55.06 52.17 3i9o s HIS 196 Cb -0.19 -3.03 -0.14 0.00 1.11 0.00 0.00 32.58 30.33 3i9o s HIS 196 CO 0.22 -0.79 0.47 0.54 -0.85 0.00 0.00 174.74 174.34 3i9o n ARG 197 N 3.23 0.44 -2.19 1.40 1.74 -1.26 -4.88 116.66 115.13 3i9o n ARG 197 Ca 0.08 0.16 -0.34 0.00 -0.77 0.00 0.00 57.85 56.98 3i9o n ARG 197 Cb 0.35 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 3i9o n ARG 197 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3i9o s LEU 198 N 2.34 3.65 0.00 0.55 1.43 -1.26 -3.23 118.68 122.16 3i9o s LEU 198 Ca 0.62 1.99 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 3i9o s LEU 198 Cb -0.65 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.01 3i9o s LEU 198 CO 0.59 -1.17 0.00 0.61 0.23 0.00 0.00 176.35 176.61 3i9o n GLY 199 N -0.35 1.93 3.52 -3.19 0.00 -1.26 -4.93 105.19 100.90 3i9o n GLY 199 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3i9o n GLY 199 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i9o s GLU 200 N 0.00 2.38 0.19 1.61 2.02 -1.20 -5.06 118.70 118.64 3i9o s GLU 200 Ca 0.00 -0.80 -0.31 0.00 0.02 0.00 0.00 54.97 53.88 3i9o s GLU 200 Cb 0.00 -2.36 -0.16 0.00 0.10 0.00 0.00 34.13 31.71 3i9o s GLU 200 CO 0.00 0.59 0.98 1.17 0.02 0.00 0.00 175.26 178.01 3i9o n LYS 201 N 1.76 0.84 -2.86 1.61 4.81 -1.26 -4.78 118.16 118.29 3i9o n LYS 201 Ca -0.16 0.30 -0.41 0.00 -0.87 0.00 0.00 58.31 57.17 3i9o n LYS 201 Cb 0.52 -1.66 -0.04 0.00 0.02 0.00 0.00 35.03 33.88 3i9o n LYS 201 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3i9o s ILE 202 N -0.56 4.86 0.04 3.15 1.01 -1.26 -4.66 121.20 123.79 3i9o s ILE 202 Ca 0.69 1.80 -0.03 0.00 0.00 0.00 0.00 60.65 63.12 3i9o s ILE 202 Cb -0.87 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 37.39 3i9o s ILE 202 CO 0.55 0.24 -0.06 -0.38 0.00 0.00 0.00 174.94 175.29 3i9o n ILE 203 N 3.56 1.14 -3.75 2.92 2.08 -0.34 -5.02 119.36 119.94 3i9o n ILE 203 Ca 0.02 0.33 -0.28 0.00 0.56 0.00 0.00 62.75 63.38 3i9o n ILE 203 Cb 0.51 -1.66 -0.03 0.00 -0.75 0.00 0.00 39.64 37.70 3i9o n ILE 203 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3i9o s GLU 204 N -2.04 3.51 0.06 0.38 0.41 -0.61 -5.04 118.70 115.37 3i9o s GLU 204 Ca -0.05 -0.36 -0.08 0.00 -0.41 0.00 0.00 54.97 54.07 3i9o s GLU 204 Cb 0.01 -2.88 -0.00 0.00 -1.78 0.00 0.00 34.13 29.47 3i9o s GLU 204 CO 0.07 0.45 0.17 0.15 -0.49 0.00 0.00 175.26 175.61 3i9o s LYS 205 N -3.13 0.75 0.49 1.61 1.02 -1.26 -4.86 119.74 114.37 3i9o s LYS 205 Ca 0.38 -0.84 -0.24 0.00 0.02 0.00 0.00 55.97 55.30 3i9o s LYS 205 Cb -0.11 0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 37.43 3i9o s LYS 205 CO 0.28 -0.22 1.38 0.00 -0.92 0.00 0.00 175.35 175.87 3i9o n GLY 207 N 0.69 0.66 3.21 0.00 0.00 -1.26 -4.97 105.19 103.52 3i9o n GLY 207 Ca 0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3i9o n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i9o s ALA 208 N -1.91 -0.29 0.00 4.61 0.00 -1.09 -4.64 121.76 118.44 3i9o s ALA 208 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.42 3i9o s ALA 208 Cb 0.00 0.47 0.00 0.00 0.00 0.00 0.00 23.12 23.59 3i9o s ALA 208 CO 0.00 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.67 3i9o n GLY 209 N 0.02 1.15 0.44 0.00 0.00 -1.26 -2.57 105.19 102.96 3i9o n GLY 209 Ca -0.16 -0.54 0.25 0.00 0.00 0.00 0.00 46.02 45.58 3i9o n GLY 209 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i9o h SER 210 N 4.09 0.30 0.91 1.61 4.64 -1.93 0.19 113.55 123.35 3i9o h SER 210 Ca 0.00 0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 3i9o h SER 210 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3i9o h SER 210 CO 0.00 0.07 -0.14 -0.07 -0.87 0.00 0.00 176.83 175.82 3i9o h LEU 211 N 0.27 0.00 -0.28 5.97 3.38 -1.78 0.32 115.31 123.20 3i9o h LEU 211 Ca 0.54 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.40 3i9o h LEU 211 Cb 1.61 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.36 3i9o h LEU 211 CO -0.18 0.14 -0.26 0.25 0.09 0.00 0.00 178.44 178.47 3i9o h LEU 212 N 0.00 0.71 -0.24 1.67 5.85 -0.52 -2.32 115.31 120.46 3i9o h LEU 212 Ca -0.00 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 3i9o h LEU 212 Cb 0.63 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 3i9o h LEU 212 CO 0.02 1.03 0.12 0.44 -0.34 0.00 0.00 178.44 179.71 3i9o h ASP 213 N 0.41 0.31 -0.33 1.25 3.32 -0.72 -2.20 116.42 118.45 3i9o h ASP 213 Ca 0.05 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3i9o h ASP 213 Cb 0.82 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 3i9o h ASP 213 CO 0.07 0.33 0.19 0.25 -1.72 0.00 0.00 179.24 178.36 3i9o h LEU 214 N 0.26 0.41 -0.35 1.55 5.85 -0.54 -0.97 115.31 121.52 3i9o h LEU 214 Ca 0.08 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.79 3i9o h LEU 214 Cb 0.10 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 40.95 3i9o h LEU 214 CO -0.01 0.36 -0.47 -0.08 -0.34 0.00 0.00 178.44 177.90 3i9o h GLU 215 N 0.42 -0.38 -0.23 1.25 4.81 -1.31 0.20 114.58 119.35 3i9o h GLU 215 Ca 0.12 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.41 3i9o h GLU 215 Cb 0.04 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 3i9o h GLU 215 CO -0.02 -0.25 -0.02 0.87 -0.73 0.00 0.00 179.01 178.86 3i9o h LYS 216 N -0.39 0.05 -0.51 1.92 1.57 -1.13 -0.85 116.57 117.23 3i9o h LYS 216 Ca 0.11 -0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.98 3i9o h LYS 216 Cb 0.60 -0.01 -0.10 0.00 0.08 0.00 0.00 32.23 32.80 3i9o h LYS 216 CO -0.55 0.03 -0.25 -0.07 -0.57 0.00 0.00 179.45 178.05 3i9o h LEU 217 N 0.05 -0.85 -0.57 2.94 3.38 -0.51 -1.06 115.31 118.69 3i9o h LEU 217 Ca 0.11 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 3i9o h LEU 217 Cb 0.15 0.45 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 3i9o h LEU 217 CO -0.20 -0.26 0.28 0.58 0.09 0.00 0.00 178.44 178.93 3i9o h VAL 218 N -0.13 1.20 -0.57 1.22 2.07 0.07 -2.46 116.25 117.65 3i9o h VAL 218 Ca 0.23 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.23 3i9o h VAL 218 Cb 0.49 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 3i9o h VAL 218 CO -0.59 0.23 0.31 0.11 0.02 0.00 0.00 177.57 177.65 3i9o h LYS 219 N 0.77 0.58 -0.46 1.57 1.57 -0.55 -1.23 116.57 118.81 3i9o h LYS 219 Ca 0.20 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.04 3i9o h LYS 219 Cb 0.11 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3i9o h LYS 219 CO -0.03 0.39 0.32 0.00 -0.57 0.00 0.00 179.45 179.56 3i9o h ALA 220 N 1.29 2.21 0.00 3.86 0.00 -0.76 -0.08 119.26 125.78 3i9o h ALA 220 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3i9o h ALA 220 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3i9o h ALA 220 CO -0.15 -0.33 0.00 1.63 0.00 0.00 0.00 179.25 180.40 3i9o n LYS 221 N -4.45 0.51 -2.74 0.00 4.76 -0.48 -4.87 118.16 110.89 3i9o n LYS 221 Ca 0.07 0.04 -0.15 0.00 -2.87 0.00 0.00 58.31 55.41 3i9o n LYS 221 Cb 0.42 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 32.13 3i9o n LYS 221 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3i9o n HIS 222 N -1.12 -1.28 -4.08 2.13 8.25 -0.04 -5.03 115.22 114.04 3i9o n HIS 222 Ca 0.13 0.33 -0.31 0.00 -0.26 0.00 0.00 57.72 57.61 3i9o n HIS 222 Cb 0.11 -3.31 -0.07 0.00 1.12 0.00 0.00 29.99 27.84 3i9o n HIS 222 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3i9o s PHE 223 N -2.95 3.22 0.71 4.41 0.08 -1.11 -4.95 117.98 117.38 3i9o s PHE 223 Ca 0.19 0.13 -0.12 0.00 0.12 0.00 0.00 56.93 57.25 3i9o s PHE 223 Cb -0.08 -1.67 0.18 0.00 -0.57 0.00 0.00 43.02 40.88 3i9o s PHE 223 CO 0.24 0.53 0.52 0.00 -0.10 0.00 0.00 175.22 176.40 3i9o n ALA 224 N 0.79 -2.25 -3.63 5.36 0.00 -0.62 -4.31 120.51 115.85 3i9o n ALA 224 Ca -0.11 -0.83 -0.01 0.00 0.00 0.00 0.00 53.44 52.49 3i9o n ALA 224 Cb 0.52 -0.07 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 3i9o n ALA 224 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3i9o s PHE 225 N -1.83 -0.50 0.18 0.00 5.36 -1.26 -3.46 117.98 116.48 3i9o s PHE 225 Ca 0.36 0.98 -0.09 0.00 -0.96 0.00 0.00 56.93 57.23 3i9o s PHE 225 Cb -0.05 0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 42.92 3i9o s PHE 225 CO 0.29 -0.25 0.30 0.16 -1.46 0.00 0.00 175.22 174.27 3i9o s ASP 226 N 1.37 0.03 -0.25 6.13 1.47 -1.07 -5.00 116.67 119.36 3i9o s ASP 226 Ca -0.08 -0.92 -0.22 0.00 1.18 0.00 0.00 52.55 52.50 3i9o s ASP 226 Cb -0.04 0.45 0.07 0.00 -0.34 0.00 0.00 42.92 43.07 3i9o s ASP 226 CO -0.14 -0.93 0.66 0.00 0.68 0.00 0.00 175.17 175.44 3i9o s VAL 228 N 0.53 0.07 -0.24 0.00 0.11 -0.63 -4.96 120.40 115.29 3i9o s VAL 228 Ca -0.01 -0.62 -0.01 0.00 -2.93 0.00 0.00 61.98 58.41 3i9o s VAL 228 Cb -0.05 -0.62 0.03 0.00 -1.53 0.00 0.00 36.38 34.21 3i9o s VAL 228 CO -0.02 -0.34 -0.08 -1.61 -3.33 0.00 0.00 175.10 169.72 3i9o s GLU 229 N -1.60 2.85 -1.27 1.54 2.02 -1.26 -1.00 118.70 119.97 3i9o s GLU 229 Ca -0.12 -0.96 -0.00 0.00 0.02 0.00 0.00 54.97 53.90 3i9o s GLU 229 Cb -0.05 -2.93 0.00 0.00 0.10 0.00 0.00 34.13 31.25 3i9o s GLU 229 CO 0.02 -0.37 0.82 0.09 0.02 0.00 0.00 175.26 175.83 3i9o n ASN 230 N 4.65 -1.59 -4.44 -0.19 4.13 -0.94 -4.93 115.26 111.96 3i9o n ASN 230 Ca -0.17 -0.74 -0.39 0.00 1.68 0.00 0.00 54.58 54.96 3i9o n ASN 230 Cb 0.47 -4.46 0.03 0.00 -1.54 0.00 0.00 39.78 34.28 3i9o n ASN 230 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3i9o n PRO 231 N -4.23 0.47 -0.20 3.52 -0.04 -1.26 -4.42 135.00 128.84 3i9o n PRO 231 Ca -0.29 0.18 0.01 0.00 -0.04 0.00 0.00 63.50 63.36 3i9o n PRO 231 Cb 0.67 -1.61 0.10 0.00 -0.04 0.00 0.00 33.50 32.63 3i9o n PRO 231 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i9o h ARG 232 N 0.29 0.19 -0.80 0.54 3.08 -1.98 0.85 114.38 116.55 3i9o h ARG 232 Ca -0.45 -0.01 0.13 0.00 0.07 0.00 0.00 59.98 59.73 3i9o h ARG 232 Cb 1.40 -0.04 -0.09 0.00 0.08 0.00 0.00 29.97 31.32 3i9o h ARG 232 CO 0.47 0.12 0.39 0.00 -1.07 0.00 0.00 179.97 179.89 3i9o h ALA 233 N 1.51 1.17 -0.12 0.04 0.00 -2.01 0.24 119.26 120.10 3i9o h ALA 233 Ca 0.31 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.19 3i9o h ALA 233 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3i9o h ALA 233 CO -0.45 -0.10 -0.38 0.28 0.00 0.00 0.00 179.25 178.60 3i9o h VAL 234 N 0.58 1.38 -0.81 0.00 2.07 -1.71 -3.19 116.25 114.56 3i9o h VAL 234 Ca 0.43 -1.69 0.16 0.00 0.82 0.00 0.00 66.70 66.42 3i9o h VAL 234 Cb 0.59 2.14 -0.10 0.00 -1.52 0.00 0.00 31.29 32.39 3i9o h VAL 234 CO -0.35 0.50 0.35 0.25 0.02 0.00 0.00 177.57 178.34 3i9o h LEU 235 N 0.05 0.33 -0.83 2.57 5.85 0.32 -1.79 115.31 121.81 3i9o h LEU 235 Ca -0.01 0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.71 3i9o h LEU 235 Cb 1.00 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 3i9o h LEU 235 CO 0.08 0.10 -0.38 -0.26 -0.34 0.00 0.00 178.44 177.64 3i9o h PHE 236 N 0.47 0.49 0.10 1.25 0.04 -1.03 -1.75 116.94 116.50 3i9o h PHE 236 Ca 0.46 -0.13 0.02 0.00 2.80 0.00 0.00 57.97 61.12 3i9o h PHE 236 Cb 0.74 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.74 3i9o h PHE 236 CO -0.15 0.74 -0.28 -0.07 -0.60 0.00 0.00 178.31 177.95 3i9o h LEU 237 N 0.35 -0.81 -0.02 1.54 4.07 -1.33 0.86 115.31 119.97 3i9o h LEU 237 Ca 0.04 0.10 0.03 0.00 0.08 0.00 0.00 57.88 58.13 3i9o h LEU 237 Cb 0.83 0.31 -0.05 0.00 1.08 0.00 0.00 40.66 42.83 3i9o h LEU 237 CO 0.07 -0.37 -0.26 -0.07 -1.08 0.00 0.00 178.44 176.73 3i9o h LEU 238 N -0.48 -0.76 -1.26 1.67 3.38 -0.97 -1.45 115.31 115.43 3i9o h LEU 238 Ca 0.04 0.11 0.14 0.00 0.09 0.00 0.00 57.88 58.26 3i9o h LEU 238 Cb 0.52 0.32 -0.07 0.00 0.09 0.00 0.00 40.66 41.52 3i9o h LEU 238 CO -0.18 -0.32 0.58 0.00 0.09 0.00 0.00 178.44 178.61 3i9o h SER 240 N 0.71 0.45 0.15 0.00 0.87 0.30 0.42 113.55 116.45 3i9o h SER 240 Ca 0.46 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 3i9o h SER 240 Cb 0.72 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 3i9o h SER 240 CO -0.22 0.14 -0.44 0.47 -0.53 0.00 0.00 176.83 176.25 3i9o n ASP 241 N -4.57 1.34 -2.86 6.23 8.00 0.30 -4.52 116.55 120.47 3i9o n ASP 241 Ca 0.22 -1.07 -0.12 0.00 0.71 0.00 0.00 54.79 54.54 3i9o n ASP 241 Cb 0.78 0.36 0.05 0.00 -0.02 0.00 0.00 41.12 42.29 3i9o n ASP 241 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3i9o n ASN 242 N -0.59 -1.59 -0.07 -2.24 4.05 -0.03 -5.02 115.26 109.78 3i9o n ASN 242 Ca 0.10 -3.45 0.00 0.00 0.45 0.00 0.00 54.58 51.68 3i9o n ASN 242 Cb 0.39 1.23 0.00 0.00 1.23 0.00 0.00 39.78 42.63 3i9o n ASN 242 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 3i9o n PRO 243 N 0.56 0.59 -0.00 1.20 -0.04 -0.25 -2.21 135.00 134.86 3i9o n PRO 243 Ca 0.11 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 3i9o n PRO 243 Cb 0.67 -1.04 -0.05 0.00 -0.04 0.00 0.00 33.50 33.04 3i9o n PRO 243 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3i9o n ASN 244 N -0.40 2.03 -4.58 3.54 4.13 -1.26 -4.87 115.26 113.85 3i9o n ASN 244 Ca 0.00 -0.29 -0.47 0.00 1.68 0.00 0.00 54.58 55.51 3i9o n ASN 244 Cb 0.02 1.19 -0.03 0.00 -1.54 0.00 0.00 39.78 39.43 3i9o n ASN 244 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3i9o n ALA 245 N -1.51 -0.53 -0.37 5.41 0.00 -0.94 -4.78 120.51 117.80 3i9o n ALA 245 Ca -0.00 0.43 0.38 0.00 0.00 0.00 0.00 53.44 54.24 3i9o n ALA 245 Cb 0.16 -2.02 0.71 0.00 0.00 0.00 0.00 19.45 18.30 3i9o n ALA 245 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3i9o h ARG 246 N 2.70 0.00 0.00 0.00 2.43 -1.95 0.30 114.38 117.87 3i9o h ARG 246 Ca -0.41 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 3i9o h ARG 246 Cb 1.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 3i9o h ARG 246 CO 0.66 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.51 3i9o n GLU 247 N -3.84 0.19 -0.11 0.20 4.71 -1.26 -3.68 120.64 116.85 3i9o n GLU 247 Ca 0.29 0.33 0.12 0.00 -0.01 0.00 0.00 57.16 57.89 3i9o n GLU 247 Cb 1.47 -1.81 0.22 0.00 -1.01 0.00 0.00 31.44 30.31 3i9o n GLU 247 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3i9o n ARG 249 N 1.24 1.08 -3.82 0.00 1.74 -1.24 -5.00 116.66 110.66 3i9o n ARG 249 Ca 0.17 0.40 -0.34 0.00 -0.77 0.00 0.00 57.85 57.32 3i9o n ARG 249 Cb 0.56 -2.11 -0.05 0.00 -1.02 0.00 0.00 32.46 29.84 3i9o n ARG 249 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3i9o s LEU 250 N -1.33 4.36 0.00 0.55 1.43 -1.26 -5.19 118.68 117.25 3i9o s LEU 250 Ca 0.70 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 54.26 3i9o s LEU 250 Cb -0.47 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.06 3i9o s LEU 250 CO 0.51 0.24 0.26 0.00 0.23 0.00 0.00 176.35 177.60