#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ipi s LEU 11 N 0.00 2.30 0.37 0.00 1.43 -1.26 -4.63 118.68 116.90 2ipi s LEU 11 Ca 0.00 1.93 -0.28 0.00 -1.03 0.00 0.00 54.13 54.75 2ipi s LEU 11 Cb 0.00 -4.22 -0.11 0.00 0.03 0.00 0.00 46.19 41.89 2ipi s LEU 11 CO 0.00 -3.25 1.46 0.54 0.23 0.00 0.00 176.35 175.33 2ipi s VAL 12 N -2.65 2.13 -0.08 -1.59 0.11 -1.26 -4.87 120.40 112.19 2ipi s VAL 12 Ca 0.66 0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.85 2ipi s VAL 12 Cb -0.22 -3.09 -0.03 0.00 -1.53 0.00 0.00 36.38 31.51 2ipi s VAL 12 CO 0.59 0.03 -0.09 -0.54 -3.33 0.00 0.00 175.10 171.77 2ipi s LYS 13 N -2.07 2.92 -0.20 1.54 -0.14 -0.95 -5.00 119.74 115.84 2ipi s LYS 13 Ca 0.52 -0.59 0.01 0.00 -1.36 0.00 0.00 55.97 54.56 2ipi s LYS 13 Cb -0.46 -2.60 0.04 0.00 -1.68 0.00 0.00 37.83 33.14 2ipi s LYS 13 CO 0.62 0.54 -0.10 0.08 -0.76 0.00 0.00 175.35 175.73 2ipi s VAL 14 N -0.48 1.65 -0.35 3.17 1.01 -1.26 -0.84 120.40 123.30 2ipi s VAL 14 Ca 0.07 -1.04 -0.07 0.00 0.00 0.00 0.00 61.98 60.94 2ipi s VAL 14 Cb -0.12 -1.74 0.04 0.00 0.00 0.00 0.00 36.38 34.57 2ipi s VAL 14 CO 0.02 0.14 0.14 -0.62 0.00 0.00 0.00 175.10 174.78 2ipi s ASP 15 N 1.39 5.40 0.01 3.32 2.15 0.95 -4.96 116.67 124.93 2ipi s ASP 15 Ca -0.02 -1.19 -0.03 0.00 0.43 0.00 0.00 52.55 51.74 2ipi s ASP 15 Cb -0.16 -1.90 -0.01 0.00 -0.30 0.00 0.00 42.92 40.55 2ipi s ASP 15 CO -0.08 -0.36 -0.06 -2.11 -0.17 0.00 0.00 175.17 172.39 2ipi n ARG 16 N 4.84 0.08 -0.14 4.34 -4.01 -1.26 -0.42 116.66 120.09 2ipi n ARG 16 Ca -0.12 0.03 0.07 0.00 -1.04 0.00 0.00 57.85 56.80 2ipi n ARG 16 Cb 0.44 -0.49 0.10 0.00 -3.04 0.00 0.00 32.46 29.48 2ipi n ARG 16 CO 0.00 0.00 0.00 1.33 -3.04 0.00 0.00 177.63 175.92 2ipi n VAL 17 N -3.22 1.47 -0.59 8.89 0.24 -1.26 -4.84 118.33 119.02 2ipi n VAL 17 Ca -0.02 -1.75 -0.30 0.00 -2.04 0.00 0.00 64.34 60.23 2ipi n VAL 17 Cb 0.08 -0.04 0.21 0.00 -1.47 0.00 0.00 33.84 32.63 2ipi n VAL 17 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2ipi n ASP 18 N -1.10 -1.66 0.25 -1.34 2.03 -1.26 -4.94 116.55 108.53 2ipi n ASP 18 Ca 0.12 -0.02 0.10 0.00 0.52 0.00 0.00 54.79 55.51 2ipi n ASP 18 Cb 0.62 -1.21 0.65 0.00 -0.72 0.00 0.00 41.12 40.46 2ipi n ASP 18 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2ipi h ARG 19 N -2.31 0.00 -0.00 -0.67 3.08 -2.00 -3.16 114.38 109.31 2ipi h ARG 19 Ca -0.55 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.50 2ipi h ARG 19 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 2ipi h ARG 19 CO 0.44 0.15 -0.48 0.54 -1.07 0.00 0.00 179.97 179.55 2ipi n ARG 20 N -3.84 0.31 0.03 0.04 1.74 -1.26 -4.59 116.66 109.09 2ipi n ARG 20 Ca -0.02 -0.19 -0.13 0.00 -0.77 0.00 0.00 57.85 56.74 2ipi n ARG 20 Cb 0.25 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.13 2ipi n ARG 20 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2ipi h TYR 21 N 0.47 -1.20 -0.91 -1.55 5.03 -1.89 -2.45 116.97 114.48 2ipi h TYR 21 Ca 0.00 0.04 0.12 0.00 2.58 0.00 0.00 58.73 61.47 2ipi h TYR 21 Cb 0.51 0.53 -0.07 0.00 1.55 0.00 0.00 36.73 39.26 2ipi h TYR 21 CO 0.00 -0.49 0.58 1.96 -1.32 0.00 0.00 178.16 178.90 2ipi h GLN 22 N -0.54 0.82 -0.76 1.82 1.08 -1.86 0.12 115.11 115.80 2ipi h GLN 22 Ca 0.06 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2ipi h GLN 22 Cb 0.64 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 27.85 2ipi h GLN 22 CO -0.35 0.54 0.47 -0.44 -0.95 0.00 0.00 178.83 178.10 2ipi h ASP 23 N 0.84 0.90 -0.01 1.46 3.32 -1.76 -2.71 116.42 118.46 2ipi h ASP 23 Ca 0.44 -0.04 -0.20 0.00 0.02 0.00 0.00 57.03 57.24 2ipi h ASP 23 Cb 0.52 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2ipi h ASP 23 CO -0.20 0.68 -0.72 -0.07 -1.72 0.00 0.00 179.24 177.21 2ipi h LEU 24 N 1.04 0.77 -0.89 1.55 4.07 -0.63 -3.04 115.31 118.18 2ipi h LEU 24 Ca 0.27 -0.49 0.00 0.00 0.08 0.00 0.00 57.88 57.75 2ipi h LEU 24 Cb -0.06 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 41.45 2ipi h LEU 24 CO -0.05 1.26 0.00 0.55 -1.08 0.00 0.00 178.44 179.12 2ipi n VAL 25 N -3.91 0.10 -0.47 1.22 3.14 -0.91 -3.35 118.33 114.15 2ipi n VAL 25 Ca -0.06 -0.26 0.08 0.00 -2.96 0.00 0.00 64.34 61.14 2ipi n VAL 25 Cb 0.71 0.31 0.23 0.00 -1.06 0.00 0.00 33.84 34.04 2ipi n VAL 25 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2ipi n THR 26 N 0.09 1.46 0.21 1.55 -2.24 -1.04 -4.12 114.28 110.19 2ipi n THR 26 Ca 0.18 -1.24 0.08 0.00 -2.27 0.00 0.00 64.05 60.79 2ipi n THR 26 Cb 0.31 0.25 0.41 0.00 -2.10 0.00 0.00 70.33 69.20 2ipi n THR 26 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2ipi h ARG 27 N 2.56 0.00 -6.10 -0.78 3.08 -1.55 -3.45 114.38 108.13 2ipi h ARG 27 Ca 0.00 0.00 -0.76 0.00 0.07 0.00 0.00 59.98 59.29 2ipi h ARG 27 Cb 1.06 0.00 0.04 0.00 0.08 0.00 0.00 29.97 31.15 2ipi h ARG 27 CO 0.10 0.29 0.32 0.41 -1.07 0.00 0.00 179.97 180.02 2ipi n GLY 28 N 0.16 0.11 0.17 0.04 0.00 -1.26 -4.85 105.19 99.56 2ipi n GLY 28 Ca -0.00 0.78 -0.09 0.00 0.00 0.00 0.00 46.02 46.71 2ipi n GLY 28 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ipi h PHE 29 N 4.07 0.45 -3.16 1.61 3.04 -0.69 -3.40 116.94 118.85 2ipi h PHE 29 Ca -0.49 -0.20 -0.57 0.00 3.98 0.00 0.00 57.97 60.69 2ipi h PHE 29 Cb 1.38 -0.07 -0.05 0.00 2.56 0.00 0.00 35.95 39.77 2ipi h PHE 29 CO 0.60 0.95 0.92 1.21 -2.02 0.00 0.00 178.31 179.97 2ipi s ASN 30 N -6.95 6.80 0.44 0.41 3.04 -1.26 -4.89 114.94 112.53 2ipi s ASN 30 Ca -0.05 1.23 0.31 0.00 0.04 0.00 0.00 52.86 54.38 2ipi s ASN 30 Cb 0.11 -2.54 1.37 0.00 -1.54 0.00 0.00 41.25 38.65 2ipi s ASN 30 CO 0.83 -0.96 1.91 1.23 -3.04 0.00 0.00 177.10 177.07 2ipi h GLY 31 N 10.43 0.00 2.00 1.21 0.00 0.14 -2.44 103.07 114.41 2ipi h GLY 31 Ca -0.24 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 2ipi h GLY 31 CO 1.02 0.00 -0.22 3.21 0.00 0.00 0.00 176.54 180.56 2ipi h ARG 32 N 0.00 0.00 -4.85 4.80 3.08 -1.91 -3.42 114.38 112.08 2ipi h ARG 32 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 2ipi h ARG 32 Cb 0.33 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.06 2ipi h ARG 32 CO 0.00 0.22 -0.73 -0.06 -1.07 0.00 0.00 179.97 178.33 2ipi s PHE 33 N -4.17 3.15 -0.09 3.04 0.08 -0.92 -5.06 117.98 114.01 2ipi s PHE 33 Ca -0.02 -1.67 -0.01 0.00 0.12 0.00 0.00 56.93 55.35 2ipi s PHE 33 Cb 0.13 -2.08 0.03 0.00 -0.57 0.00 0.00 43.02 40.53 2ipi s PHE 33 CO 0.65 -0.75 -0.05 1.03 -0.10 0.00 0.00 175.22 175.99 2ipi s ARG 34 N 1.30 1.16 0.67 0.44 1.81 -1.26 -4.77 118.95 118.31 2ipi s ARG 34 Ca -0.02 -0.12 -0.05 0.00 -1.72 0.00 0.00 55.73 53.82 2ipi s ARG 34 Cb -0.18 -1.31 0.06 0.00 -0.45 0.00 0.00 34.95 33.07 2ipi s ARG 34 CO -0.03 -0.26 0.96 0.20 -0.68 0.00 0.00 175.30 175.50 2ipi s GLY 35 N 1.71 1.73 -0.41 -3.53 0.00 -1.21 -4.90 107.32 100.71 2ipi s GLY 35 Ca 0.03 -1.08 0.11 0.00 0.00 0.00 0.00 44.72 43.78 2ipi s GLY 35 CO -0.06 -0.69 0.82 0.54 0.00 0.00 0.00 173.10 173.72 2ipi n ARG 36 N -2.79 1.62 -1.42 2.90 1.74 -1.26 -4.95 116.66 112.49 2ipi n ARG 36 Ca 0.09 -3.75 -0.30 0.00 -0.77 0.00 0.00 57.85 53.11 2ipi n ARG 36 Cb 0.60 -1.79 0.10 0.00 -1.02 0.00 0.00 32.46 30.35 2ipi n ARG 36 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2ipi s PRO 37 N -2.80 1.99 0.10 5.56 0.04 -1.25 -4.87 135.00 133.75 2ipi s PRO 37 Ca 0.41 0.80 0.05 0.00 0.04 0.00 0.00 61.00 62.29 2ipi s PRO 37 Cb 0.35 -1.89 -0.23 0.00 0.04 0.00 0.00 34.50 32.77 2ipi s PRO 37 CO -0.08 -1.73 1.21 -0.44 0.04 0.00 0.00 177.00 176.00 2ipi h ASP 38 N -1.17 0.08 -4.64 6.66 3.45 -1.16 -3.47 116.42 116.18 2ipi h ASP 38 Ca -0.47 -0.09 -0.13 0.00 0.43 0.00 0.00 57.03 56.77 2ipi h ASP 38 Cb 1.26 -0.03 -0.22 0.00 -0.56 0.00 0.00 39.33 39.79 2ipi h ASP 38 CO 0.57 1.07 -0.33 0.54 -1.57 0.00 0.00 179.24 179.52 2ipi s VAL 39 N -2.69 0.04 -0.12 -1.35 0.11 -1.03 -4.55 120.40 110.81 2ipi s VAL 39 Ca -0.00 -0.36 -0.00 0.00 -2.93 0.00 0.00 61.98 58.68 2ipi s VAL 39 Cb 0.09 -0.53 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 2ipi s VAL 39 CO 0.83 -0.20 -0.11 -0.69 -3.33 0.00 0.00 175.10 171.60 2ipi s VAL 40 N -0.88 3.23 -0.35 2.04 1.01 0.44 -1.85 120.40 124.05 2ipi s VAL 40 Ca -0.10 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 2ipi s VAL 40 Cb -0.05 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.99 2ipi s VAL 40 CO 0.03 0.53 0.19 -0.31 0.00 0.00 0.00 175.10 175.54 2ipi s TYR 41 N 0.12 3.22 -0.55 5.22 2.02 0.12 -0.03 117.35 127.46 2ipi s TYR 41 Ca -0.05 -0.75 -0.22 0.00 -0.37 0.00 0.00 57.07 55.68 2ipi s TYR 41 Cb -0.15 -2.41 0.05 0.00 -0.40 0.00 0.00 41.96 39.06 2ipi s TYR 41 CO 0.04 -0.55 0.81 0.08 -1.57 0.00 0.00 175.55 174.36 2ipi s VAL 42 N 1.59 4.58 0.20 0.71 1.01 -0.02 -1.50 120.40 126.97 2ipi s VAL 42 Ca 0.03 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.76 2ipi s VAL 42 Cb -0.18 -4.47 -0.07 0.00 0.00 0.00 0.00 36.38 31.66 2ipi s VAL 42 CO 0.07 -1.05 0.50 0.68 0.00 0.00 0.00 175.10 175.31 2ipi s VAL 43 N 3.40 4.99 0.00 2.92 -7.23 -1.20 -2.23 120.40 121.04 2ipi s VAL 43 Ca 0.22 0.41 0.00 0.00 -1.81 0.00 0.00 61.98 60.80 2ipi s VAL 43 Cb -0.16 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.15 2ipi s VAL 43 CO 0.15 -0.00 0.00 1.41 -0.31 0.00 0.00 175.10 176.34 2ipi n HIS 44 N 0.05 0.00 -3.80 2.82 8.25 -1.26 -4.28 115.22 117.00 2ipi n HIS 44 Ca -0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.36 2ipi n HIS 44 Cb 0.52 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.57 2ipi n HIS 44 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2ipi s THR 45 N -0.94 0.12 0.36 1.59 -4.23 -1.26 -4.86 115.64 106.42 2ipi s THR 45 Ca 0.00 -1.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.60 2ipi s THR 45 Cb 0.00 -1.26 0.32 0.00 1.34 0.00 0.00 72.50 72.90 2ipi s THR 45 CO 0.00 -0.55 1.89 0.00 -0.54 0.00 0.00 174.62 175.42 2ipi h ALA 46 N 2.71 1.82 0.00 3.99 0.00 -1.98 0.19 119.26 125.99 2ipi h ALA 46 Ca -0.34 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 2ipi h ALA 46 Cb 1.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2ipi h ALA 46 CO 0.53 -0.02 -0.59 -0.44 0.00 0.00 0.00 179.25 178.73 2ipi h ASP 47 N 0.70 0.00 -0.52 0.00 3.32 -1.99 -2.01 116.42 115.91 2ipi h ASP 47 Ca 0.41 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.39 2ipi h ASP 47 Cb 0.61 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 2ipi h ASP 47 CO -0.17 0.59 0.08 1.56 -1.72 0.00 0.00 179.24 179.58 2ipi h GLN 48 N 0.00 0.92 -0.65 3.56 4.20 -1.07 -1.34 115.11 120.73 2ipi h GLN 48 Ca -0.01 -0.23 -0.06 0.00 0.06 0.00 0.00 58.65 58.41 2ipi h GLN 48 Cb 1.06 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.70 2ipi h GLN 48 CO 0.08 0.87 0.15 0.28 -0.67 0.00 0.00 178.83 179.54 2ipi h VAL 49 N 0.87 1.26 -0.96 -0.54 2.07 -1.19 0.69 116.25 118.46 2ipi h VAL 49 Ca 0.18 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.80 2ipi h VAL 49 Cb 0.41 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 2ipi h VAL 49 CO 0.01 0.36 0.62 0.58 0.02 0.00 0.00 177.57 179.15 2ipi h VAL 50 N 0.96 1.11 -0.11 2.57 2.07 -0.84 -0.90 116.25 121.11 2ipi h VAL 50 Ca 0.20 -0.40 -0.23 0.00 0.82 0.00 0.00 66.70 67.10 2ipi h VAL 50 Cb 0.37 -0.14 0.01 0.00 -1.52 0.00 0.00 31.29 30.01 2ipi h VAL 50 CO 0.00 0.21 -0.82 -0.78 0.02 0.00 0.00 177.57 176.20 2ipi h ASP 51 N 1.15 0.86 -0.19 0.57 3.58 -0.74 -0.26 116.42 121.39 2ipi h ASP 51 Ca 0.40 -0.59 -0.10 0.00 0.42 0.00 0.00 57.03 57.16 2ipi h ASP 51 Cb 0.10 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 2ipi h ASP 51 CO -0.15 1.38 -0.27 0.00 -2.88 0.00 0.00 179.24 177.31 2ipi h ALA 52 N 0.60 0.29 -0.88 -0.78 0.00 -0.64 -0.93 119.26 116.92 2ipi h ALA 52 Ca -0.06 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.52 2ipi h ALA 52 Cb 1.45 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.12 2ipi h ALA 52 CO 0.16 0.29 0.55 0.28 0.00 0.00 0.00 179.25 180.53 2ipi h VAL 53 N 0.19 1.04 -0.46 0.00 2.07 -1.19 0.31 116.25 118.20 2ipi h VAL 53 Ca 0.02 -0.34 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 2ipi h VAL 53 Cb 0.85 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2ipi h VAL 53 CO 0.06 0.18 -0.12 0.78 0.02 0.00 0.00 177.57 178.49 2ipi h ASN 54 N 0.99 0.91 -0.61 0.57 2.35 -0.96 -1.88 115.58 116.94 2ipi h ASN 54 Ca 0.39 -0.37 -0.10 0.00 -0.55 0.00 0.00 56.30 55.68 2ipi h ASN 54 Cb 0.19 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2ipi h ASN 54 CO -0.18 1.06 0.00 1.56 -1.65 0.00 0.00 177.43 178.23 2ipi h GLN 55 N 0.74 1.08 -0.81 0.81 4.20 -0.59 -0.91 115.11 119.64 2ipi h GLN 55 Ca 0.12 -0.34 0.02 0.00 0.06 0.00 0.00 58.65 58.50 2ipi h GLN 55 Cb 0.67 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 2ipi h GLN 55 CO 0.05 1.05 0.53 0.00 -0.67 0.00 0.00 178.83 179.79 2ipi h ALA 56 N 1.00 1.46 -0.18 3.87 0.00 -0.37 -2.59 119.26 122.45 2ipi h ALA 56 Ca 0.17 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 2ipi h ALA 56 Cb 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2ipi h ALA 56 CO 0.03 0.49 -0.66 0.52 0.00 0.00 0.00 179.25 179.63 2ipi h MET 57 N 1.06 0.68 0.00 0.00 2.86 -0.87 0.40 114.93 119.06 2ipi h MET 57 Ca 0.30 -0.50 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2ipi h MET 57 Cb -0.07 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 2ipi h MET 57 CO -0.07 1.12 -0.03 0.00 1.06 0.00 0.00 176.91 178.98 2ipi h ALA 58 N 0.76 1.29 -0.29 6.32 0.00 -0.80 -1.44 119.26 125.10 2ipi h ALA 58 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ipi h ALA 58 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2ipi h ALA 58 CO 0.13 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.41 2ipi n ALA 59 N -2.23 2.21 -2.63 0.00 0.00 -1.07 -4.98 120.51 111.82 2ipi n ALA 59 Ca -0.03 -1.07 -0.16 0.00 0.00 0.00 0.00 53.44 52.19 2ipi n ALA 59 Cb 0.12 -0.41 0.01 0.00 0.00 0.00 0.00 19.45 19.18 2ipi n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ipi n GLY 60 N 0.49 -0.19 3.63 0.00 0.00 -0.54 -4.97 105.19 103.61 2ipi n GLY 60 Ca 0.11 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 2ipi n GLY 60 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ipi s GLN 61 N -5.15 4.14 -0.03 1.61 -0.21 0.14 -5.01 119.66 115.14 2ipi s GLN 61 Ca 0.14 0.62 -0.30 0.00 0.02 0.00 0.00 55.36 55.85 2ipi s GLN 61 Cb -0.06 -3.64 -0.05 0.00 1.00 0.00 0.00 33.01 30.26 2ipi s GLN 61 CO 0.18 -0.41 1.38 0.50 -2.12 0.00 0.00 175.29 174.83 2ipi s ARG 62 N 2.48 4.28 0.14 2.91 3.52 -1.26 -4.59 118.95 126.42 2ipi s ARG 62 Ca 0.28 1.92 -0.04 0.00 -0.13 0.00 0.00 55.73 57.75 2ipi s ARG 62 Cb -0.15 -3.63 -0.05 0.00 -1.56 0.00 0.00 34.95 29.55 2ipi s ARG 62 CO 0.09 -0.60 0.36 0.42 -0.81 0.00 0.00 175.30 174.76 2ipi s ILE 63 N 2.64 5.19 -0.00 4.11 1.01 -1.26 -1.26 121.20 131.63 2ipi s ILE 63 Ca 0.63 -0.02 -0.02 0.00 0.00 0.00 0.00 60.65 61.24 2ipi s ILE 63 Cb -0.30 -3.62 -0.00 0.00 0.01 0.00 0.00 42.46 38.54 2ipi s ILE 63 CO 0.25 0.05 0.03 0.00 0.00 0.00 0.00 174.94 175.26 2ipi s ALA 64 N -1.65 -0.06 -0.19 9.38 0.00 -0.49 -4.69 121.76 124.06 2ipi s ALA 64 Ca 0.40 -0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.08 2ipi s ALA 64 Cb -0.12 0.03 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 2ipi s ALA 64 CO 0.25 -0.10 0.20 0.08 0.00 0.00 0.00 175.76 176.20 2ipi s VAL 65 N -0.70 5.36 -0.06 0.00 1.01 -1.26 -2.13 120.40 122.62 2ipi s VAL 65 Ca -0.08 0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.28 2ipi s VAL 65 Cb -0.05 -3.54 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 2ipi s VAL 65 CO -0.00 0.40 -0.19 -0.60 0.00 0.00 0.00 175.10 174.70 2ipi s ARG 66 N 0.56 2.13 0.00 2.72 3.52 -0.81 -4.91 118.95 122.16 2ipi s ARG 66 Ca 0.11 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 55.03 2ipi s ARG 66 Cb -0.12 -1.77 0.00 0.00 -1.56 0.00 0.00 34.95 31.50 2ipi s ARG 66 CO 0.01 0.23 0.00 0.43 -0.81 0.00 0.00 175.30 175.17 2ipi n SER 67 N 3.26 0.00 0.05 -2.12 7.64 -1.26 -0.97 113.62 120.21 2ipi n SER 67 Ca -0.19 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.59 2ipi n SER 67 Cb 0.53 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.74 2ipi n SER 67 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2ipi h GLY 68 N 0.00 0.46 0.00 0.23 0.00 -1.83 -3.41 103.07 98.51 2ipi h GLY 68 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.67 2ipi h GLY 68 CO 0.00 0.59 0.00 0.61 0.00 0.00 0.00 176.54 177.74 2ipi n GLY 69 N 0.60 0.86 1.47 4.60 0.00 -1.26 -4.55 105.19 106.91 2ipi n GLY 69 Ca -0.05 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.88 2ipi n GLY 69 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ipi n HIS 70 N -2.23 1.24 -1.62 1.61 8.25 -1.26 0.07 115.22 121.28 2ipi n HIS 70 Ca 0.00 -0.56 -0.47 0.00 -0.26 0.00 0.00 57.72 56.43 2ipi n HIS 70 Cb 0.00 -0.12 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 2ipi n HIS 70 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ipi h PHE 72 N 11.06 0.00 -0.52 0.00 0.05 -1.91 -2.04 116.94 123.57 2ipi h PHE 72 Ca -0.43 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.36 2ipi h PHE 72 Cb 1.27 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.22 2ipi h PHE 72 CO 0.91 0.07 0.00 0.39 -0.18 0.00 0.00 178.31 179.50 2ipi n GLU 73 N -3.47 2.63 -3.13 1.51 -0.58 -1.26 -4.88 120.64 111.47 2ipi n GLU 73 Ca -0.02 -2.34 -0.22 0.00 -0.42 0.00 0.00 57.16 54.17 2ipi n GLU 73 Cb 0.21 -1.45 0.01 0.00 -0.57 0.00 0.00 31.44 29.64 2ipi n GLU 73 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ipi n GLY 74 N 1.22 -0.50 0.31 0.62 0.00 -0.77 -4.88 105.19 101.19 2ipi n GLY 74 Ca 0.19 0.10 -0.05 0.00 0.00 0.00 0.00 46.02 46.26 2ipi n GLY 74 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2ipi h PHE 75 N -1.07 1.03 -0.40 1.61 0.05 -1.94 -0.72 116.94 115.51 2ipi h PHE 75 Ca -0.47 -0.01 0.11 0.00 3.82 0.00 0.00 57.97 61.43 2ipi h PHE 75 Cb 1.32 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 38.92 2ipi h PHE 75 CO 0.61 0.70 0.56 0.28 -0.18 0.00 0.00 178.31 180.27 2ipi h VAL 76 N 1.07 0.22 -0.38 -0.55 2.07 -1.91 -1.70 116.25 115.08 2ipi h VAL 76 Ca 0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.80 2ipi h VAL 76 Cb -0.03 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2ipi h VAL 76 CO -0.05 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.01 2ipi n ASP 77 N -3.42 3.59 -4.60 0.57 8.00 -0.28 -4.86 116.55 115.55 2ipi n ASP 77 Ca 0.07 -2.42 -0.42 0.00 0.71 0.00 0.00 54.79 52.73 2ipi n ASP 77 Cb 0.72 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 2ipi n ASP 77 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2ipi n ASP 78 N 0.30 1.30 0.00 -2.24 -0.08 -0.64 -3.32 116.55 111.88 2ipi n ASP 78 Ca 0.18 1.09 0.07 0.00 -1.51 0.00 0.00 54.79 54.61 2ipi n ASP 78 Cb 0.67 -1.33 0.33 0.00 2.34 0.00 0.00 41.12 43.13 2ipi n ASP 78 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2ipi n PRO 79 N 0.38 0.10 0.05 -0.67 -0.02 -1.26 -1.76 135.00 131.81 2ipi n PRO 79 Ca 0.09 0.21 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 2ipi n PRO 79 Cb 0.37 -1.50 0.32 0.00 -0.02 0.00 0.00 33.50 32.66 2ipi n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ipi n ALA 80 N -1.40 2.80 -2.52 3.55 0.00 -1.26 -4.83 120.51 116.85 2ipi n ALA 80 Ca 0.05 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 2ipi n ALA 80 Cb 0.14 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 2ipi n ALA 80 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2ipi s VAL 81 N -3.09 4.35 -0.34 0.00 1.01 -0.72 -4.63 120.40 116.98 2ipi s VAL 81 Ca 0.09 1.68 0.04 0.00 0.00 0.00 0.00 61.98 63.80 2ipi s VAL 81 Cb 0.15 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2ipi s VAL 81 CO 0.66 0.10 0.36 0.54 0.00 0.00 0.00 175.10 176.76 2ipi n ARG 82 N 4.21 3.16 -3.69 2.72 5.12 -0.39 -3.90 116.66 123.89 2ipi n ARG 82 Ca 0.08 -0.32 -0.14 0.00 -1.93 0.00 0.00 57.85 55.54 2ipi n ARG 82 Cb 0.48 -0.85 -0.14 0.00 -1.16 0.00 0.00 32.46 30.79 2ipi n ARG 82 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ipi s ALA 83 N -0.95 -0.41 -0.09 7.54 0.00 -0.40 -0.73 121.76 126.72 2ipi s ALA 83 Ca 0.03 0.81 0.02 0.00 0.00 0.00 0.00 51.96 52.82 2ipi s ALA 83 Cb 0.03 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 2ipi s ALA 83 CO 0.12 -0.46 -0.17 0.54 0.00 0.00 0.00 175.76 175.79 2ipi s VAL 84 N 1.97 2.78 -0.36 0.00 0.11 -0.77 -1.40 120.40 122.73 2ipi s VAL 84 Ca -0.02 -0.79 -0.11 0.00 -2.93 0.00 0.00 61.98 58.14 2ipi s VAL 84 Cb -0.12 -2.11 0.02 0.00 -1.53 0.00 0.00 36.38 32.64 2ipi s VAL 84 CO -0.07 0.55 0.20 0.27 -3.33 0.00 0.00 175.10 172.72 2ipi s ILE 85 N -0.04 4.57 -0.27 7.04 -0.00 -0.90 0.13 121.20 131.72 2ipi s ILE 85 Ca -0.04 -0.79 -0.10 0.00 -0.00 0.00 0.00 60.65 59.71 2ipi s ILE 85 Cb -0.14 -3.52 -0.05 0.00 -0.00 0.00 0.00 42.46 38.76 2ipi s ILE 85 CO 0.04 -0.19 0.17 -0.62 -0.00 0.00 0.00 174.94 174.34 2ipi s ASP 86 N 1.56 5.85 0.00 4.36 3.68 -0.56 -1.92 116.67 129.64 2ipi s ASP 86 Ca 0.02 -0.04 0.23 0.00 2.13 0.00 0.00 52.55 54.89 2ipi s ASP 86 Cb -0.19 -2.08 0.49 0.00 -1.45 0.00 0.00 42.92 39.69 2ipi s ASP 86 CO 0.07 -0.04 1.43 0.23 0.13 0.00 0.00 175.17 176.98 2ipi n MET 87 N 5.00 2.34 0.09 4.34 2.81 -0.15 -3.28 117.12 128.27 2ipi n MET 87 Ca -0.14 -2.02 0.08 0.00 -1.81 0.00 0.00 57.70 53.81 2ipi n MET 87 Cb 0.52 -1.49 0.38 0.00 -0.71 0.00 0.00 33.22 31.92 2ipi n MET 87 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2ipi n SER 88 N 1.24 0.36 -0.66 7.83 3.41 -1.26 -0.53 113.62 124.01 2ipi n SER 88 Ca 0.18 0.64 0.13 0.00 -0.26 0.00 0.00 58.87 59.57 2ipi n SER 88 Cb 0.55 -0.70 0.37 0.00 -0.26 0.00 0.00 64.21 64.16 2ipi n SER 88 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ipi n GLN 89 N -1.96 1.91 -3.44 4.33 1.13 -1.26 -4.63 117.38 113.46 2ipi n GLN 89 Ca 0.00 -1.32 -0.43 0.00 -1.94 0.00 0.00 57.00 53.31 2ipi n GLN 89 Cb 0.08 -1.47 -0.08 0.00 0.11 0.00 0.00 30.24 28.89 2ipi n GLN 89 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2ipi s MET 90 N -2.00 2.82 0.00 -1.09 -1.94 0.31 -4.89 119.30 112.51 2ipi s MET 90 Ca 0.34 -1.54 0.13 0.00 -1.71 0.00 0.00 55.69 52.91 2ipi s MET 90 Cb 0.21 -4.07 0.22 0.00 2.01 0.00 0.00 34.83 33.19 2ipi s MET 90 CO 0.32 -1.12 1.07 0.54 -0.01 0.00 0.00 175.02 175.82 2ipi n ARG 91 N 5.11 0.00 -1.38 2.03 1.74 -1.26 -1.78 116.66 121.12 2ipi n ARG 91 Ca -0.12 -1.46 -0.35 0.00 -0.77 0.00 0.00 57.85 55.15 2ipi n ARG 91 Cb 0.42 -0.18 0.10 0.00 -1.02 0.00 0.00 32.46 31.78 2ipi n ARG 91 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ipi n GLN 92 N 0.25 0.58 -3.77 5.56 6.02 -1.26 -4.65 117.38 120.12 2ipi n GLN 92 Ca 0.02 0.27 -0.14 0.00 -0.01 0.00 0.00 57.00 57.13 2ipi n GLN 92 Cb 0.92 -2.45 -0.15 0.00 1.02 0.00 0.00 30.24 29.58 2ipi n GLN 92 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2ipi s VAL 93 N -1.80 -0.05 0.00 5.09 1.01 -1.26 -2.45 120.40 120.93 2ipi s VAL 93 Ca 0.77 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 62.66 2ipi s VAL 93 Cb -0.33 -0.14 0.10 0.00 0.00 0.00 0.00 36.38 36.01 2ipi s VAL 93 CO 0.47 0.08 1.01 0.72 0.00 0.00 0.00 175.10 177.37 2ipi s PHE 94 N 1.07 -0.22 -0.16 5.22 -0.12 -0.95 -5.02 117.98 117.81 2ipi s PHE 94 Ca -0.09 0.06 -0.10 0.00 -0.05 0.00 0.00 56.93 56.75 2ipi s PHE 94 Cb -0.12 0.56 -0.05 0.00 -0.63 0.00 0.00 43.02 42.78 2ipi s PHE 94 CO -0.04 -0.52 0.18 -0.47 -0.05 0.00 0.00 175.22 174.32 2ipi s TYR 95 N -2.96 3.49 -0.17 3.49 5.04 -1.26 -0.51 117.35 124.47 2ipi s TYR 95 Ca 0.09 0.47 0.01 0.00 -2.44 0.00 0.00 57.07 55.20 2ipi s TYR 95 Cb -0.00 -2.15 0.02 0.00 0.35 0.00 0.00 41.96 40.18 2ipi s TYR 95 CO -0.05 0.41 -0.20 0.34 -1.34 0.00 0.00 175.55 174.71 2ipi s ASP 96 N -0.05 3.17 0.23 4.32 3.68 0.57 -4.95 116.67 123.64 2ipi s ASP 96 Ca 0.12 -0.62 -0.03 0.00 2.13 0.00 0.00 52.55 54.15 2ipi s ASP 96 Cb -0.12 -1.48 0.23 0.00 -1.45 0.00 0.00 42.92 40.10 2ipi s ASP 96 CO 0.01 0.03 1.65 0.77 0.13 0.00 0.00 175.17 177.76 2ipi h SER 97 N 7.73 0.73 -0.54 -0.34 4.64 -1.95 0.65 113.55 124.47 2ipi h SER 97 Ca -0.41 -0.26 0.06 0.00 -0.47 0.00 0.00 61.79 60.71 2ipi h SER 97 Cb 1.16 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 63.00 2ipi h SER 97 CO 0.61 0.94 0.26 1.23 -0.87 0.00 0.00 176.83 178.99 2ipi h GLY 98 N 0.98 0.76 1.60 -0.77 0.00 -1.95 -1.06 103.07 102.63 2ipi h GLY 98 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 2ipi h GLY 98 CO 0.06 0.09 -0.41 0.50 0.00 0.00 0.00 176.54 176.77 2ipi h LYS 99 N 0.49 0.00 -5.99 4.80 1.79 -1.96 -3.48 116.57 112.22 2ipi h LYS 99 Ca 0.25 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 58.32 2ipi h LYS 99 Cb 0.19 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 30.92 2ipi h LYS 99 CO -0.19 0.01 -0.83 -2.13 -1.08 0.00 0.00 179.45 175.23 2ipi n ARG 100 N -2.93 -4.96 -3.62 3.15 0.63 0.21 -4.97 116.66 104.16 2ipi n ARG 100 Ca 0.02 0.66 -0.08 0.00 -0.92 0.00 0.00 57.85 57.54 2ipi n ARG 100 Cb 0.54 -5.28 -0.02 0.00 0.45 0.00 0.00 32.46 28.15 2ipi n ARG 100 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ipi s ALA 101 N -3.60 -1.56 -0.19 5.13 0.00 -0.10 -4.90 121.76 116.54 2ipi s ALA 101 Ca 0.04 0.32 -0.20 0.00 0.00 0.00 0.00 51.96 52.12 2ipi s ALA 101 Cb -0.01 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 2ipi s ALA 101 CO 0.80 -0.88 0.57 -0.06 0.00 0.00 0.00 175.76 176.19 2ipi s PHE 102 N -3.56 3.39 -0.15 0.00 0.08 -0.60 -0.31 117.98 116.82 2ipi s PHE 102 Ca 0.07 0.86 -0.20 0.00 0.12 0.00 0.00 56.93 57.77 2ipi s PHE 102 Cb -0.02 -2.72 -0.03 0.00 -0.57 0.00 0.00 43.02 39.67 2ipi s PHE 102 CO -0.04 -0.11 0.60 0.00 -0.10 0.00 0.00 175.22 175.57 2ipi s ALA 103 N 1.66 3.49 -0.05 5.36 0.00 0.33 -1.41 121.76 131.13 2ipi s ALA 103 Ca 0.27 -0.19 0.02 0.00 0.00 0.00 0.00 51.96 52.06 2ipi s ALA 103 Cb -0.16 -2.88 0.02 0.00 0.00 0.00 0.00 23.12 20.11 2ipi s ALA 103 CO 0.10 -0.32 -0.08 0.14 0.00 0.00 0.00 175.76 175.59 2ipi s VAL 104 N 1.36 0.84 0.26 0.00 -7.23 -0.42 -2.25 120.40 112.96 2ipi s VAL 104 Ca 0.29 -0.30 -0.11 0.00 -1.81 0.00 0.00 61.98 60.05 2ipi s VAL 104 Cb -0.16 -0.80 -0.08 0.00 0.56 0.00 0.00 36.38 35.90 2ipi s VAL 104 CO 0.12 0.29 0.61 -1.61 -0.31 0.00 0.00 175.10 174.19 2ipi s GLU 105 N 0.79 3.86 0.36 4.82 2.02 -1.03 0.51 118.70 130.03 2ipi s GLU 105 Ca -0.13 0.40 0.27 0.00 0.02 0.00 0.00 54.97 55.53 2ipi s GLU 105 Cb -0.15 -2.58 1.12 0.00 0.10 0.00 0.00 34.13 32.62 2ipi s GLU 105 CO 0.02 0.27 1.81 -1.00 0.02 0.00 0.00 175.26 176.37 2ipi h PRO 106 N 2.46 0.00 -0.01 0.39 0.13 -1.76 -2.49 132.00 130.72 2ipi h PRO 106 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ipi h PRO 106 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2ipi h PRO 106 CO 0.68 0.00 -0.23 0.41 -0.23 0.00 0.00 178.00 178.63 2ipi n GLY 107 N 0.01 -0.63 3.73 1.56 0.00 -0.73 0.49 105.19 109.61 2ipi n GLY 107 Ca 0.02 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 2ipi n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ipi s ALA 108 N -2.49 3.33 0.64 4.61 0.00 -0.94 -4.73 121.76 122.19 2ipi s ALA 108 Ca 0.25 0.75 -0.12 0.00 0.00 0.00 0.00 51.96 52.84 2ipi s ALA 108 Cb 0.19 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 2ipi s ALA 108 CO 0.51 -0.20 1.04 -0.08 0.00 0.00 0.00 175.76 177.03 2ipi s THR 109 N 0.09 4.30 0.17 0.00 -1.32 -1.26 -0.79 115.64 116.83 2ipi s THR 109 Ca 0.50 0.80 -0.13 0.00 -1.21 0.00 0.00 61.69 61.66 2ipi s THR 109 Cb -0.27 -3.60 0.08 0.00 -1.51 0.00 0.00 72.50 67.19 2ipi s THR 109 CO 0.32 -0.92 1.79 -0.07 -2.21 0.00 0.00 174.62 173.53 2ipi h LEU 110 N -0.34 0.71 -0.77 9.08 3.38 -0.83 -2.04 115.31 124.50 2ipi h LEU 110 Ca -0.44 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.48 2ipi h LEU 110 Cb 1.20 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 2ipi h LEU 110 CO 0.59 0.59 0.48 1.23 0.09 0.00 0.00 178.44 181.43 2ipi h GLY 111 N 0.78 1.13 1.01 0.83 0.00 -1.50 -0.24 103.07 105.07 2ipi h GLY 111 Ca 0.20 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 2ipi h GLY 111 CO -0.03 0.29 0.48 0.83 0.00 0.00 0.00 176.54 178.11 2ipi h GLU 112 N 0.93 1.04 -0.02 4.80 5.08 -1.69 -0.47 114.58 124.25 2ipi h GLU 112 Ca 0.32 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 58.42 2ipi h GLU 112 Cb 0.06 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 2ipi h GLU 112 CO -0.13 0.72 -0.76 1.79 -1.00 0.00 0.00 179.01 179.63 2ipi h THR 113 N 1.06 1.46 -0.13 1.13 1.35 -0.93 -0.68 112.91 116.17 2ipi h THR 113 Ca 0.28 -2.39 -0.02 0.00 -0.55 0.00 0.00 66.41 63.73 2ipi h THR 113 Cb -0.07 2.29 -0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2ipi h THR 113 CO -0.06 0.70 -0.01 1.88 -0.25 0.00 0.00 175.52 177.78 2ipi h TYR 114 N 0.12 0.27 -0.67 4.73 0.99 -0.72 -0.00 116.97 121.68 2ipi h TYR 114 Ca -0.03 -0.05 -0.08 0.00 2.00 0.00 0.00 58.73 60.58 2ipi h TYR 114 Cb 1.34 -0.07 -0.03 0.00 1.00 0.00 0.00 36.73 38.98 2ipi h TYR 114 CO 0.02 0.49 0.10 0.07 -0.00 0.00 0.00 178.16 178.85 2ipi h ARG 115 N -0.03 1.11 0.18 4.88 0.11 -1.11 -2.32 114.38 117.20 2ipi h ARG 115 Ca 0.04 -0.30 -0.01 0.00 0.10 0.00 0.00 59.98 59.81 2ipi h ARG 115 Cb 0.39 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 31.34 2ipi h ARG 115 CO 0.01 1.01 -0.09 0.00 0.10 0.00 0.00 179.97 181.00 2ipi h ALA 116 N 1.07 -0.25 -0.80 0.08 0.00 -0.96 -1.89 119.26 116.51 2ipi h ALA 116 Ca 0.20 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2ipi h ALA 116 Cb 0.44 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2ipi h ALA 116 CO 0.01 -0.55 0.53 -0.07 0.00 0.00 0.00 179.25 179.17 2ipi h LEU 117 N -0.42 0.80 0.00 0.00 4.07 -0.98 -2.77 115.31 116.01 2ipi h LEU 117 Ca -0.03 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 2ipi h LEU 117 Cb 0.33 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.89 2ipi h LEU 117 CO 0.04 0.53 -0.00 0.22 -1.08 0.00 0.00 178.44 178.15 2ipi h TYR 118 N 0.92 -0.00 -0.59 1.13 3.20 -1.33 -2.66 116.97 117.64 2ipi h TYR 118 Ca 0.34 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.19 2ipi h TYR 118 Cb 0.16 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2ipi h TYR 118 CO -0.00 0.90 0.29 -0.07 -1.64 0.00 0.00 178.16 177.65 2ipi h LEU 119 N -1.00 0.74 0.03 2.82 3.38 -1.34 0.76 115.31 120.71 2ipi h LEU 119 Ca -0.00 -0.07 -0.26 0.00 0.09 0.00 0.00 57.88 57.64 2ipi h LEU 119 Cb 0.90 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2ipi h LEU 119 CO 0.00 0.62 -1.36 0.44 0.09 0.00 0.00 178.44 178.23 2ipi h ASP 120 N 0.83 0.11 0.00 -0.43 5.19 -1.60 -3.41 116.42 117.10 2ipi h ASP 120 Ca 0.21 -0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2ipi h ASP 120 Cb 0.07 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2ipi h ASP 120 CO -0.03 1.13 0.00 0.79 -3.12 0.00 0.00 179.24 178.01 2ipi n TRP 121 N -3.29 0.00 -1.11 4.55 8.01 -1.01 -5.03 117.44 119.55 2ipi n TRP 121 Ca -0.10 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.05 2ipi n TRP 121 Cb 1.00 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.29 2ipi n TRP 121 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2ipi n GLY 122 N 0.42 0.68 3.47 6.99 0.00 0.26 -4.67 105.19 112.35 2ipi n GLY 122 Ca 0.00 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 2ipi n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ipi s VAL 123 N -2.13 1.66 0.35 1.61 1.01 -1.17 -2.45 120.40 119.28 2ipi s VAL 123 Ca 0.00 -2.09 -0.03 0.00 0.00 0.00 0.00 61.98 59.86 2ipi s VAL 123 Cb 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.78 2ipi s VAL 123 CO 0.00 -0.19 0.49 -0.89 0.00 0.00 0.00 175.10 174.50 2ipi s THR 124 N -2.99 0.00 0.00 3.92 2.01 -0.91 -3.06 115.64 114.61 2ipi s THR 124 Ca 0.32 -1.58 0.05 0.00 0.31 0.00 0.00 61.69 60.79 2ipi s THR 124 Cb 0.05 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.89 2ipi s THR 124 CO 0.14 0.00 -0.17 0.27 -0.69 0.00 0.00 174.62 174.17 2ipi s ILE 125 N -3.00 1.31 -1.35 1.82 -4.36 -1.26 -3.83 121.20 110.52 2ipi s ILE 125 Ca 0.30 -0.80 -0.15 0.00 -0.26 0.00 0.00 60.65 59.74 2ipi s ILE 125 Cb -0.01 -1.11 0.01 0.00 1.25 0.00 0.00 42.46 42.60 2ipi s ILE 125 CO 0.20 0.29 2.19 -0.81 0.24 0.00 0.00 174.94 177.06 2ipi n PRO 126 N 2.47 2.64 -0.47 0.37 -0.04 -1.26 -4.88 135.00 133.82 2ipi n PRO 126 Ca -0.15 -2.47 0.00 0.00 -0.04 0.00 0.00 63.50 60.84 2ipi n PRO 126 Cb 0.54 -3.22 0.00 0.00 -0.04 0.00 0.00 33.50 30.78 2ipi n PRO 126 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ipi n ALA 127 N 6.28 0.00 -1.46 0.55 0.00 -1.26 -2.97 120.51 121.65 2ipi n ALA 127 Ca 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.83 2ipi n ALA 127 Cb 0.39 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.97 2ipi n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ipi n GLY 128 N 5.00 -1.61 0.09 0.00 0.00 -1.08 -2.00 105.19 105.59 2ipi n GLY 128 Ca 0.00 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 2ipi n GLY 128 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ipi h VAL 129 N -1.62 1.00 -3.42 1.61 2.07 -1.96 -3.46 116.25 110.47 2ipi h VAL 129 Ca -0.26 -2.78 -0.57 0.00 0.82 0.00 0.00 66.70 63.91 2ipi h VAL 129 Cb 0.73 2.55 -0.07 0.00 -1.52 0.00 0.00 31.29 32.99 2ipi h VAL 129 CO 0.18 0.67 0.85 0.00 0.02 0.00 0.00 177.57 179.29 2ipi h PRO 131 N 8.40 0.02 -0.00 0.00 0.11 -1.88 -2.31 132.00 136.34 2ipi h PRO 131 Ca -0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2ipi h PRO 131 Cb 1.06 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2ipi h PRO 131 CO 1.05 0.20 -0.10 0.94 -0.21 0.00 0.00 178.00 179.89 2ipi n GLN 132 N -4.32 0.81 -2.00 1.05 7.27 -1.26 -1.39 117.38 117.54 2ipi n GLN 132 Ca -0.02 -0.29 -0.39 0.00 0.07 0.00 0.00 57.00 56.37 2ipi n GLN 132 Cb 0.25 -1.49 0.01 0.00 2.41 0.00 0.00 30.24 31.41 2ipi n GLN 132 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2ipi s VAL 133 N -2.39 2.51 0.27 1.69 1.01 -0.87 -4.77 120.40 117.85 2ipi s VAL 133 Ca 0.31 0.42 -0.18 0.00 0.00 0.00 0.00 61.98 62.53 2ipi s VAL 133 Cb 0.20 -3.23 -0.09 0.00 0.00 0.00 0.00 36.38 33.27 2ipi s VAL 133 CO 0.45 0.03 0.74 -0.83 0.00 0.00 0.00 175.10 175.50 2ipi s GLY 134 N -0.92 2.51 0.12 4.51 0.00 -1.26 -1.19 107.32 111.10 2ipi s GLY 134 Ca 0.63 0.14 -0.19 0.00 0.00 0.00 0.00 44.72 45.30 2ipi s GLY 134 CO 0.46 0.44 1.78 -2.08 0.00 0.00 0.00 173.10 173.70 2ipi h VAL 135 N 2.44 1.07 -0.98 1.40 2.07 -0.81 -3.24 116.25 118.19 2ipi h VAL 135 Ca -0.48 -0.13 0.18 0.00 0.82 0.00 0.00 66.70 67.09 2ipi h VAL 135 Cb 1.19 0.74 -0.09 0.00 -1.52 0.00 0.00 31.29 31.60 2ipi h VAL 135 CO 0.65 0.06 0.61 1.23 0.02 0.00 0.00 177.57 180.15 2ipi h GLY 136 N 0.31 1.53 0.00 2.17 0.00 -0.21 -1.45 103.07 105.43 2ipi h GLY 136 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2ipi h GLY 136 CO -0.02 -0.00 -1.20 0.61 0.00 0.00 0.00 176.54 175.93 2ipi n GLY 137 N -1.38 -0.97 0.11 4.60 0.00 -1.24 -4.46 105.19 101.85 2ipi n GLY 137 Ca 0.21 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 2ipi n GLY 137 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2ipi h HIS 138 N 0.00 0.42 -0.33 1.61 6.17 -1.40 -3.38 115.15 118.24 2ipi h HIS 138 Ca 0.00 -0.31 -0.10 0.00 0.71 0.00 0.00 60.37 60.68 2ipi h HIS 138 Cb 0.60 -0.02 -0.01 0.00 2.52 0.00 0.00 27.41 30.50 2ipi h HIS 138 CO 0.00 1.36 -0.18 0.28 0.71 0.00 0.00 177.93 180.10 2ipi h VAL 139 N -0.46 1.29 0.00 5.26 2.07 -1.51 -2.72 116.25 120.18 2ipi h VAL 139 Ca -0.19 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2ipi h VAL 139 Cb 1.59 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.78 2ipi h VAL 139 CO 0.09 0.42 0.00 0.00 0.02 0.00 0.00 177.57 178.10 2ipi n LEU 140 N -4.33 0.00 -1.01 2.57 -0.00 -1.26 -0.71 117.00 112.26 2ipi n LEU 140 Ca -0.03 0.25 0.10 0.00 -0.00 0.00 0.00 56.01 56.34 2ipi n LEU 140 Cb 0.40 -0.25 0.27 0.00 -0.00 0.00 0.00 43.42 43.84 2ipi n LEU 140 CO 0.43 -0.10 0.72 0.61 -0.00 0.00 0.00 177.39 179.06 2ipi n GLY 141 N 0.31 1.47 2.50 1.47 0.00 -1.14 0.36 105.19 110.16 2ipi n GLY 141 Ca 0.10 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2ipi n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 142 N 1.40 -0.27 3.74 -0.02 0.00 0.12 -4.40 105.19 105.75 2ipi n GLY 142 Ca 0.19 0.21 -0.40 0.00 0.00 0.00 0.00 46.02 46.02 2ipi n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 143 N -1.34 0.85 3.37 -0.02 0.00 -1.04 -4.81 105.19 102.21 2ipi n GLY 143 Ca -0.04 0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2ipi n GLY 143 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ipi s TYR 144 N -1.22 1.93 0.00 1.61 1.13 -1.26 -1.50 117.35 118.04 2ipi s TYR 144 Ca 0.64 -0.46 0.00 0.00 -1.41 0.00 0.00 57.07 55.84 2ipi s TYR 144 Cb -0.45 -0.92 0.00 0.00 -1.10 0.00 0.00 41.96 39.50 2ipi s TYR 144 CO 0.55 0.44 0.00 0.41 -2.51 0.00 0.00 175.55 174.44 2ipi n GLY 145 N -0.09 2.29 0.49 5.49 0.00 -0.85 -2.63 105.19 109.89 2ipi n GLY 145 Ca -0.10 -1.05 0.31 0.00 0.00 0.00 0.00 46.02 45.18 2ipi n GLY 145 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ipi h PRO 146 N 0.00 0.00 -0.58 1.61 0.11 -1.88 -2.20 132.00 129.06 2ipi h PRO 146 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2ipi h PRO 146 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2ipi h PRO 146 CO 0.00 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.07 2ipi n LEU 147 N -4.17 4.89 0.14 2.35 4.77 -1.26 -4.35 117.00 119.37 2ipi n LEU 147 Ca 0.20 -2.62 0.06 0.00 -0.03 0.00 0.00 56.01 53.63 2ipi n LEU 147 Cb 1.06 -0.59 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 2ipi n LEU 147 CO 0.38 0.75 0.41 0.28 -1.33 0.00 0.00 177.39 177.89 2ipi h SER 148 N 3.77 0.00 1.58 -1.43 0.02 -1.50 0.92 113.55 116.91 2ipi h SER 148 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ipi h SER 148 Cb 1.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.11 2ipi h SER 148 CO 0.30 0.30 0.00 0.03 -1.14 0.00 0.00 176.83 176.31 2ipi h ARG 149 N 0.00 0.00 0.01 3.45 3.08 -1.76 0.92 114.38 120.08 2ipi h ARG 149 Ca -0.02 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.78 2ipi h ARG 149 Cb 1.25 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.26 2ipi h ARG 149 CO 0.03 0.00 -1.33 -2.13 -1.07 0.00 0.00 179.97 175.47 2ipi n ARG 150 N -2.92 0.58 0.00 0.04 0.63 -0.73 -2.15 116.66 112.11 2ipi n ARG 150 Ca 0.03 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.52 2ipi n ARG 150 Cb 0.44 -1.74 0.00 0.00 0.45 0.00 0.00 32.46 31.61 2ipi n ARG 150 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2ipi n ASP 151 N -4.38 0.81 0.00 6.15 8.00 0.31 -4.59 116.55 122.87 2ipi n ASP 151 Ca -0.33 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.26 2ipi n ASP 151 Cb 0.71 0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.97 2ipi n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ipi n GLY 152 N 0.17 -1.74 3.86 0.44 0.00 0.32 -4.89 105.19 103.34 2ipi n GLY 152 Ca 0.00 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 2ipi n GLY 152 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ipi s VAL 153 N 0.00 4.66 0.44 1.61 1.01 -1.26 -3.84 120.40 123.02 2ipi s VAL 153 Ca 0.00 0.94 0.17 0.00 0.00 0.00 0.00 61.98 63.09 2ipi s VAL 153 Cb 0.00 -3.78 0.36 0.00 0.00 0.00 0.00 36.38 32.96 2ipi s VAL 153 CO 0.00 -0.82 1.94 1.62 0.00 0.00 0.00 175.10 177.84 2ipi h VAL 154 N 0.51 0.81 0.00 2.92 3.04 -1.16 -1.68 116.25 120.68 2ipi h VAL 154 Ca -0.46 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.11 2ipi h VAL 154 Cb 1.19 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.88 2ipi h VAL 154 CO 0.62 0.07 0.00 0.00 -1.01 0.00 0.00 177.57 177.25 2ipi n ALA 155 N -2.54 2.31 1.06 3.17 0.00 -1.26 -1.91 120.51 121.34 2ipi n ALA 155 Ca 0.13 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.55 2ipi n ALA 155 Cb 0.51 -1.44 0.52 0.00 0.00 0.00 0.00 19.45 19.04 2ipi n ALA 155 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ipi n ASP 156 N -1.39 0.00 -0.10 0.00 8.00 -0.63 -1.84 116.55 120.60 2ipi n ASP 156 Ca 0.10 -0.35 0.05 0.00 0.71 0.00 0.00 54.79 55.30 2ipi n ASP 156 Cb 0.27 -0.11 0.07 0.00 -0.02 0.00 0.00 41.12 41.33 2ipi n ASP 156 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2ipi n HIS 157 N -1.11 0.00 -2.99 1.24 8.25 -0.80 -4.38 115.22 115.42 2ipi n HIS 157 Ca 0.12 -0.67 -0.42 0.00 -0.26 0.00 0.00 57.72 56.50 2ipi n HIS 157 Cb 0.10 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.05 2ipi n HIS 157 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2ipi s LEU 158 N -1.79 4.09 -0.15 2.41 2.96 -0.77 -0.88 118.68 124.55 2ipi s LEU 158 Ca 0.17 0.67 0.03 0.00 -0.22 0.00 0.00 54.13 54.78 2ipi s LEU 158 Cb 0.15 -3.01 -0.23 0.00 0.50 0.00 0.00 46.19 43.60 2ipi s LEU 158 CO 0.02 -0.54 0.23 0.00 -1.32 0.00 0.00 176.35 174.73 2ipi n TYR 159 N 6.05 0.69 -3.51 5.38 4.19 0.41 -4.85 117.16 125.53 2ipi n TYR 159 Ca 0.02 0.18 -0.11 0.00 3.31 0.00 0.00 57.90 61.30 2ipi n TYR 159 Cb 0.48 -1.10 -0.03 0.00 0.49 0.00 0.00 39.34 39.18 2ipi n TYR 159 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2ipi s ALA 160 N -2.55 -1.80 -0.06 2.98 0.00 -1.07 -1.82 121.76 117.45 2ipi s ALA 160 Ca -0.20 1.10 -0.05 0.00 0.00 0.00 0.00 51.96 52.81 2ipi s ALA 160 Cb 0.07 0.18 0.02 0.00 0.00 0.00 0.00 23.12 23.39 2ipi s ALA 160 CO 0.75 -0.57 0.15 0.54 0.00 0.00 0.00 175.76 176.63 2ipi s VAL 161 N -2.48 -0.00 -0.17 0.00 0.11 -0.38 -0.52 120.40 116.96 2ipi s VAL 161 Ca 0.00 0.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.90 2ipi s VAL 161 Cb -0.01 -0.22 -0.04 0.00 -1.53 0.00 0.00 36.38 34.58 2ipi s VAL 161 CO -0.04 0.00 0.41 -1.61 -3.33 0.00 0.00 175.10 170.53 2ipi s GLU 162 N 0.12 4.25 -0.01 1.54 2.02 -0.10 -1.91 118.70 124.61 2ipi s GLU 162 Ca -0.00 0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.28 2ipi s GLU 162 Cb -0.01 -3.48 -0.00 0.00 0.10 0.00 0.00 34.13 30.73 2ipi s GLU 162 CO -0.00 0.08 -0.07 0.08 0.02 0.00 0.00 175.26 175.36 2ipi s VAL 163 N 0.93 0.62 -0.28 2.63 1.01 -0.38 0.03 120.40 124.97 2ipi s VAL 163 Ca 0.21 -0.31 -0.14 0.00 0.00 0.00 0.00 61.98 61.74 2ipi s VAL 163 Cb -0.14 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 2ipi s VAL 163 CO 0.08 0.19 0.32 -0.69 0.00 0.00 0.00 175.10 175.00 2ipi s VAL 164 N -0.01 5.21 0.43 2.92 1.01 -0.36 -0.91 120.40 128.70 2ipi s VAL 164 Ca 0.00 0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.44 2ipi s VAL 164 Cb -0.05 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 2ipi s VAL 164 CO -0.00 0.15 0.06 0.68 0.00 0.00 0.00 175.10 175.99 2ipi s VAL 165 N 1.98 1.92 -0.09 2.92 -7.23 -0.65 -1.51 120.40 117.73 2ipi s VAL 165 Ca 0.12 -1.92 0.02 0.00 -1.81 0.00 0.00 61.98 58.40 2ipi s VAL 165 Cb -0.16 -2.83 0.01 0.00 0.56 0.00 0.00 36.38 33.96 2ipi s VAL 165 CO 0.10 0.00 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.07 2ipi s VAL 166 N -2.72 1.32 0.75 1.32 1.01 -1.25 -1.94 120.40 118.89 2ipi s VAL 166 Ca 0.31 -0.55 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 2ipi s VAL 166 Cb 0.07 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2ipi s VAL 166 CO 0.17 0.40 0.47 0.47 0.00 0.00 0.00 175.10 176.61 2ipi n ASP 167 N 4.11 -1.47 0.28 3.32 8.00 -0.27 -4.29 116.55 126.23 2ipi n ASP 167 Ca -0.20 0.55 0.11 0.00 0.71 0.00 0.00 54.79 55.97 2ipi n ASP 167 Cb 0.51 -1.20 0.76 0.00 -0.02 0.00 0.00 41.12 41.18 2ipi n ASP 167 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ipi h ALA 168 N -0.51 1.77 0.00 2.24 0.00 -1.93 -0.51 119.26 120.32 2ipi h ALA 168 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2ipi h ALA 168 Cb 1.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2ipi h ALA 168 CO 0.41 0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.54 2ipi n SER 169 N -4.21 0.53 0.00 0.00 3.41 -1.26 -4.89 113.62 107.20 2ipi n SER 169 Ca -0.03 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2ipi n SER 169 Cb 0.09 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2ipi n SER 169 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ipi n GLY 170 N 1.25 0.87 3.80 5.00 0.00 -0.20 -5.07 105.19 110.84 2ipi n GLY 170 Ca 0.06 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 2ipi n GLY 170 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ipi s ARG 171 N -0.58 3.89 0.20 1.61 3.52 -1.26 -4.81 118.95 121.51 2ipi s ARG 171 Ca 0.00 -0.08 -0.27 0.00 -0.13 0.00 0.00 55.73 55.25 2ipi s ARG 171 Cb 0.00 -3.32 -0.08 0.00 -1.56 0.00 0.00 34.95 29.99 2ipi s ARG 171 CO 0.00 0.50 0.84 0.00 -0.81 0.00 0.00 175.30 175.84 2ipi s ALA 172 N -0.27 3.40 0.09 6.12 0.00 -1.26 -1.11 121.76 128.73 2ipi s ALA 172 Ca 0.13 0.47 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 2ipi s ALA 172 Cb -0.12 -3.06 0.02 0.00 0.00 0.00 0.00 23.12 19.95 2ipi s ALA 172 CO 0.02 0.26 0.28 -0.98 0.00 0.00 0.00 175.76 175.35 2ipi s ARG 173 N -1.15 0.90 0.04 0.00 1.70 -0.82 -4.99 118.95 114.64 2ipi s ARG 173 Ca 0.38 -0.75 -0.18 0.00 -0.47 0.00 0.00 55.73 54.71 2ipi s ARG 173 Cb -0.24 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.46 2ipi s ARG 173 CO 0.29 -0.31 0.52 0.21 -1.08 0.00 0.00 175.30 174.93 2ipi s LYS 174 N -3.45 4.13 0.06 3.89 2.20 -1.26 -1.64 119.74 123.66 2ipi s LYS 174 Ca 0.01 0.64 0.03 0.00 -0.36 0.00 0.00 55.97 56.29 2ipi s LYS 174 Cb 0.02 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 33.07 2ipi s LYS 174 CO -0.09 0.63 -0.10 0.14 -0.36 0.00 0.00 175.35 175.57 2ipi s VAL 175 N -1.01 0.77 -0.08 4.02 -7.23 -0.08 -4.98 120.40 111.81 2ipi s VAL 175 Ca 0.27 -1.25 0.04 0.00 -1.81 0.00 0.00 61.98 59.23 2ipi s VAL 175 Cb -0.19 -0.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.86 2ipi s VAL 175 CO 0.17 -0.37 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.71 2ipi s VAL 176 N -1.55 2.61 -0.06 1.32 1.01 -1.26 -1.24 120.40 121.23 2ipi s VAL 176 Ca -0.05 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2ipi s VAL 176 Cb -0.09 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 34.29 2ipi s VAL 176 CO 0.01 0.56 -0.08 0.00 0.00 0.00 0.00 175.10 175.59 2ipi s ALA 177 N -0.17 0.99 0.15 5.51 0.00 -0.80 -4.86 121.76 122.57 2ipi s ALA 177 Ca -0.02 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 51.73 2ipi s ALA 177 Cb -0.14 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2ipi s ALA 177 CO 0.04 -0.00 -0.11 -0.08 0.00 0.00 0.00 175.76 175.61 2ipi s THR 178 N 0.90 1.23 -2.00 0.00 -1.32 -1.26 -1.25 115.64 111.93 2ipi s THR 178 Ca -0.11 -2.05 0.15 0.00 -1.21 0.00 0.00 61.69 58.48 2ipi s THR 178 Cb -0.15 -1.83 0.44 0.00 -1.51 0.00 0.00 72.50 69.45 2ipi s THR 178 CO 0.01 -0.71 1.42 -1.54 -2.21 0.00 0.00 174.62 171.59 2ipi n SER 179 N -0.15 0.00 -4.69 8.08 3.41 -0.75 -4.09 113.62 115.42 2ipi n SER 179 Ca -0.10 -1.01 -0.43 0.00 -0.26 0.00 0.00 58.87 57.07 2ipi n SER 179 Cb 0.60 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 2ipi n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ipi n ALA 180 N -0.82 2.23 -0.34 7.33 0.00 -1.26 -4.84 120.51 122.81 2ipi n ALA 180 Ca 0.12 0.34 0.29 0.00 0.00 0.00 0.00 53.44 54.19 2ipi n ALA 180 Cb 0.05 -2.56 0.61 0.00 0.00 0.00 0.00 19.45 17.56 2ipi n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ipi h ALA 181 N 7.95 2.62 -0.61 0.00 0.00 -2.02 0.17 119.26 127.37 2ipi h ALA 181 Ca -0.46 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2ipi h ALA 181 Cb 1.22 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2ipi h ALA 181 CO 0.95 -1.02 0.00 -0.40 0.00 0.00 0.00 179.25 178.77 2ipi n ASP 182 N -4.47 3.71 -4.71 0.00 3.85 -1.26 -4.95 116.55 108.73 2ipi n ASP 182 Ca 0.27 -1.99 -0.42 0.00 -0.71 0.00 0.00 54.79 51.94 2ipi n ASP 182 Cb 1.08 -0.41 -0.03 0.00 -1.35 0.00 0.00 41.12 40.41 2ipi n ASP 182 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2ipi s ASP 183 N -1.09 7.25 0.14 -1.12 -1.08 0.61 -4.93 116.67 116.45 2ipi s ASP 183 Ca 0.43 1.78 0.20 0.00 -0.52 0.00 0.00 52.55 54.45 2ipi s ASP 183 Cb 0.23 -2.57 0.84 0.00 -1.46 0.00 0.00 42.92 39.96 2ipi s ASP 183 CO 0.31 -0.36 1.63 -0.81 0.52 0.00 0.00 175.17 176.45 2ipi n PRO 184 N 4.06 0.11 -0.50 4.34 -0.04 -1.26 -2.31 135.00 139.40 2ipi n PRO 184 Ca 0.07 0.33 0.08 0.00 -0.04 0.00 0.00 63.50 63.94 2ipi n PRO 184 Cb 0.49 -1.71 0.28 0.00 -0.04 0.00 0.00 33.50 32.52 2ipi n PRO 184 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2ipi n ASN 185 N -1.92 4.11 0.08 3.54 3.02 -1.26 -4.66 115.26 118.17 2ipi n ASN 185 Ca 0.03 -2.92 0.14 0.00 -0.03 0.00 0.00 54.58 51.79 2ipi n ASN 185 Cb 0.22 -0.55 0.63 0.00 -0.61 0.00 0.00 39.78 39.48 2ipi n ASN 185 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2ipi h ARG 186 N 2.19 0.08 0.00 3.52 2.43 -1.61 -1.71 114.38 119.29 2ipi h ARG 186 Ca 0.00 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 2ipi h ARG 186 Cb 1.47 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.99 2ipi h ARG 186 CO 0.25 0.06 -0.47 0.93 -1.51 0.00 0.00 179.97 179.22 2ipi h GLU 187 N 0.09 0.00 -0.52 0.20 4.39 -1.86 -0.53 114.58 116.35 2ipi h GLU 187 Ca 0.16 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.78 2ipi h GLU 187 Cb 0.52 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2ipi h GLU 187 CO -0.01 0.47 -0.01 1.25 -1.16 0.00 0.00 179.01 179.55 2ipi h LEU 188 N 0.00 0.85 0.52 1.33 6.46 -1.69 -0.92 115.31 121.87 2ipi h LEU 188 Ca -0.00 -0.22 -0.03 0.00 -0.12 0.00 0.00 57.88 57.51 2ipi h LEU 188 Cb 0.99 -0.23 0.01 0.00 -0.73 0.00 0.00 40.66 40.70 2ipi h LEU 188 CO 0.06 0.92 -0.25 -0.25 -0.62 0.00 0.00 178.44 178.30 2ipi h TRP 189 N 0.81 -0.65 -0.87 1.25 7.01 -1.00 -3.08 115.95 119.43 2ipi h TRP 189 Ca 0.15 -0.02 0.18 0.00 2.11 0.00 0.00 58.89 61.32 2ipi h TRP 189 Cb 0.50 0.21 -0.16 0.00 -2.10 0.00 0.00 29.16 27.61 2ipi h TRP 189 CO 0.03 -0.35 -0.18 2.35 -2.79 0.00 0.00 178.44 177.50 2ipi h TRP 190 N -0.82 -0.40 -0.12 2.65 2.91 -0.97 0.21 115.95 119.42 2ipi h TRP 190 Ca -0.07 0.08 0.03 0.00 1.13 0.00 0.00 58.89 60.06 2ipi h TRP 190 Cb 0.59 0.31 -0.00 0.00 -0.51 0.00 0.00 29.16 29.54 2ipi h TRP 190 CO -0.02 -0.37 0.12 0.00 -1.03 0.00 0.00 178.44 177.15 2ipi h ALA 191 N 1.86 1.76 -0.26 2.65 0.00 -1.08 0.19 119.26 124.38 2ipi h ALA 191 Ca 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2ipi h ALA 191 Cb 0.68 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2ipi h ALA 191 CO -0.88 -0.18 0.00 0.72 0.00 0.00 0.00 179.25 178.91 2ipi n HIS 192 N -3.92 0.35 -1.88 0.00 8.25 0.73 -4.00 115.22 114.75 2ipi n HIS 192 Ca -0.00 -0.17 -0.33 0.00 -0.26 0.00 0.00 57.72 56.96 2ipi n HIS 192 Cb 0.23 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.38 2ipi n HIS 192 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2ipi n THR 193 N 0.44 3.13 0.00 1.59 5.66 0.67 -4.18 114.28 121.59 2ipi n THR 193 Ca 0.14 -4.01 0.00 0.00 -3.05 0.00 0.00 64.05 57.13 2ipi n THR 193 Cb 0.32 -1.20 0.00 0.00 -1.55 0.00 0.00 70.33 67.89 2ipi n THR 193 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ipi n GLY 194 N -0.68 3.12 2.76 1.09 0.00 -0.90 -1.55 105.19 109.03 2ipi n GLY 194 Ca 0.51 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2ipi n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 195 N -1.34 1.26 0.00 -0.02 0.00 -1.11 -4.74 105.19 99.24 2ipi n GLY 195 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ipi n GLY 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 196 N -2.00 -3.00 0.00 -0.02 0.00 0.16 -4.93 105.19 95.39 2ipi n GLY 196 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2ipi n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 197 N 0.00 0.00 4.08 -0.02 0.00 -1.26 -4.41 105.19 103.58 2ipi n GLY 197 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2ipi n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 198 N 0.00 -0.36 0.60 -0.02 0.00 -1.26 -4.92 105.19 99.24 2ipi n GLY 198 Ca 0.00 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 2ipi n GLY 198 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ipi n ASN 199 N -2.81 1.10 -0.62 1.61 3.02 -1.26 -3.86 115.26 112.44 2ipi n ASN 199 Ca -0.09 0.18 0.07 0.00 -0.03 0.00 0.00 54.58 54.71 2ipi n ASN 199 Cb 0.58 -0.43 0.10 0.00 -0.61 0.00 0.00 39.78 39.41 2ipi n ASN 199 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2ipi n PHE 200 N -3.70 0.17 0.00 3.10 3.72 -1.26 -4.56 117.46 114.94 2ipi n PHE 200 Ca -0.20 -0.15 0.00 0.00 -0.05 0.00 0.00 57.45 57.05 2ipi n PHE 200 Cb 0.54 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.08 2ipi n PHE 200 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ipi n GLY 201 N 0.76 0.85 3.51 1.37 0.00 -1.26 -4.71 105.19 105.70 2ipi n GLY 201 Ca 0.10 -2.14 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 2ipi n GLY 201 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ipi s ILE 202 N -0.99 5.08 -0.02 -0.61 1.01 -0.57 -4.79 121.20 120.32 2ipi s ILE 202 Ca 0.00 -0.23 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 2ipi s ILE 202 Cb 0.00 -3.58 -0.06 0.00 0.01 0.00 0.00 42.46 38.83 2ipi s ILE 202 CO 0.00 0.05 1.59 -0.69 0.00 0.00 0.00 174.94 175.88 2ipi s VAL 203 N 1.69 3.51 -0.43 2.92 1.01 -1.26 -1.23 120.40 126.61 2ipi s VAL 203 Ca 0.06 0.76 0.16 0.00 0.00 0.00 0.00 61.98 62.96 2ipi s VAL 203 Cb -0.17 -3.49 -0.21 0.00 0.00 0.00 0.00 36.38 32.51 2ipi s VAL 203 CO 0.09 -0.04 0.54 1.07 0.00 0.00 0.00 175.10 176.76 2ipi n THR 204 N 5.13 0.00 -3.64 3.92 5.66 0.10 -4.61 114.28 120.84 2ipi n THR 204 Ca 0.16 -0.24 -0.08 0.00 -3.05 0.00 0.00 64.05 60.84 2ipi n THR 204 Cb 0.42 0.61 -0.07 0.00 -1.55 0.00 0.00 70.33 69.74 2ipi n THR 204 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2ipi s ARG 205 N -2.80 0.50 0.18 1.09 3.52 -1.17 -4.36 118.95 115.92 2ipi s ARG 205 Ca 0.01 0.64 0.06 0.00 -0.13 0.00 0.00 55.73 56.31 2ipi s ARG 205 Cb 0.11 0.22 -0.04 0.00 -1.56 0.00 0.00 34.95 33.68 2ipi s ARG 205 CO 0.67 -0.07 0.07 0.71 -0.81 0.00 0.00 175.30 175.88 2ipi s TYR 206 N 0.46 2.99 -0.08 5.12 1.51 0.18 -0.92 117.35 126.62 2ipi s TYR 206 Ca 0.01 -0.08 0.01 0.00 -1.01 0.00 0.00 57.07 56.00 2ipi s TYR 206 Cb -0.05 -1.43 0.02 0.00 -0.11 0.00 0.00 41.96 40.39 2ipi s TYR 206 CO -0.08 0.52 -0.11 -1.58 -1.11 0.00 0.00 175.55 173.20 2ipi s TRP 207 N -1.79 1.45 0.01 2.71 0.52 0.32 -1.31 118.94 120.86 2ipi s TRP 207 Ca 0.30 -0.59 0.06 0.00 0.02 0.00 0.00 56.10 55.89 2ipi s TRP 207 Cb -0.09 -1.11 -0.03 0.00 -1.15 0.00 0.00 33.47 31.09 2ipi s TRP 207 CO 0.21 -0.35 -0.18 -0.06 0.02 0.00 0.00 176.95 176.59 2ipi s PHE 208 N 0.97 2.56 -0.30 -1.98 0.40 -0.50 -0.44 117.98 118.69 2ipi s PHE 208 Ca -0.09 -0.26 -0.16 0.00 -0.60 0.00 0.00 56.93 55.82 2ipi s PHE 208 Cb -0.15 -1.51 0.18 0.00 0.51 0.00 0.00 43.02 42.05 2ipi s PHE 208 CO 0.00 0.20 1.12 0.50 0.70 0.00 0.00 175.22 177.74 2ipi s ARG 209 N -1.15 0.20 0.36 0.44 3.00 -0.06 -1.56 118.95 120.16 2ipi s ARG 209 Ca 0.13 0.38 -0.28 0.00 -1.00 0.00 0.00 55.73 54.96 2ipi s ARG 209 Cb -0.10 0.11 -0.12 0.00 0.00 0.00 0.00 34.95 34.84 2ipi s ARG 209 CO 0.03 -0.05 1.42 2.41 0.00 0.00 0.00 175.30 179.11 2ipi n THR 210 N 3.84 1.93 -0.27 4.11 -1.04 -0.67 -4.49 114.28 117.67 2ipi n THR 210 Ca -0.15 -0.48 0.03 0.00 -2.04 0.00 0.00 64.05 61.41 2ipi n THR 210 Cb 0.56 -1.82 0.11 0.00 -1.82 0.00 0.00 70.33 67.36 2ipi n THR 210 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2ipi h PRO 211 N 2.93 0.01 -5.79 -2.82 0.11 -1.92 -3.28 132.00 121.24 2ipi h PRO 211 Ca -0.49 -0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.11 2ipi h PRO 211 Cb 1.26 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2ipi h PRO 211 CO 0.64 0.01 1.55 0.20 -0.21 0.00 0.00 178.00 180.19 2ipi s GLY 212 N -3.81 -0.05 -0.16 -0.55 0.00 -1.26 -4.84 107.32 96.65 2ipi s GLY 212 Ca -0.14 0.19 0.12 0.00 0.00 0.00 0.00 44.72 44.89 2ipi s GLY 212 CO 0.75 3.94 0.02 0.00 0.00 0.00 0.00 173.10 177.81 2ipi n ALA 213 N 14.14 1.62 -0.53 3.20 0.00 -1.24 -4.92 120.51 132.79 2ipi n ALA 213 Ca 0.33 -0.98 -0.19 0.00 0.00 0.00 0.00 53.44 52.60 2ipi n ALA 213 Cb 0.51 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.89 2ipi n ALA 213 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ipi n THR 214 N -2.64 0.49 0.00 0.00 -1.04 -1.26 -4.82 114.28 105.01 2ipi n THR 214 Ca -0.26 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 2ipi n THR 214 Cb 0.98 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.49 2ipi n THR 214 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ipi n GLY 215 N 0.67 0.79 0.85 3.41 0.00 -1.26 -4.72 105.19 104.93 2ipi n GLY 215 Ca 0.07 -1.81 0.11 0.00 0.00 0.00 0.00 46.02 44.39 2ipi n GLY 215 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ipi n THR 216 N 0.89 0.38 -2.76 2.61 -2.24 -1.26 -4.85 114.28 107.05 2ipi n THR 216 Ca 0.00 -0.55 -0.43 0.00 -2.27 0.00 0.00 64.05 60.81 2ipi n THR 216 Cb 0.00 0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 68.82 2ipi n THR 216 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ipi s ASP 217 N -1.47 6.32 0.47 3.42 -1.08 -1.26 -4.91 116.67 118.17 2ipi s ASP 217 Ca 0.35 -0.35 0.20 0.00 -0.52 0.00 0.00 52.55 52.23 2ipi s ASP 217 Cb 0.20 -2.47 1.20 0.00 -1.46 0.00 0.00 42.92 40.39 2ipi s ASP 217 CO 0.28 -1.37 1.96 -0.65 0.52 0.00 0.00 175.17 175.90 2ipi h PRO 218 N 9.47 0.23 0.00 4.34 0.11 -1.97 -2.09 132.00 142.08 2ipi h PRO 218 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2ipi h PRO 218 Cb 1.07 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2ipi h PRO 218 CO 1.14 0.15 0.00 0.43 -0.21 0.00 0.00 178.00 179.51 2ipi n SER 219 N -4.43 0.41 -1.00 -2.05 7.64 -1.26 -2.19 113.62 110.74 2ipi n SER 219 Ca 0.12 0.58 0.01 0.00 1.01 0.00 0.00 58.87 60.59 2ipi n SER 219 Cb 0.55 -0.68 0.22 0.00 -1.01 0.00 0.00 64.21 63.29 2ipi n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ipi n GLN 220 N -1.93 2.22 0.00 1.43 6.02 -0.79 -4.51 117.38 119.83 2ipi n GLN 220 Ca 0.04 -3.01 0.11 0.00 -0.01 0.00 0.00 57.00 54.13 2ipi n GLN 220 Cb 0.26 -1.81 0.06 0.00 1.02 0.00 0.00 30.24 29.76 2ipi n GLN 220 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2ipi n LEU 221 N -0.91 1.11 -3.78 1.08 4.77 -0.93 -4.86 117.00 113.49 2ipi n LEU 221 Ca 0.28 -0.41 -0.10 0.00 -0.03 0.00 0.00 56.01 55.75 2ipi n LEU 221 Cb 0.96 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.91 2ipi n LEU 221 CO 0.17 0.24 -0.01 -0.76 -1.33 0.00 0.00 177.39 175.70 2ipi s LEU 222 N -2.82 1.07 0.66 2.23 1.43 -1.26 -1.68 118.68 118.32 2ipi s LEU 222 Ca 0.13 -0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 52.57 2ipi s LEU 222 Cb 0.17 1.30 -0.00 0.00 0.03 0.00 0.00 46.19 47.69 2ipi s LEU 222 CO 0.72 -0.74 1.29 -2.65 0.23 0.00 0.00 176.35 175.20 2ipi n PRO 223 N 0.01 1.04 -2.92 1.29 -0.02 -1.25 -4.76 135.00 128.39 2ipi n PRO 223 Ca -0.16 0.41 -0.40 0.00 -2.02 0.00 0.00 63.50 61.34 2ipi n PRO 223 Cb 0.62 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.52 2ipi n PRO 223 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ipi s LYS 224 N -3.44 4.62 0.92 -0.52 1.02 -1.26 -2.13 119.74 118.94 2ipi s LYS 224 Ca 0.82 1.23 -0.11 0.00 0.02 0.00 0.00 55.97 57.93 2ipi s LYS 224 Cb -0.37 -3.30 0.15 0.00 -0.52 0.00 0.00 37.83 33.79 2ipi s LYS 224 CO 0.41 0.47 1.11 0.00 -0.92 0.00 0.00 175.35 176.42 2ipi s ALA 225 N -0.81 1.33 0.64 5.17 0.00 -1.03 -4.81 121.76 122.25 2ipi s ALA 225 Ca 0.38 0.32 -0.15 0.00 0.00 0.00 0.00 51.96 52.52 2ipi s ALA 225 Cb -0.23 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2ipi s ALA 225 CO 0.27 -2.67 1.08 -2.14 0.00 0.00 0.00 175.76 172.30 2ipi s PRO 226 N -4.71 3.01 0.22 0.00 0.02 -1.26 -4.94 135.00 127.34 2ipi s PRO 226 Ca 0.65 1.24 -0.08 0.00 0.02 0.00 0.00 61.00 62.84 2ipi s PRO 226 Cb -0.21 -1.99 0.31 0.00 0.02 0.00 0.00 34.50 32.63 2ipi s PRO 226 CO 0.58 -1.06 1.78 1.15 -0.33 0.00 0.00 177.00 179.13 2ipi h THR 227 N 0.06 0.87 -2.00 0.99 2.02 -1.94 -3.42 112.91 109.48 2ipi h THR 227 Ca -0.46 -0.21 0.28 0.00 0.77 0.00 0.00 66.41 66.79 2ipi h THR 227 Cb 1.23 0.21 -0.08 0.00 -1.74 0.00 0.00 68.15 67.77 2ipi h THR 227 CO 0.56 0.11 0.75 -0.94 0.37 0.00 0.00 175.52 176.37 2ipi s SER 228 N -5.51 -0.04 -0.20 4.18 1.04 -1.26 -4.30 113.70 107.61 2ipi s SER 228 Ca -0.13 -0.31 -0.02 0.00 0.48 0.00 0.00 55.95 55.97 2ipi s SER 228 Cb 0.17 0.27 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 2ipi s SER 228 CO 0.76 -0.53 -0.09 -0.89 0.98 0.00 0.00 173.24 173.47 2ipi s THR 229 N -2.36 3.09 -0.27 2.02 2.01 0.15 -1.44 115.64 118.84 2ipi s THR 229 Ca 0.20 -0.60 -0.13 0.00 0.31 0.00 0.00 61.69 61.47 2ipi s THR 229 Cb 0.01 -2.37 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 2ipi s THR 229 CO -0.00 0.46 0.29 -0.22 -0.69 0.00 0.00 174.62 174.46 2ipi s LEU 230 N 1.23 4.04 0.12 4.42 2.96 -0.84 0.11 118.68 130.70 2ipi s LEU 230 Ca 0.02 0.17 0.10 0.00 -0.22 0.00 0.00 54.13 54.20 2ipi s LEU 230 Cb -0.14 -2.29 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 2ipi s LEU 230 CO -0.03 -0.11 -0.25 -0.60 -1.32 0.00 0.00 176.35 174.03 2ipi s ARG 231 N 1.87 1.35 -0.15 1.98 3.52 0.16 -1.01 118.95 126.66 2ipi s ARG 231 Ca 0.11 -1.28 0.01 0.00 -0.13 0.00 0.00 55.73 54.44 2ipi s ARG 231 Cb -0.16 -1.76 0.02 0.00 -1.56 0.00 0.00 34.95 31.49 2ipi s ARG 231 CO 0.10 0.42 -0.16 -1.01 -0.81 0.00 0.00 175.30 173.84 2ipi s HIS 232 N -1.07 2.31 -0.37 5.12 3.76 0.45 -2.22 115.29 123.27 2ipi s HIS 232 Ca 0.12 -1.30 -0.06 0.00 -0.15 0.00 0.00 55.06 53.67 2ipi s HIS 232 Cb -0.10 -1.66 0.07 0.00 1.11 0.00 0.00 32.58 31.99 2ipi s HIS 232 CO 0.05 -0.68 0.16 -1.50 -0.85 0.00 0.00 174.74 171.92 2ipi s ILE 233 N 1.38 3.76 -0.15 0.60 2.07 -0.53 0.89 121.20 129.21 2ipi s ILE 233 Ca 0.04 -1.42 -0.15 0.00 -1.41 0.00 0.00 60.65 57.71 2ipi s ILE 233 Cb -0.13 -3.27 -0.05 0.00 0.13 0.00 0.00 42.46 39.14 2ipi s ILE 233 CO -0.10 -0.37 0.33 -0.69 -1.91 0.00 0.00 174.94 172.19 2ipi s VAL 234 N 1.35 5.28 0.06 4.00 1.01 -0.59 -0.74 120.40 130.77 2ipi s VAL 234 Ca 0.01 0.62 0.09 0.00 0.00 0.00 0.00 61.98 62.71 2ipi s VAL 234 Cb -0.21 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2ipi s VAL 234 CO 0.01 0.38 -0.24 -0.89 0.00 0.00 0.00 175.10 174.35 2ipi s THR 235 N 0.48 2.00 -0.09 3.92 2.01 0.38 -1.40 115.64 122.94 2ipi s THR 235 Ca 0.18 -1.42 0.00 0.00 0.31 0.00 0.00 61.69 60.77 2ipi s THR 235 Cb -0.13 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.67 2ipi s THR 235 CO 0.05 0.24 -0.07 0.26 -0.69 0.00 0.00 174.62 174.40 2ipi s TRP 236 N -0.88 1.31 0.36 4.92 0.51 -0.76 -2.10 118.94 122.30 2ipi s TRP 236 Ca 0.11 -0.57 -0.28 0.00 -2.12 0.00 0.00 56.10 53.23 2ipi s TRP 236 Cb -0.10 -1.09 -0.10 0.00 -0.81 0.00 0.00 33.47 31.37 2ipi s TRP 236 CO 0.03 -0.41 1.36 -0.51 -0.51 0.00 0.00 176.95 176.92 2ipi s ASP 237 N 1.42 6.57 0.47 2.95 1.11 -1.26 -1.53 116.67 126.40 2ipi s ASP 237 Ca -0.01 2.80 0.14 0.00 0.18 0.00 0.00 52.55 55.66 2ipi s ASP 237 Cb -0.13 -2.65 1.09 0.00 1.07 0.00 0.00 42.92 42.29 2ipi s ASP 237 CO -0.04 -0.68 2.06 -0.50 1.18 0.00 0.00 175.17 177.18 2ipi h TRP 238 N 3.17 0.04 0.00 4.23 4.06 0.18 -2.20 115.95 125.43 2ipi h TRP 238 Ca -0.50 -0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.40 2ipi h TRP 238 Cb 1.23 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.37 2ipi h TRP 238 CO 0.55 0.13 -0.23 0.66 -3.56 0.00 0.00 178.44 175.98 2ipi h SER 239 N 0.04 0.00 0.11 -3.49 4.64 -1.91 -2.73 113.55 110.22 2ipi h SER 239 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2ipi h SER 239 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2ipi h SER 239 CO 0.01 0.23 -0.87 0.00 -0.87 0.00 0.00 176.83 175.33 2ipi n ALA 240 N -2.39 4.46 -2.74 5.18 0.00 -0.85 -4.82 120.51 119.34 2ipi n ALA 240 Ca -0.02 -0.54 -0.36 0.00 0.00 0.00 0.00 53.44 52.52 2ipi n ALA 240 Cb 0.31 -0.85 -0.10 0.00 0.00 0.00 0.00 19.45 18.81 2ipi n ALA 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ipi s LEU 241 N -2.98 3.97 0.51 0.00 1.43 -1.03 -4.90 118.68 115.68 2ipi s LEU 241 Ca 0.09 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2ipi s LEU 241 Cb 0.16 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 2ipi s LEU 241 CO 0.82 0.07 0.02 -0.89 0.23 0.00 0.00 176.35 176.61 2ipi s THR 242 N 0.99 1.17 0.11 5.49 2.01 -1.26 -4.86 115.64 119.29 2ipi s THR 242 Ca 0.06 -1.97 -0.23 0.00 0.31 0.00 0.00 61.69 59.86 2ipi s THR 242 Cb -0.13 -2.14 -0.06 0.00 0.01 0.00 0.00 72.50 70.18 2ipi s THR 242 CO 0.04 0.00 1.40 -0.08 -0.69 0.00 0.00 174.62 175.28 2ipi h GLU 243 N 1.31 -0.06 -0.53 4.92 4.81 -1.98 1.30 114.58 124.35 2ipi h GLU 243 Ca -0.44 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 58.85 2ipi h GLU 243 Cb 1.32 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.64 2ipi h GLU 243 CO 0.73 -0.04 -0.43 0.93 -0.73 0.00 0.00 179.01 179.47 2ipi h GLU 244 N -0.06 -0.14 -0.46 1.92 5.08 -1.98 1.38 114.58 120.31 2ipi h GLU 244 Ca 0.10 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 2ipi h GLU 244 Cb 0.33 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2ipi h GLU 244 CO -0.63 -0.10 -0.06 0.00 -1.00 0.00 0.00 179.01 177.22 2ipi h ALA 245 N -0.12 0.63 0.10 3.43 0.00 -1.56 -2.81 119.26 118.93 2ipi h ALA 245 Ca 0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ipi h ALA 245 Cb 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ipi h ALA 245 CO -0.57 0.49 -0.05 0.35 0.00 0.00 0.00 179.25 179.47 2ipi h PHE 246 N 0.70 -0.12 -0.38 0.00 3.57 0.22 -3.13 116.94 117.80 2ipi h PHE 246 Ca 0.12 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.50 2ipi h PHE 246 Cb 0.59 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 2ipi h PHE 246 CO 0.04 0.01 -0.22 1.15 -2.23 0.00 0.00 178.31 177.07 2ipi h THR 247 N -0.23 1.28 -0.65 4.41 2.02 0.19 -2.18 112.91 117.75 2ipi h THR 247 Ca -0.01 -1.36 0.07 0.00 0.77 0.00 0.00 66.41 65.87 2ipi h THR 247 Cb 0.19 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 2ipi h THR 247 CO 0.02 0.45 0.43 0.03 0.37 0.00 0.00 175.52 176.83 2ipi h ARG 248 N 0.62 0.62 0.09 6.66 2.47 -1.58 -0.75 114.38 122.52 2ipi h ARG 248 Ca 0.08 -0.04 0.01 0.00 -1.26 0.00 0.00 59.98 58.77 2ipi h ARG 248 Cb 0.78 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 28.92 2ipi h ARG 248 CO 0.06 0.41 -0.46 0.82 0.56 0.00 0.00 179.97 181.37 2ipi h ILE 249 N 0.64 0.00 -0.71 2.04 2.04 -1.34 1.47 117.51 121.65 2ipi h ILE 249 Ca 0.28 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.20 2ipi h ILE 249 Cb 0.29 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.32 2ipi h ILE 249 CO -0.09 0.00 0.42 0.40 0.00 0.00 0.00 178.15 178.88 2ipi h ILE 250 N -0.64 1.00 -0.87 -0.67 1.08 -1.04 0.42 117.51 116.79 2ipi h ILE 250 Ca -0.00 -0.26 0.01 0.00 -0.39 0.00 0.00 64.86 64.21 2ipi h ILE 250 Cb 0.65 0.16 -0.04 0.00 -3.07 0.00 0.00 36.82 34.52 2ipi h ILE 250 CO -0.26 0.14 0.57 0.44 -0.69 0.00 0.00 178.15 178.35 2ipi h ASP 251 N 0.77 1.02 0.67 1.72 5.19 -0.85 -0.70 116.42 124.23 2ipi h ASP 251 Ca 0.31 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.66 2ipi h ASP 251 Cb 0.16 -0.25 0.01 0.00 0.18 0.00 0.00 39.33 39.43 2ipi h ASP 251 CO -0.17 0.75 -0.32 0.78 -3.12 0.00 0.00 179.24 177.15 2ipi h ASN 252 N 1.19 -0.76 -0.54 6.45 2.35 0.56 -3.01 115.58 121.82 2ipi h ASN 252 Ca 0.32 -0.01 0.11 0.00 -0.55 0.00 0.00 56.30 56.17 2ipi h ASN 252 Cb -0.12 0.20 -0.09 0.00 0.05 0.00 0.00 38.32 38.36 2ipi h ASN 252 CO -0.07 -0.42 0.03 -0.74 -1.65 0.00 0.00 177.43 174.59 2ipi h HIS 253 N -1.12 0.02 0.07 1.19 2.76 -0.19 -2.82 115.15 115.06 2ipi h HIS 253 Ca -0.09 0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.14 2ipi h HIS 253 Cb 0.72 0.07 -0.05 0.00 1.55 0.00 0.00 27.41 29.71 2ipi h HIS 253 CO -0.00 -0.10 -0.42 0.78 -1.30 0.00 0.00 177.93 176.89 2ipi h GLY 254 N 0.15 -0.81 1.66 5.26 0.00 -1.19 -2.30 103.07 105.84 2ipi h GLY 254 Ca 0.28 0.50 -0.03 0.00 0.00 0.00 0.00 47.33 48.08 2ipi h GLY 254 CO -0.43 -0.26 0.06 0.00 0.00 0.00 0.00 176.54 175.91 2ipi h ALA 255 N -0.11 1.54 -0.07 3.60 0.00 -1.40 0.24 119.26 123.07 2ipi h ALA 255 Ca 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2ipi h ALA 255 Cb 0.67 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2ipi h ALA 255 CO -0.27 0.34 0.02 2.35 0.00 0.00 0.00 179.25 181.70 2ipi h TRP 256 N 0.43 0.10 0.00 0.00 7.01 -1.27 -2.21 115.95 120.02 2ipi h TRP 256 Ca 0.10 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.03 2ipi h TRP 256 Cb 0.19 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 2ipi h TRP 256 CO 0.01 0.24 -0.29 0.45 -2.79 0.00 0.00 178.44 176.05 2ipi h HIS 257 N -0.07 0.00 0.00 2.65 3.86 -1.09 0.59 115.15 121.09 2ipi h HIS 257 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2ipi h HIS 257 Cb 0.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.65 2ipi h HIS 257 CO -0.01 0.29 0.00 0.37 0.86 0.00 0.00 177.93 179.44 2ipi h GLN 258 N 0.00 0.00 0.03 2.45 4.15 -0.55 -1.56 115.11 119.63 2ipi h GLN 258 Ca -0.00 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.07 2ipi h GLN 258 Cb 0.54 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.18 2ipi h GLN 258 CO 0.04 0.00 -2.14 0.43 -1.93 0.00 0.00 178.83 175.23 2ipi n SER 259 N -2.65 1.13 -1.03 -0.69 7.64 -0.35 -4.35 113.62 113.33 2ipi n SER 259 Ca 0.02 0.13 0.11 0.00 1.01 0.00 0.00 58.87 60.14 2ipi n SER 259 Cb 0.29 -0.00 0.17 0.00 -1.01 0.00 0.00 64.21 63.66 2ipi n SER 259 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2ipi n ASN 260 N -3.10 3.22 -2.93 6.43 5.03 0.05 -4.83 115.26 119.12 2ipi n ASN 260 Ca -0.31 -1.96 -0.25 0.00 0.87 0.00 0.00 54.58 52.93 2ipi n ASN 260 Cb 1.07 -0.17 -0.03 0.00 -1.02 0.00 0.00 39.78 39.63 2ipi n ASN 260 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2ipi n SER 261 N 1.36 3.74 -4.46 6.41 2.88 -0.59 -4.16 113.62 118.79 2ipi n SER 261 Ca 0.17 -3.54 -0.23 0.00 -1.33 0.00 0.00 58.87 53.94 2ipi n SER 261 Cb 0.57 -0.56 -0.10 0.00 -0.75 0.00 0.00 64.21 63.37 2ipi n SER 261 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ipi s ALA 262 N -3.28 2.65 -0.19 -1.46 0.00 -1.26 -4.16 121.76 114.07 2ipi s ALA 262 Ca 0.47 -1.88 -0.31 0.00 0.00 0.00 0.00 51.96 50.24 2ipi s ALA 262 Cb 0.31 -0.19 0.14 0.00 0.00 0.00 0.00 23.12 23.39 2ipi s ALA 262 CO -0.13 0.21 1.12 0.00 0.00 0.00 0.00 175.76 176.96 2ipi s ALA 263 N -2.61 -2.00 -0.44 0.00 0.00 -1.26 -4.82 121.76 110.64 2ipi s ALA 263 Ca 0.29 1.62 0.09 0.00 0.00 0.00 0.00 51.96 53.96 2ipi s ALA 263 Cb -0.03 -0.74 0.40 0.00 0.00 0.00 0.00 23.12 22.74 2ipi s ALA 263 CO 0.14 -0.37 0.97 0.41 0.00 0.00 0.00 175.76 176.92 2ipi n GLY 264 N 0.46 4.55 3.67 0.00 0.00 -1.26 -3.37 105.19 109.24 2ipi n GLY 264 Ca -0.06 -2.28 -0.30 0.00 0.00 0.00 0.00 46.02 43.38 2ipi n GLY 264 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ipi s THR 265 N -4.25 1.52 0.13 2.61 -4.23 -1.26 -5.01 115.64 105.15 2ipi s THR 265 Ca 0.42 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.73 2ipi s THR 265 Cb 0.37 -2.59 -0.03 0.00 1.34 0.00 0.00 72.50 71.60 2ipi s THR 265 CO -0.11 0.00 1.69 -0.65 -0.54 0.00 0.00 174.62 175.01 2ipi h PRO 266 N 1.60 -0.07 0.00 3.99 0.11 -1.99 -2.07 132.00 133.57 2ipi h PRO 266 Ca -0.43 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2ipi h PRO 266 Cb 1.28 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2ipi h PRO 266 CO 0.76 -0.05 0.00 1.88 -0.21 0.00 0.00 178.00 180.38 2ipi h TYR 267 N -0.08 0.00 0.00 0.65 0.05 -1.96 0.22 116.97 115.85 2ipi h TYR 267 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.87 2ipi h TYR 267 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 2ipi h TYR 267 CO -0.23 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 176.88 2ipi h ALA 268 N 2.06 1.00 -0.10 3.88 0.00 -1.67 -1.09 119.26 123.35 2ipi h ALA 268 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ipi h ALA 268 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2ipi h ALA 268 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.68 2ipi n SER 269 N -2.54 2.55 -4.83 0.00 7.64 0.78 -1.78 113.62 115.44 2ipi n SER 269 Ca -0.01 -1.84 -0.38 0.00 1.01 0.00 0.00 58.87 57.66 2ipi n SER 269 Cb 0.11 -0.05 -0.06 0.00 -1.01 0.00 0.00 64.21 63.20 2ipi n SER 269 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2ipi s MET 270 N -1.90 3.91 0.13 1.43 0.00 -0.41 -3.80 119.30 118.65 2ipi s MET 270 Ca 0.33 0.36 0.07 0.00 0.00 0.00 0.00 55.69 56.46 2ipi s MET 270 Cb 0.20 -3.23 -0.04 0.00 0.00 0.00 0.00 34.83 31.76 2ipi s MET 270 CO 0.31 0.67 -0.17 -1.58 0.00 0.00 0.00 175.02 174.24 2ipi s HIS 271 N -0.96 1.65 0.15 4.11 2.46 -0.42 -4.88 115.29 117.39 2ipi s HIS 271 Ca 0.23 -0.48 -0.15 0.00 0.47 0.00 0.00 55.06 55.13 2ipi s HIS 271 Cb -0.16 -0.86 0.02 0.00 -0.13 0.00 0.00 32.58 31.45 2ipi s HIS 271 CO 0.12 0.23 0.40 -1.54 -2.47 0.00 0.00 174.74 171.49 2ipi s SER 272 N -2.37 -0.17 -0.04 9.88 1.04 -1.26 -0.76 113.70 120.02 2ipi s SER 272 Ca 0.10 -0.50 -0.01 0.00 0.48 0.00 0.00 55.95 56.03 2ipi s SER 272 Cb -0.07 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.57 2ipi s SER 272 CO 0.05 -0.92 0.02 -0.69 0.98 0.00 0.00 173.24 172.68 2ipi s VAL 273 N -3.86 0.14 -0.49 5.02 1.01 -0.51 -1.65 120.40 120.06 2ipi s VAL 273 Ca 0.08 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 62.08 2ipi s VAL 273 Cb 0.01 -0.30 0.07 0.00 0.00 0.00 0.00 36.38 36.17 2ipi s VAL 273 CO -0.07 0.18 0.50 0.12 0.00 0.00 0.00 175.10 175.83 2ipi s PHE 274 N 1.58 3.17 -0.83 5.22 5.99 -0.27 -0.67 117.98 132.17 2ipi s PHE 274 Ca -0.02 -0.82 -0.25 0.00 0.00 0.00 0.00 56.93 55.84 2ipi s PHE 274 Cb -0.13 -3.38 0.05 0.00 0.00 0.00 0.00 43.02 39.56 2ipi s PHE 274 CO -0.03 -0.92 1.28 0.71 -0.00 0.00 0.00 175.22 176.27 2ipi s TYR 275 N 2.03 2.45 -1.35 10.12 1.51 0.32 -1.36 117.35 131.06 2ipi s TYR 275 Ca 0.08 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 55.57 2ipi s TYR 275 Cb -0.23 -4.59 0.09 0.00 -0.11 0.00 0.00 41.96 37.12 2ipi s TYR 275 CO 0.08 -1.95 1.93 1.28 -1.11 0.00 0.00 175.55 175.78 2ipi n LEU 276 N 8.87 6.08 -4.76 -1.29 4.77 -0.64 -0.82 117.00 129.21 2ipi n LEU 276 Ca 0.12 -4.21 -0.35 0.00 -0.03 0.00 0.00 56.01 51.54 2ipi n LEU 276 Cb 0.49 -1.65 0.04 0.00 -2.33 0.00 0.00 43.42 39.97 2ipi n LEU 276 CO 0.67 0.84 0.80 0.20 -1.33 0.00 0.00 177.39 178.58 2ipi s ASN 277 N 3.00 5.19 1.25 -1.43 0.01 -1.26 -3.31 114.94 118.40 2ipi s ASN 277 Ca 0.47 2.25 -0.17 0.00 -0.71 0.00 0.00 52.86 54.70 2ipi s ASN 277 Cb 0.08 -2.58 0.31 0.00 0.41 0.00 0.00 41.25 39.47 2ipi s ASN 277 CO -0.01 -1.58 1.01 -0.44 -1.51 0.00 0.00 177.10 174.56 2ipi s SER 278 N -1.90 0.35 -0.14 -1.22 0.01 -1.03 -4.68 113.70 105.08 2ipi s SER 278 Ca 0.74 1.14 -0.03 0.00 1.31 0.00 0.00 55.95 59.10 2ipi s SER 278 Cb -0.26 -1.72 -0.06 0.00 0.21 0.00 0.00 66.02 64.18 2ipi s SER 278 CO 0.35 -4.54 2.82 -1.14 0.41 0.00 0.00 173.24 171.14 2ipi n ARG 279 N -5.11 1.81 0.00 12.44 0.63 0.25 -2.22 116.66 124.46 2ipi n ARG 279 Ca 0.07 -1.13 0.00 0.00 -0.92 0.00 0.00 57.85 55.88 2ipi n ARG 279 Cb 0.57 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.75 2ipi n ARG 279 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ipi n ALA 280 N 1.60 1.05 0.13 5.13 0.00 -1.26 -4.66 120.51 122.49 2ipi n ALA 280 Ca 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.76 2ipi n ALA 280 Cb 0.69 0.05 0.10 0.00 0.00 0.00 0.00 19.45 20.29 2ipi n ALA 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ipi h ALA 281 N 0.00 0.74 0.00 0.00 0.00 -1.78 -3.48 119.26 114.75 2ipi h ALA 281 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2ipi h ALA 281 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ipi h ALA 281 CO 0.00 0.78 0.00 0.41 0.00 0.00 0.00 179.25 180.44 2ipi n GLY 282 N 0.76 2.75 3.20 0.00 0.00 -1.25 -5.01 105.19 105.64 2ipi n GLY 282 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 2ipi n GLY 282 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ipi s GLN 283 N 0.00 0.84 -0.14 1.61 -2.07 -1.26 0.19 119.66 118.84 2ipi s GLN 283 Ca 0.00 -1.02 -0.04 0.00 -1.82 0.00 0.00 55.36 52.49 2ipi s GLN 283 Cb 0.00 0.33 -0.03 0.00 -1.09 0.00 0.00 33.01 32.22 2ipi s GLN 283 CO 0.00 -0.26 -0.02 0.96 -1.32 0.00 0.00 175.29 174.65 2ipi s ILE 284 N -3.88 4.05 -0.02 3.63 -4.36 -0.58 -4.12 121.20 115.91 2ipi s ILE 284 Ca 0.07 -0.31 0.08 0.00 -0.26 0.00 0.00 60.65 60.22 2ipi s ILE 284 Cb 0.05 -2.76 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 2ipi s ILE 284 CO -0.10 0.51 -0.25 -0.22 0.24 0.00 0.00 174.94 175.12 2ipi s LEU 285 N 0.10 2.05 -0.30 0.37 0.20 -0.00 -1.83 118.68 119.27 2ipi s LEU 285 Ca 0.00 -0.46 -0.04 0.00 0.69 0.00 0.00 54.13 54.32 2ipi s LEU 285 Cb -0.13 -1.31 0.03 0.00 -0.43 0.00 0.00 46.19 44.35 2ipi s LEU 285 CO 0.02 0.31 0.03 -0.22 -0.29 0.00 0.00 176.35 176.20 2ipi s LEU 286 N -0.58 3.82 -0.37 -0.68 0.20 -0.49 0.12 118.68 120.70 2ipi s LEU 286 Ca 0.09 -1.02 -0.12 0.00 0.69 0.00 0.00 54.13 53.77 2ipi s LEU 286 Cb -0.10 -1.77 0.01 0.00 -0.43 0.00 0.00 46.19 43.90 2ipi s LEU 286 CO -0.01 -0.23 0.23 -0.62 -0.29 0.00 0.00 176.35 175.43 2ipi s ASP 287 N 1.36 5.85 -0.05 3.68 3.68 0.16 -1.54 116.67 129.81 2ipi s ASP 287 Ca -0.01 -0.80 0.05 0.00 2.13 0.00 0.00 52.55 53.92 2ipi s ASP 287 Cb -0.18 -2.07 -0.01 0.00 -1.45 0.00 0.00 42.92 39.21 2ipi s ASP 287 CO -0.00 -0.35 -0.21 0.27 0.13 0.00 0.00 175.17 175.01 2ipi s ILE 288 N 1.62 1.74 0.14 4.11 -4.36 0.26 -1.43 121.20 123.28 2ipi s ILE 288 Ca 0.04 -0.89 0.02 0.00 -0.26 0.00 0.00 60.65 59.57 2ipi s ILE 288 Cb -0.18 -1.48 -0.04 0.00 1.25 0.00 0.00 42.46 42.00 2ipi s ILE 288 CO 0.08 0.49 -0.04 0.00 0.24 0.00 0.00 174.94 175.71 2ipi s GLN 289 N -0.03 1.01 0.10 0.37 -2.07 0.06 0.17 119.66 119.27 2ipi s GLN 289 Ca -0.05 -1.45 -0.24 0.00 -1.82 0.00 0.00 55.36 51.80 2ipi s GLN 289 Cb -0.13 -0.32 0.06 0.00 -1.09 0.00 0.00 33.01 31.53 2ipi s GLN 289 CO 0.03 -0.05 0.59 -1.50 -1.32 0.00 0.00 175.29 173.04 2ipi s ILE 290 N -3.58 0.01 -0.19 3.63 2.07 -0.18 -1.30 121.20 121.66 2ipi s ILE 290 Ca 0.18 -0.08 -0.28 0.00 -1.41 0.00 0.00 60.65 59.06 2ipi s ILE 290 Cb 0.05 -1.01 -0.05 0.00 0.13 0.00 0.00 42.46 41.58 2ipi s ILE 290 CO 0.00 -0.05 2.09 -0.62 -1.91 0.00 0.00 174.94 174.45 2ipi s ASP 291 N -2.32 5.73 0.00 4.50 2.15 -1.25 -2.00 116.67 123.49 2ipi s ASP 291 Ca -0.02 1.92 0.00 0.00 0.43 0.00 0.00 52.55 54.88 2ipi s ASP 291 Cb -0.01 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 2ipi s ASP 291 CO -0.07 -1.74 0.69 0.61 -0.17 0.00 0.00 175.17 174.49 2ipi n GLY 292 N 5.45 -0.38 0.23 2.66 0.00 -0.52 -2.61 105.19 110.03 2ipi n GLY 292 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.36 2ipi n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 293 N 0.24 -0.19 3.87 -0.02 0.00 -1.26 -4.84 105.19 102.98 2ipi n GLY 293 Ca 0.00 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 2ipi n GLY 293 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ipi s LEU 294 N -2.29 3.88 0.52 0.99 0.05 -1.07 -4.99 118.68 115.77 2ipi s LEU 294 Ca 0.11 1.17 -0.20 0.00 0.05 0.00 0.00 54.13 55.25 2ipi s LEU 294 Cb 0.12 -4.03 -0.09 0.00 -2.05 0.00 0.00 46.19 40.15 2ipi s LEU 294 CO 0.49 -0.35 0.76 0.47 -0.55 0.00 0.00 176.35 177.16 2ipi n ASP 295 N -1.08 -0.01 -4.25 1.48 8.00 -1.26 -2.25 116.55 117.18 2ipi n ASP 295 Ca 0.03 0.85 -0.38 0.00 0.71 0.00 0.00 54.79 56.00 2ipi n ASP 295 Cb 0.54 -1.26 -0.07 0.00 -0.02 0.00 0.00 41.12 40.30 2ipi n ASP 295 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ipi n GLY 296 N 1.51 -0.34 0.22 0.44 0.00 -1.26 -4.85 105.19 100.91 2ipi n GLY 296 Ca 0.12 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 2ipi n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ipi h ALA 297 N 0.97 -0.49 -0.82 4.61 0.00 -1.80 -0.03 119.26 121.71 2ipi h ALA 297 Ca -0.55 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.28 2ipi h ALA 297 Cb 1.26 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.18 2ipi h ALA 297 CO 0.80 -0.67 0.53 1.49 0.00 0.00 0.00 179.25 181.40 2ipi h GLU 298 N -0.69 0.81 0.25 0.00 4.22 -1.89 -2.12 114.58 115.16 2ipi h GLU 298 Ca -0.05 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.33 2ipi h GLU 298 Cb 0.49 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2ipi h GLU 298 CO 0.08 0.53 -0.12 0.00 -2.18 0.00 0.00 179.01 177.32 2ipi h ALA 299 N 1.57 -0.34 0.00 2.92 0.00 -1.89 -0.87 119.26 120.66 2ipi h ALA 299 Ca 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2ipi h ALA 299 Cb 0.33 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2ipi h ALA 299 CO -0.14 -0.66 -0.05 1.37 0.00 0.00 0.00 179.25 179.78 2ipi h LEU 300 N -0.41 0.00 0.04 0.00 8.10 -0.37 -1.84 115.31 120.82 2ipi h LEU 300 Ca -0.03 0.00 -0.14 0.00 0.11 0.00 0.00 57.88 57.82 2ipi h LEU 300 Cb 0.31 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.54 2ipi h LEU 300 CO 0.06 0.05 -0.57 -0.07 -4.11 0.00 0.00 178.44 173.79 2ipi h LEU 301 N 0.00 0.43 -1.88 0.17 4.07 -0.87 -2.36 115.31 114.88 2ipi h LEU 301 Ca -0.00 -0.83 -0.02 0.00 0.08 0.00 0.00 57.88 57.11 2ipi h LEU 301 Cb 0.31 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.91 2ipi h LEU 301 CO 0.01 1.21 -0.09 -0.55 -1.08 0.00 0.00 178.44 177.94 2ipi h ASN 302 N -0.29 0.00 -0.30 -0.43 7.08 -0.90 -1.55 115.58 119.18 2ipi h ASN 302 Ca -0.08 0.00 -0.06 0.00 -3.08 0.00 0.00 56.30 53.08 2ipi h ASN 302 Cb 1.33 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.56 2ipi h ASN 302 CO 0.11 0.09 -0.03 0.44 -2.08 0.00 0.00 177.43 175.96 2ipi h ASP 303 N 0.00 0.55 0.10 6.14 5.19 -1.26 0.72 116.42 127.86 2ipi h ASP 303 Ca -0.00 -0.33 -0.00 0.00 -0.62 0.00 0.00 57.03 56.07 2ipi h ASP 303 Cb 0.38 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.74 2ipi h ASP 303 CO 0.01 0.75 -0.05 0.15 -3.12 0.00 0.00 179.24 176.98 2ipi h PHE 304 N 0.34 -0.13 0.00 4.55 -0.00 -0.86 0.28 116.94 121.12 2ipi h PHE 304 Ca 0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.05 2ipi h PHE 304 Cb 0.49 0.04 0.00 0.00 -0.00 0.00 0.00 35.95 36.48 2ipi h PHE 304 CO 0.04 -0.08 0.00 -0.39 -0.00 0.00 0.00 178.31 177.88 2ipi h VAL 305 N -0.14 0.00 0.00 1.41 -1.51 -1.27 0.56 116.25 115.30 2ipi h VAL 305 Ca -0.01 -0.34 -0.03 0.00 -1.23 0.00 0.00 66.70 65.09 2ipi h VAL 305 Cb 0.11 1.22 -0.00 0.00 -2.13 0.00 0.00 31.29 30.48 2ipi h VAL 305 CO 0.02 0.00 -0.16 0.00 -1.23 0.00 0.00 177.57 176.19 2ipi h ALA 306 N 2.09 0.89 0.04 5.19 0.00 -0.03 -3.16 119.26 124.28 2ipi h ALA 306 Ca 0.00 -0.15 -0.27 0.00 0.00 0.00 0.00 54.91 54.49 2ipi h ALA 306 Cb 0.38 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2ipi h ALA 306 CO 0.00 0.20 -1.41 0.00 0.00 0.00 0.00 179.25 178.04 2ipi h ALA 307 N 1.84 0.46 -0.41 0.00 0.00 0.12 -3.35 119.26 117.90 2ipi h ALA 307 Ca -0.00 -1.16 -0.11 0.00 0.00 0.00 0.00 54.91 53.64 2ipi h ALA 307 Cb 1.12 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2ipi h ALA 307 CO 0.02 1.32 -0.17 0.28 0.00 0.00 0.00 179.25 180.70 2ipi h VAL 308 N 0.02 1.28 -0.59 0.00 2.07 -1.34 -3.16 116.25 114.53 2ipi h VAL 308 Ca -0.18 -1.30 -0.19 0.00 0.82 0.00 0.00 66.70 65.85 2ipi h VAL 308 Cb 1.93 1.24 -0.11 0.00 -1.52 0.00 0.00 31.29 32.83 2ipi h VAL 308 CO 0.12 0.44 0.24 -3.20 0.02 0.00 0.00 177.57 175.20 2ipi n ASN 309 N -4.24 4.09 0.25 0.57 5.15 -1.20 -4.43 115.26 115.44 2ipi n ASN 309 Ca -0.01 -2.95 -0.17 0.00 -0.60 0.00 0.00 54.58 50.84 2ipi n ASN 309 Cb 0.41 -0.70 -0.09 0.00 -0.53 0.00 0.00 39.78 38.87 2ipi n ASN 309 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 2ipi h GLU 310 N 1.90 -0.89 -0.01 1.20 4.81 -1.68 -3.03 114.58 116.88 2ipi h GLU 310 Ca 0.24 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 2ipi h GLU 310 Cb 2.01 0.20 0.00 0.00 0.63 0.00 0.00 28.75 31.59 2ipi h GLU 310 CO 0.60 -0.59 0.00 0.41 -0.73 0.00 0.00 179.01 178.70 2ipi n GLY 311 N -1.54 -0.85 3.83 1.92 0.00 -1.26 -4.90 105.19 102.39 2ipi n GLY 311 Ca -0.11 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 2ipi n GLY 311 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ipi s THR 312 N -1.99 4.12 -1.68 2.61 2.01 -1.15 -4.94 115.64 114.63 2ipi s THR 312 Ca 0.36 0.69 0.17 0.00 0.31 0.00 0.00 61.69 63.22 2ipi s THR 312 Cb 0.17 -3.50 0.02 0.00 0.01 0.00 0.00 72.50 69.19 2ipi s THR 312 CO 0.28 -0.90 0.92 0.61 -0.69 0.00 0.00 174.62 174.85 2ipi n GLY 313 N -2.24 0.04 3.72 4.40 0.00 -1.26 -4.98 105.19 104.87 2ipi n GLY 313 Ca 0.07 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 2ipi n GLY 313 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ipi s VAL 314 N -1.92 4.53 -0.32 1.61 -7.23 -1.26 -5.08 120.40 110.73 2ipi s VAL 314 Ca 0.15 -0.21 -0.09 0.00 -1.81 0.00 0.00 61.98 60.02 2ipi s VAL 314 Cb 0.14 -2.94 -0.00 0.00 0.56 0.00 0.00 36.38 34.14 2ipi s VAL 314 CO 0.40 0.57 0.15 -0.70 -0.31 0.00 0.00 175.10 175.22 2ipi s GLU 315 N -1.02 3.24 0.75 4.82 2.12 -1.26 -5.06 118.70 122.29 2ipi s GLU 315 Ca 0.15 -0.78 -0.14 0.00 0.36 0.00 0.00 54.97 54.56 2ipi s GLU 315 Cb -0.11 -3.56 0.05 0.00 0.26 0.00 0.00 34.13 30.76 2ipi s GLU 315 CO 0.04 -0.46 1.16 -1.25 -0.54 0.00 0.00 175.26 174.21 2ipi s PRO 316 N 1.59 2.14 0.05 4.30 0.04 -1.26 -5.01 135.00 136.85 2ipi s PRO 316 Ca 0.04 1.56 -0.20 0.00 0.04 0.00 0.00 61.00 62.43 2ipi s PRO 316 Cb -0.17 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 2ipi s PRO 316 CO 0.06 -1.79 0.60 0.00 0.04 0.00 0.00 177.00 175.90 2ipi s ALA 317 N -2.30 3.54 -0.03 8.56 0.00 -0.89 -4.90 121.76 125.74 2ipi s ALA 317 Ca 0.70 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.74 2ipi s ALA 317 Cb -0.24 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.18 2ipi s ALA 317 CO 0.48 0.30 -0.06 0.08 0.00 0.00 0.00 175.76 176.55 2ipi s VAL 318 N -0.77 0.60 -0.08 0.00 1.01 -1.26 -0.47 120.40 119.44 2ipi s VAL 318 Ca 0.30 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.07 2ipi s VAL 318 Cb -0.19 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2ipi s VAL 318 CO 0.19 0.21 -0.18 -1.10 0.00 0.00 0.00 175.10 174.22 2ipi s GLN 319 N 0.37 2.33 0.15 2.72 1.11 0.08 -4.98 119.66 121.44 2ipi s GLN 319 Ca -0.05 -0.63 0.09 0.00 0.01 0.00 0.00 55.36 54.78 2ipi s GLN 319 Cb -0.09 -1.83 -0.04 0.00 -1.01 0.00 0.00 33.01 30.03 2ipi s GLN 319 CO 0.00 0.09 -0.13 1.03 0.01 0.00 0.00 175.29 176.29 2ipi s ARG 320 N 0.54 1.94 -0.06 2.91 0.52 -1.26 -1.45 118.95 122.09 2ipi s ARG 320 Ca -0.16 -1.24 -0.18 0.00 -0.52 0.00 0.00 55.73 53.63 2ipi s ARG 320 Cb -0.17 -2.13 0.04 0.00 0.52 0.00 0.00 34.95 33.21 2ipi s ARG 320 CO 0.06 0.45 0.41 -1.54 0.02 0.00 0.00 175.30 174.70 2ipi s SER 321 N -2.55 -0.35 -0.15 0.23 1.04 -0.94 -4.99 113.70 106.00 2ipi s SER 321 Ca 0.22 0.40 0.01 0.00 0.48 0.00 0.00 55.95 57.06 2ipi s SER 321 Cb -0.09 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.54 2ipi s SER 321 CO 0.13 -0.41 -0.16 0.28 0.98 0.00 0.00 173.24 174.06 2ipi s THR 322 N -0.92 1.72 0.16 2.02 -1.32 -1.25 0.37 115.64 116.42 2ipi s THR 322 Ca -0.10 -0.74 0.03 0.00 -1.21 0.00 0.00 61.69 59.68 2ipi s THR 322 Cb -0.04 -1.58 -0.05 0.00 -1.51 0.00 0.00 72.50 69.33 2ipi s THR 322 CO 0.04 0.48 -0.05 -1.61 -2.21 0.00 0.00 174.62 171.27 2ipi s GLU 323 N 1.30 1.08 0.52 7.08 8.01 0.12 -4.94 118.70 131.87 2ipi s GLU 323 Ca 0.02 -1.49 -0.22 0.00 0.01 0.00 0.00 54.97 53.28 2ipi s GLU 323 Cb -0.13 -0.47 -0.06 0.00 -4.31 0.00 0.00 34.13 29.16 2ipi s GLU 323 CO -0.09 -0.02 1.34 -2.14 0.01 0.00 0.00 175.26 174.36 2ipi s PRO 324 N -3.82 3.32 0.06 0.39 0.02 -1.26 0.32 135.00 134.02 2ipi s PRO 324 Ca 0.20 2.20 -0.31 0.00 0.02 0.00 0.00 61.00 63.11 2ipi s PRO 324 Cb 0.04 -2.35 -0.18 0.00 0.02 0.00 0.00 34.50 32.04 2ipi s PRO 324 CO 0.02 -1.04 1.52 2.35 -0.33 0.00 0.00 177.00 179.52 2ipi h TRP 325 N 1.69 -0.73 -0.91 6.54 7.01 -1.82 -2.05 115.95 125.68 2ipi h TRP 325 Ca -0.51 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 60.53 2ipi h TRP 325 Cb 1.29 0.24 -0.06 0.00 -2.10 0.00 0.00 29.16 28.53 2ipi h TRP 325 CO 0.48 -0.42 0.59 1.25 -2.79 0.00 0.00 178.44 177.54 2ipi h LEU 326 N -0.87 0.92 -0.12 0.65 5.85 -1.92 0.52 115.31 120.35 2ipi h LEU 326 Ca -0.08 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.66 2ipi h LEU 326 Cb 0.63 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2ipi h LEU 326 CO 0.13 0.60 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.72 2ipi h ARG 327 N 1.05 0.01 -0.58 1.25 2.43 -1.89 0.38 114.38 117.03 2ipi h ARG 327 Ca 0.38 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.50 2ipi h ARG 327 Cb 0.16 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 2ipi h ARG 327 CO -0.14 0.01 0.17 0.00 -1.51 0.00 0.00 179.97 178.50 2ipi h ALA 328 N 1.11 1.20 0.00 2.80 0.00 -1.04 -2.98 119.26 120.35 2ipi h ALA 328 Ca 0.05 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2ipi h ALA 328 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2ipi h ALA 328 CO -0.11 0.56 -0.28 1.15 0.00 0.00 0.00 179.25 180.57 2ipi h THR 329 N 0.86 0.77 -0.53 0.00 2.02 0.88 -2.99 112.91 113.91 2ipi h THR 329 Ca 0.19 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 66.21 2ipi h THR 329 Cb 0.27 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2ipi h THR 329 CO -0.01 0.27 0.00 0.18 0.37 0.00 0.00 175.52 176.34 2ipi n LEU 330 N -3.59 3.26 -4.66 2.58 4.77 0.13 -4.82 117.00 114.67 2ipi n LEU 330 Ca -0.01 -1.64 -0.50 0.00 -0.03 0.00 0.00 56.01 53.83 2ipi n LEU 330 Cb 0.41 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 2ipi n LEU 330 CO 0.34 0.70 1.23 0.00 -1.33 0.00 0.00 177.39 178.33 2ipi n ALA 331 N 1.00 0.42 -1.20 -1.18 0.00 -1.13 -4.82 120.51 113.59 2ipi n ALA 331 Ca 0.19 0.41 -0.19 0.00 0.00 0.00 0.00 53.44 53.85 2ipi n ALA 331 Cb 0.56 -2.31 -0.10 0.00 0.00 0.00 0.00 19.45 17.60 2ipi n ALA 331 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2ipi n ASN 332 N 4.40 5.87 0.00 0.00 2.04 -1.26 -4.56 115.26 121.76 2ipi n ASN 332 Ca 0.20 -2.84 0.03 0.00 -0.44 0.00 0.00 54.58 51.53 2ipi n ASN 332 Cb 0.24 -1.31 0.16 0.00 -2.53 0.00 0.00 39.78 36.35 2ipi n ASN 332 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2ipi n LYS 333 N 1.61 0.47 -2.62 -3.83 5.02 -1.26 -3.77 118.16 113.78 2ipi n LYS 333 Ca 0.43 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.47 2ipi n LYS 333 Cb 0.72 -1.18 -0.01 0.00 -0.02 0.00 0.00 35.03 34.54 2ipi n LYS 333 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2ipi n PHE 334 N -0.68 3.27 -3.14 2.13 3.01 -1.26 -5.01 117.46 115.78 2ipi n PHE 334 Ca 0.04 -3.31 -0.39 0.00 1.01 0.00 0.00 57.45 54.80 2ipi n PHE 334 Cb 0.02 -0.21 -0.05 0.00 -0.01 0.00 0.00 39.48 39.23 2ipi n PHE 334 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2ipi s ASP 335 N -3.46 6.77 0.09 4.37 2.15 -1.25 -4.97 116.67 120.38 2ipi s ASP 335 Ca 0.46 0.94 0.00 0.00 0.43 0.00 0.00 52.55 54.38 2ipi s ASP 335 Cb 0.38 -2.35 -0.25 0.00 -0.30 0.00 0.00 42.92 40.39 2ipi s ASP 335 CO -0.16 -0.17 1.17 0.00 -0.17 0.00 0.00 175.17 175.84 2ipi h THR 336 N 4.96 1.55 -5.67 1.71 1.03 -1.95 -3.49 112.91 111.06 2ipi h THR 336 Ca -0.36 -3.18 -0.31 0.00 -0.01 0.00 0.00 66.41 62.55 2ipi h THR 336 Cb 1.17 2.89 0.16 0.00 -1.07 0.00 0.00 68.15 71.30 2ipi h THR 336 CO 0.77 0.91 -0.84 0.61 -0.01 0.00 0.00 175.52 176.96 2ipi n GLY 337 N 1.47 -0.84 2.93 2.99 0.00 -1.26 -3.05 105.19 107.43 2ipi n GLY 337 Ca -0.06 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2ipi n GLY 337 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 338 N -1.30 2.50 2.83 -0.02 0.00 -1.26 -4.90 105.19 103.03 2ipi n GLY 338 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2ipi n GLY 338 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ipi n PHE 339 N -2.00 2.63 0.44 1.61 3.72 -1.17 -4.48 117.46 118.21 2ipi n PHE 339 Ca 0.00 -2.70 0.12 0.00 -0.05 0.00 0.00 57.45 54.82 2ipi n PHE 339 Cb 0.00 -1.64 0.20 0.00 -0.94 0.00 0.00 39.48 37.09 2ipi n PHE 339 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2ipi n ASP 340 N 2.37 3.40 -4.62 4.37 3.85 -1.19 -4.60 116.55 120.13 2ipi n ASP 340 Ca 0.39 -2.00 -0.40 0.00 -0.71 0.00 0.00 54.79 52.08 2ipi n ASP 340 Cb 0.33 -0.20 -0.08 0.00 -1.35 0.00 0.00 41.12 39.81 2ipi n ASP 340 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 2ipi s ARG 341 N -1.59 4.07 0.05 0.11 0.52 -0.28 0.16 118.95 121.99 2ipi s ARG 341 Ca 0.37 0.29 0.00 0.00 -0.52 0.00 0.00 55.73 55.87 2ipi s ARG 341 Cb 0.22 -3.65 -0.03 0.00 0.52 0.00 0.00 34.95 32.01 2ipi s ARG 341 CO 0.32 -0.33 -0.04 0.95 0.02 0.00 0.00 175.30 176.22 2ipi s THR 342 N 2.23 0.32 -0.00 0.02 -4.23 -1.26 -0.58 115.64 112.14 2ipi s THR 342 Ca 0.20 -1.53 0.03 0.00 -1.18 0.00 0.00 61.69 59.21 2ipi s THR 342 Cb -0.16 -1.13 -0.01 0.00 1.34 0.00 0.00 72.50 72.54 2ipi s THR 342 CO 0.09 -0.78 -0.08 -0.75 -0.54 0.00 0.00 174.62 172.56 2ipi s LYS 343 N -3.02 0.66 0.11 3.99 2.47 -0.95 -4.94 119.74 118.06 2ipi s LYS 343 Ca 0.00 -0.31 -0.13 0.00 -1.56 0.00 0.00 55.97 53.97 2ipi s LYS 343 Cb 0.01 -0.63 0.02 0.00 -1.46 0.00 0.00 37.83 35.76 2ipi s LYS 343 CO -0.06 0.17 0.30 -1.54 0.16 0.00 0.00 175.35 174.39 2ipi s SER 344 N -0.25 -0.07 -0.28 1.43 1.04 -1.26 -2.84 113.70 111.47 2ipi s SER 344 Ca 0.03 -0.48 -0.21 0.00 0.48 0.00 0.00 55.95 55.76 2ipi s SER 344 Cb -0.03 0.41 0.11 0.00 0.10 0.00 0.00 66.02 66.60 2ipi s SER 344 CO -0.00 -0.80 0.88 -1.59 0.98 0.00 0.00 173.24 172.71 2ipi s LYS 345 N -3.83 0.59 0.00 4.02 -2.85 -0.82 -4.68 119.74 112.18 2ipi s LYS 345 Ca 0.04 0.83 0.00 0.00 -1.00 0.00 0.00 55.97 55.84 2ipi s LYS 345 Cb 0.03 0.22 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 2ipi s LYS 345 CO -0.11 -0.09 0.00 0.41 0.10 0.00 0.00 175.35 175.66 2ipi n GLY 346 N 3.07 6.59 3.62 0.59 0.00 -1.26 -0.83 105.19 116.97 2ipi n GLY 346 Ca -0.16 -1.81 -0.06 0.00 0.00 0.00 0.00 46.02 43.99 2ipi n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ipi s ALA 347 N -2.00 -2.05 -0.28 4.61 0.00 -0.78 -4.80 121.76 116.46 2ipi s ALA 347 Ca 0.00 1.76 -0.08 0.00 0.00 0.00 0.00 51.96 53.64 2ipi s ALA 347 Cb 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 23.12 21.88 2ipi s ALA 347 CO 0.00 -0.26 0.10 0.71 0.00 0.00 0.00 175.76 176.32 2ipi s TYR 348 N -0.92 3.14 -0.22 0.00 2.02 -0.13 -0.68 117.35 120.55 2ipi s TYR 348 Ca 0.04 -0.62 -0.11 0.00 -0.37 0.00 0.00 57.07 56.01 2ipi s TYR 348 Cb -0.01 -2.29 -0.05 0.00 -0.40 0.00 0.00 41.96 39.21 2ipi s TYR 348 CO -0.05 -0.45 0.20 -0.51 -1.57 0.00 0.00 175.55 173.17 2ipi s LEU 349 N 1.59 4.14 0.20 -1.29 1.43 -0.28 -0.64 118.68 123.83 2ipi s LEU 349 Ca 0.05 0.21 0.24 0.00 -1.03 0.00 0.00 54.13 53.60 2ipi s LEU 349 Cb -0.16 -2.18 0.34 0.00 0.03 0.00 0.00 46.19 44.22 2ipi s LEU 349 CO 0.04 0.06 1.38 0.03 0.23 0.00 0.00 176.35 178.09 2ipi h ARG 350 N 7.32 0.00 -4.49 1.70 3.08 -0.78 -1.46 114.38 119.74 2ipi h ARG 350 Ca -0.38 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.45 2ipi h ARG 350 Cb 1.17 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.07 2ipi h ARG 350 CO 0.69 0.00 -0.59 0.15 -1.07 0.00 0.00 179.97 179.14 2ipi s LYS 351 N -3.21 1.16 0.79 0.04 1.02 -1.11 -4.47 119.74 113.96 2ipi s LYS 351 Ca 0.06 -1.56 -0.12 0.00 0.02 0.00 0.00 55.97 54.37 2ipi s LYS 351 Cb 0.11 0.28 0.07 0.00 -0.52 0.00 0.00 37.83 37.77 2ipi s LYS 351 CO 0.71 -0.38 1.14 -2.14 -0.92 0.00 0.00 175.35 173.76 2ipi s PRO 352 N -4.12 1.90 0.60 -1.68 0.02 -1.26 -4.94 135.00 125.51 2ipi s PRO 352 Ca 0.34 1.45 -0.19 0.00 0.02 0.00 0.00 61.00 62.62 2ipi s PRO 352 Cb 0.07 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.71 2ipi s PRO 352 CO 0.09 -1.95 1.08 0.91 -0.33 0.00 0.00 177.00 176.80 2ipi n TRP 353 N -3.44 1.23 -2.37 6.54 7.02 -1.26 -5.02 117.44 120.13 2ipi n TRP 353 Ca 0.11 0.44 -0.25 0.00 -1.02 0.00 0.00 57.50 56.78 2ipi n TRP 353 Cb 0.52 -2.19 0.09 0.00 -2.42 0.00 0.00 31.31 27.31 2ipi n TRP 353 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2ipi s THR 354 N -1.45 2.28 0.17 -0.99 -1.32 -1.26 -4.84 115.64 108.23 2ipi s THR 354 Ca 0.76 -0.42 -0.19 0.00 -1.21 0.00 0.00 61.69 60.64 2ipi s THR 354 Cb -0.41 -2.86 0.11 0.00 -1.51 0.00 0.00 72.50 67.82 2ipi s THR 354 CO 0.46 0.00 1.62 0.00 -2.21 0.00 0.00 174.62 174.50 2ipi h ALA 355 N -0.57 0.07 -0.61 11.08 0.00 -1.98 0.13 119.26 127.38 2ipi h ALA 355 Ca -0.41 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2ipi h ALA 355 Cb 1.29 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 19.58 2ipi h ALA 355 CO 0.50 -0.58 0.26 0.00 0.00 0.00 0.00 179.25 179.43 2ipi h ALA 356 N 1.11 0.79 -0.09 0.00 0.00 -1.99 -0.32 119.26 118.77 2ipi h ALA 356 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ipi h ALA 356 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ipi h ALA 356 CO -0.51 0.39 0.04 1.96 0.00 0.00 0.00 179.25 181.12 2ipi h GLN 357 N 0.84 0.13 0.00 0.00 4.20 -1.80 -2.71 115.11 115.78 2ipi h GLN 357 Ca 0.21 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 2ipi h GLN 357 Cb 0.17 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 2ipi h GLN 357 CO -0.02 0.23 -0.12 0.00 -0.67 0.00 0.00 178.83 178.25 2ipi h ALA 358 N 0.89 1.79 -0.29 3.87 0.00 -0.20 -1.22 119.26 124.10 2ipi h ALA 358 Ca 0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 2ipi h ALA 358 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ipi h ALA 358 CO -0.00 0.15 -0.52 0.00 0.00 0.00 0.00 179.25 178.88 2ipi h ALA 359 N 1.88 0.45 -0.41 0.00 0.00 -1.02 -2.61 119.26 117.56 2ipi h ALA 359 Ca -0.00 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 2ipi h ALA 359 Cb 0.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2ipi h ALA 359 CO 0.02 0.65 0.11 1.15 0.00 0.00 0.00 179.25 181.18 2ipi h THR 360 N 0.65 1.22 -0.53 0.00 2.02 -0.93 -2.19 112.91 113.16 2ipi h THR 360 Ca 0.02 -0.75 0.07 0.00 0.77 0.00 0.00 66.41 66.52 2ipi h THR 360 Cb 1.13 0.94 -0.10 0.00 -1.74 0.00 0.00 68.15 68.38 2ipi h THR 360 CO 0.12 0.26 -0.50 0.25 0.37 0.00 0.00 175.52 176.02 2ipi h LEU 361 N 0.52 -1.71 -0.25 2.58 5.85 -1.28 -1.87 115.31 119.15 2ipi h LEU 361 Ca 0.13 0.25 0.03 0.00 0.84 0.00 0.00 57.88 59.13 2ipi h LEU 361 Cb 0.28 0.74 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2ipi h LEU 361 CO -0.00 -0.36 0.06 0.22 -0.34 0.00 0.00 178.44 178.02 2ipi h TYR 362 N -0.29 0.10 -0.18 1.25 5.03 -1.27 -2.39 116.97 119.22 2ipi h TYR 362 Ca 0.13 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.45 2ipi h TYR 362 Cb 0.57 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.83 2ipi h TYR 362 CO -0.74 0.04 0.08 0.00 -1.32 0.00 0.00 178.16 176.22 2ipi h ARG 363 N 0.16 0.24 0.04 1.82 3.08 -0.76 0.59 114.38 119.56 2ipi h ARG 363 Ca 0.11 -0.02 -0.27 0.00 0.07 0.00 0.00 59.98 59.87 2ipi h ARG 363 Cb 0.10 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2ipi h ARG 363 CO -0.14 0.20 -1.43 0.45 -1.07 0.00 0.00 179.97 177.98 2ipi h HIS 364 N 0.25 0.17 0.05 3.04 3.86 -1.14 -3.00 115.15 118.39 2ipi h HIS 364 Ca 0.06 -0.13 -0.25 0.00 -1.16 0.00 0.00 60.37 58.90 2ipi h HIS 364 Cb 0.04 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 2ipi h HIS 364 CO 0.00 1.15 -1.20 -0.07 0.86 0.00 0.00 177.93 178.67 2ipi h LEU 365 N 0.03 0.18 -0.70 2.43 3.38 -0.92 -3.34 115.31 116.37 2ipi h LEU 365 Ca -0.19 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2ipi h LEU 365 Cb 1.94 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 2ipi h LEU 365 CO 0.12 1.17 0.44 -1.28 0.09 0.00 0.00 178.44 178.98 2ipi h SER 366 N 0.03 0.82 -3.94 -0.43 0.87 0.11 0.73 113.55 111.74 2ipi h SER 366 Ca -0.10 -0.04 -0.52 0.00 -1.23 0.00 0.00 61.79 59.89 2ipi h SER 366 Cb 1.88 -0.21 0.08 0.00 -0.44 0.00 0.00 62.40 63.72 2ipi h SER 366 CO 0.15 0.62 0.60 0.00 -0.53 0.00 0.00 176.83 177.67 2ipi s ALA 367 N -6.06 3.25 -1.00 6.23 0.00 -1.13 -4.57 121.76 118.47 2ipi s ALA 367 Ca -0.13 1.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.99 2ipi s ALA 367 Cb 0.14 -3.47 0.15 0.00 0.00 0.00 0.00 23.12 19.94 2ipi s ALA 367 CO 0.78 -0.79 2.39 -3.47 0.00 0.00 0.00 175.76 174.67 2ipi n ASP 368 N 0.13 7.47 -4.16 0.00 -0.08 -1.26 -4.49 116.55 114.16 2ipi n ASP 368 Ca 0.04 -3.29 -0.29 0.00 -1.51 0.00 0.00 54.79 49.74 2ipi n ASP 368 Cb 0.44 -1.28 0.21 0.00 2.34 0.00 0.00 41.12 42.83 2ipi n ASP 368 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2ipi n SER 369 N 1.07 -2.49 -1.36 1.67 2.88 -1.26 -4.83 113.62 109.30 2ipi n SER 369 Ca 0.56 -0.26 -0.06 0.00 -1.33 0.00 0.00 58.87 57.78 2ipi n SER 369 Cb 0.33 -1.02 0.10 0.00 -0.75 0.00 0.00 64.21 62.87 2ipi n SER 369 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2ipi n GLN 370 N -3.31 1.86 -4.25 -1.46 0.00 -1.26 -4.83 117.38 104.12 2ipi n GLN 370 Ca 0.03 -1.24 -0.18 0.00 -0.00 0.00 0.00 57.00 55.61 2ipi n GLN 370 Cb 0.57 -1.59 -0.13 0.00 0.00 0.00 0.00 30.24 29.09 2ipi n GLN 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2ipi s VAL 371 N -1.46 0.84 -0.99 1.69 -7.23 -1.26 -4.95 120.40 107.04 2ipi s VAL 371 Ca 0.23 -0.86 -0.22 0.00 -1.81 0.00 0.00 61.98 59.32 2ipi s VAL 371 Cb 0.19 -0.78 0.07 0.00 0.56 0.00 0.00 36.38 36.41 2ipi s VAL 371 CO 0.05 -0.06 1.37 0.86 -0.31 0.00 0.00 175.10 177.01 2ipi s TRP 372 N -0.82 2.64 -0.05 2.82 -0.11 -1.26 -4.98 118.94 117.19 2ipi s TRP 372 Ca -0.01 -0.92 0.06 0.00 1.22 0.00 0.00 56.10 56.45 2ipi s TRP 372 Cb -0.07 -4.61 -0.01 0.00 -1.50 0.00 0.00 33.47 27.28 2ipi s TRP 372 CO 0.01 -1.85 -0.23 0.20 -4.62 0.00 0.00 176.95 170.46 2ipi s GLY 373 N 4.64 1.18 0.09 5.86 0.00 -1.26 -2.07 107.32 115.76 2ipi s GLY 373 Ca 0.43 -0.96 -0.04 0.00 0.00 0.00 0.00 44.72 44.15 2ipi s GLY 373 CO -0.09 -0.63 0.08 -1.83 0.00 0.00 0.00 173.10 170.64 2ipi s GLU 374 N -0.21 0.80 -0.17 2.90 4.04 0.20 -2.47 118.70 123.79 2ipi s GLU 374 Ca -0.01 -1.20 0.01 0.00 0.04 0.00 0.00 54.97 53.81 2ipi s GLU 374 Cb -0.12 0.27 0.03 0.00 0.02 0.00 0.00 34.13 34.33 2ipi s GLU 374 CO 0.02 -0.22 -0.14 0.08 -1.84 0.00 0.00 175.26 173.16 2ipi s VAL 375 N -3.94 1.69 -0.18 1.83 1.01 -1.21 -1.22 120.40 118.38 2ipi s VAL 375 Ca 0.12 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.22 2ipi s VAL 375 Cb 0.07 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2ipi s VAL 375 CO -0.06 0.39 0.07 -0.44 0.00 0.00 0.00 175.10 175.05 2ipi s SER 376 N 1.42 5.67 -0.17 3.32 0.01 -0.44 -1.63 113.70 121.89 2ipi s SER 376 Ca 0.03 0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.33 2ipi s SER 376 Cb -0.14 -1.97 -0.03 0.00 0.21 0.00 0.00 66.02 64.09 2ipi s SER 376 CO -0.10 0.17 -0.00 -0.76 0.41 0.00 0.00 173.24 172.96 2ipi s LEU 377 N 0.37 3.42 -0.14 2.44 1.43 -0.47 -1.47 118.68 124.26 2ipi s LEU 377 Ca 0.03 -0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 2ipi s LEU 377 Cb -0.12 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 2ipi s LEU 377 CO -0.00 0.16 0.01 -0.31 0.23 0.00 0.00 176.35 176.44 2ipi s TYR 378 N 0.43 3.16 0.39 0.29 1.51 0.89 -1.12 117.35 122.90 2ipi s TYR 378 Ca -0.02 0.02 -0.27 0.00 -1.01 0.00 0.00 57.07 55.79 2ipi s TYR 378 Cb -0.14 -1.93 -0.10 0.00 -0.11 0.00 0.00 41.96 39.69 2ipi s TYR 378 CO 0.02 0.23 1.40 -1.54 -1.11 0.00 0.00 175.55 174.56 2ipi s SER 379 N -0.15 6.31 0.13 2.29 1.04 -0.66 -1.59 113.70 121.08 2ipi s SER 379 Ca 0.05 2.88 -0.00 0.00 0.48 0.00 0.00 55.95 59.35 2ipi s SER 379 Cb -0.12 -2.66 0.00 0.00 0.10 0.00 0.00 66.02 63.34 2ipi s SER 379 CO 0.02 -0.88 0.18 0.00 0.98 0.00 0.00 173.24 173.55 2ipi n TYR 380 N 0.31 -0.79 -2.41 5.02 4.19 -0.46 -4.74 117.16 118.28 2ipi n TYR 380 Ca 0.02 -0.91 0.00 0.00 3.31 0.00 0.00 57.90 60.32 2ipi n TYR 380 Cb 0.41 0.21 0.00 0.00 0.49 0.00 0.00 39.34 40.45 2ipi n TYR 380 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2ipi n GLY 381 N -0.22 0.38 7.00 2.98 0.00 -1.14 -4.69 105.19 109.49 2ipi n GLY 381 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2ipi n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 382 N 0.00 2.07 0.33 -0.02 0.00 -1.26 -2.88 105.19 103.43 2ipi n GLY 382 Ca 0.00 -0.50 0.18 0.00 0.00 0.00 0.00 46.02 45.71 2ipi n GLY 382 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2ipi h LYS 383 N 0.00 0.00 -0.45 1.61 1.63 -1.44 -1.18 116.57 116.74 2ipi h LYS 383 Ca 0.00 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 2ipi h LYS 383 Cb 0.00 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 2ipi h LYS 383 CO 0.00 0.00 0.17 -0.24 -3.45 0.00 0.00 179.45 175.93 2ipi h VAL 384 N 0.00 1.18 -0.11 2.00 3.04 -1.55 -2.37 116.25 118.44 2ipi h VAL 384 Ca 0.03 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 2ipi h VAL 384 Cb 0.28 0.65 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 2ipi h VAL 384 CO -0.00 0.22 0.00 0.59 -1.01 0.00 0.00 177.57 177.37 2ipi n ASN 385 N -4.35 0.63 0.11 3.17 3.02 -0.45 -3.38 115.26 114.00 2ipi n ASN 385 Ca 0.03 -1.88 0.09 0.00 -0.03 0.00 0.00 54.58 52.79 2ipi n ASN 385 Cb 0.16 -0.07 0.01 0.00 -0.61 0.00 0.00 39.78 39.27 2ipi n ASN 385 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2ipi h SER 386 N 0.72 0.00 -3.38 6.41 0.02 -1.53 -3.46 113.55 112.34 2ipi h SER 386 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 2ipi h SER 386 Cb 0.16 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.66 2ipi h SER 386 CO 0.00 0.13 0.11 -0.69 -1.14 0.00 0.00 176.83 175.24 2ipi s VAL 387 N -3.24 4.91 0.41 2.27 1.01 -1.22 -5.05 120.40 119.49 2ipi s VAL 387 Ca 0.01 1.50 -0.26 0.00 0.00 0.00 0.00 61.98 63.23 2ipi s VAL 387 Cb 0.09 -4.06 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 2ipi s VAL 387 CO 0.77 0.31 1.41 -2.84 0.00 0.00 0.00 175.10 174.75 2ipi s PRO 388 N 0.36 3.91 0.38 2.72 0.02 -1.26 -4.83 135.00 136.29 2ipi s PRO 388 Ca 0.37 2.39 0.22 0.00 0.02 0.00 0.00 61.00 64.00 2ipi s PRO 388 Cb -0.19 -2.79 1.32 0.00 0.02 0.00 0.00 34.50 32.86 2ipi s PRO 388 CO 0.20 -0.63 1.60 1.49 -0.33 0.00 0.00 177.00 179.33 2ipi h GLU 389 N 2.66 0.06 -0.37 5.54 4.81 -1.88 -1.41 114.58 123.98 2ipi h GLU 389 Ca -0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2ipi h GLU 389 Cb 1.25 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2ipi h GLU 389 CO 0.63 0.04 0.00 -2.37 -0.73 0.00 0.00 179.01 176.58 2ipi n THR 390 N -5.14 0.50 0.47 0.32 5.66 -1.26 -4.25 114.28 110.58 2ipi n THR 390 Ca 0.37 -0.75 0.13 0.00 -3.05 0.00 0.00 64.05 60.75 2ipi n THR 390 Cb 1.27 0.99 0.34 0.00 -1.55 0.00 0.00 70.33 71.38 2ipi n THR 390 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2ipi h ALA 391 N 4.32 1.00 -2.55 1.79 0.00 -1.63 -3.46 119.26 118.74 2ipi h ALA 391 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2ipi h ALA 391 Cb 0.96 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.59 2ipi h ALA 391 CO 0.00 0.00 -0.20 -0.08 0.00 0.00 0.00 179.25 178.97 2ipi s THR 392 N -3.17 0.08 -0.55 0.00 -1.32 -1.26 -5.04 115.64 104.38 2ipi s THR 392 Ca 0.09 -0.62 0.01 0.00 -1.21 0.00 0.00 61.69 59.96 2ipi s THR 392 Cb 0.10 -0.96 0.12 0.00 -1.51 0.00 0.00 72.50 70.25 2ipi s THR 392 CO 0.61 -0.34 0.87 0.00 -2.21 0.00 0.00 174.62 173.55 2ipi n ALA 393 N 0.52 2.82 -3.85 11.08 0.00 -0.60 -4.29 120.51 126.19 2ipi n ALA 393 Ca -0.18 -0.35 -0.34 0.00 0.00 0.00 0.00 53.44 52.56 2ipi n ALA 393 Cb 0.60 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.89 2ipi n ALA 393 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2ipi s THR 394 N -0.95 3.05 0.18 0.00 -4.23 -0.83 -3.00 115.64 109.86 2ipi s THR 394 Ca 0.08 -2.56 -0.09 0.00 -1.18 0.00 0.00 61.69 57.95 2ipi s THR 394 Cb 0.07 -3.10 0.05 0.00 1.34 0.00 0.00 72.50 70.86 2ipi s THR 394 CO 0.02 -0.74 1.62 0.00 -0.54 0.00 0.00 174.62 174.99 2ipi h ALA 395 N 7.44 0.81 -0.98 3.99 0.00 -1.76 -3.42 119.26 125.34 2ipi h ALA 395 Ca -0.07 -0.34 -0.37 0.00 0.00 0.00 0.00 54.91 54.13 2ipi h ALA 395 Cb 0.99 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 2ipi h ALA 395 CO 0.66 0.67 0.96 -0.65 0.00 0.00 0.00 179.25 180.89 2ipi s GLN 396 N -4.91 2.61 -0.44 0.00 1.11 -1.26 -4.54 119.66 112.23 2ipi s GLN 396 Ca -0.11 -0.02 0.07 0.00 0.01 0.00 0.00 55.36 55.31 2ipi s GLN 396 Cb 0.13 -4.84 0.41 0.00 -1.01 0.00 0.00 33.01 27.71 2ipi s GLN 396 CO 0.86 -3.13 1.05 0.54 0.01 0.00 0.00 175.29 174.63 2ipi n ARG 397 N 8.97 3.00 -0.40 2.91 5.12 -1.26 -4.74 116.66 130.26 2ipi n ARG 397 Ca 0.33 -4.34 -0.01 0.00 -1.93 0.00 0.00 57.85 51.90 2ipi n ARG 397 Cb 0.49 -2.09 -0.01 0.00 -1.16 0.00 0.00 32.46 29.69 2ipi n ARG 397 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2ipi n ASP 398 N -0.37 -0.11 -4.94 0.55 4.64 -1.26 -4.64 116.55 110.43 2ipi n ASP 398 Ca 0.33 -0.29 -0.27 0.00 -1.38 0.00 0.00 54.79 53.18 2ipi n ASP 398 Cb 0.65 0.03 -0.03 0.00 -1.04 0.00 0.00 41.12 40.73 2ipi n ASP 398 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 2ipi s SER 399 N -0.11 6.35 -0.18 1.67 0.01 -1.26 -4.72 113.70 115.45 2ipi s SER 399 Ca 0.00 0.22 0.18 0.00 1.31 0.00 0.00 55.95 57.65 2ipi s SER 399 Cb 0.00 -1.93 -0.25 0.00 0.21 0.00 0.00 66.02 64.05 2ipi s SER 399 CO 0.00 0.07 0.13 2.30 0.41 0.00 0.00 173.24 176.16 2ipi n ILE 400 N -0.36 1.37 -3.85 1.44 -5.35 -0.57 -2.89 119.36 109.15 2ipi n ILE 400 Ca -0.06 -0.84 -0.12 0.00 -0.27 0.00 0.00 62.75 61.45 2ipi n ILE 400 Cb 0.53 -0.50 -0.13 0.00 -1.74 0.00 0.00 39.64 37.80 2ipi n ILE 400 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2ipi s ILE 401 N -2.53 -0.00 -0.08 7.28 1.01 -1.11 -1.35 121.20 124.42 2ipi s ILE 401 Ca -0.09 0.00 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 2ipi s ILE 401 Cb 0.06 -0.10 -0.04 0.00 0.01 0.00 0.00 42.46 42.40 2ipi s ILE 401 CO 0.83 0.00 0.16 -0.54 0.00 0.00 0.00 174.94 175.39 2ipi s LYS 402 N 0.03 3.45 -0.02 2.79 1.02 -0.62 -1.13 119.74 125.27 2ipi s LYS 402 Ca -0.00 -0.18 0.07 0.00 0.02 0.00 0.00 55.97 55.88 2ipi s LYS 402 Cb -0.00 -3.16 -0.02 0.00 -0.52 0.00 0.00 37.83 34.13 2ipi s LYS 402 CO 0.00 0.74 -0.24 0.14 -0.92 0.00 0.00 175.35 175.07 2ipi s VAL 403 N -1.14 1.87 -0.18 3.17 -7.23 0.15 -0.07 120.40 116.97 2ipi s VAL 403 Ca 0.20 -1.02 -0.02 0.00 -1.81 0.00 0.00 61.98 59.33 2ipi s VAL 403 Cb -0.12 -1.56 0.05 0.00 0.56 0.00 0.00 36.38 35.31 2ipi s VAL 403 CO 0.10 0.53 -0.00 0.86 -0.31 0.00 0.00 175.10 176.27 2ipi s TRP 404 N -0.56 1.35 -0.09 2.82 -0.00 -0.55 -1.87 118.94 120.04 2ipi s TRP 404 Ca 0.09 -0.98 -0.06 0.00 -0.00 0.00 0.00 56.10 55.15 2ipi s TRP 404 Cb -0.09 -1.15 -0.04 0.00 -0.00 0.00 0.00 33.47 32.19 2ipi s TRP 404 CO -0.01 -0.61 0.15 -1.64 -0.00 0.00 0.00 176.95 174.84 2ipi s MET 405 N 1.75 3.42 0.12 5.86 -1.94 -0.01 -1.33 119.30 127.17 2ipi s MET 405 Ca -0.01 -0.18 -0.08 0.00 -1.71 0.00 0.00 55.69 53.71 2ipi s MET 405 Cb -0.17 -3.16 -0.01 0.00 2.01 0.00 0.00 34.83 33.51 2ipi s MET 405 CO -0.07 0.75 0.22 -1.54 -0.01 0.00 0.00 175.02 174.37 2ipi s SER 406 N -1.23 0.10 -0.06 3.03 1.04 -0.35 -1.94 113.70 114.29 2ipi s SER 406 Ca 0.18 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 55.85 2ipi s SER 406 Cb -0.12 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.39 2ipi s SER 406 CO 0.07 -0.80 -0.11 0.00 0.98 0.00 0.00 173.24 173.39 2ipi s ALA 407 N -3.92 1.15 -0.02 5.32 0.00 -1.13 0.59 121.76 123.76 2ipi s ALA 407 Ca 0.11 -0.35 0.02 0.00 0.00 0.00 0.00 51.96 51.74 2ipi s ALA 407 Cb 0.04 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.63 2ipi s ALA 407 CO -0.06 0.10 -0.07 0.99 0.00 0.00 0.00 175.76 176.72 2ipi s THR 408 N 0.68 0.61 0.34 0.00 2.01 -0.88 -2.23 115.64 116.16 2ipi s THR 408 Ca -0.14 -0.29 -0.12 0.00 0.31 0.00 0.00 61.69 61.45 2ipi s THR 408 Cb -0.15 -0.53 0.03 0.00 0.01 0.00 0.00 72.50 71.85 2ipi s THR 408 CO 0.03 0.19 0.64 -1.66 -0.69 0.00 0.00 174.62 173.13 2ipi s TRP 409 N 0.07 0.38 -0.08 4.92 -2.14 0.26 -4.28 118.94 118.07 2ipi s TRP 409 Ca -0.01 -0.86 0.04 0.00 2.66 0.00 0.00 56.10 57.94 2ipi s TRP 409 Cb -0.06 0.46 -0.08 0.00 -3.10 0.00 0.00 33.47 30.69 2ipi s TRP 409 CO -0.00 -1.32 -0.02 -0.12 -2.66 0.00 0.00 176.95 172.83 2ipi n MET 410 N -0.51 1.72 -4.10 3.25 0.00 -1.26 -1.12 117.12 115.10 2ipi n MET 410 Ca -0.04 0.02 -0.35 0.00 -0.00 0.00 0.00 57.70 57.33 2ipi n MET 410 Cb 0.61 -1.19 -0.14 0.00 0.00 0.00 0.00 33.22 32.49 2ipi n MET 410 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2ipi s ASP 411 N -4.35 4.37 0.47 6.12 2.15 -1.26 -4.74 116.67 119.43 2ipi s ASP 411 Ca -0.08 -0.33 0.29 0.00 0.43 0.00 0.00 52.55 52.86 2ipi s ASP 411 Cb 0.03 -1.73 1.36 0.00 -0.30 0.00 0.00 42.92 42.27 2ipi s ASP 411 CO 0.27 0.03 1.75 1.55 -0.17 0.00 0.00 175.17 178.60 2ipi h PRO 412 N 7.70 0.17 -0.04 4.34 0.13 -2.01 -1.00 132.00 141.29 2ipi h PRO 412 Ca -0.37 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.76 2ipi h PRO 412 Cb 1.17 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ipi h PRO 412 CO 0.60 0.11 0.08 0.00 -0.23 0.00 0.00 178.00 178.57 2ipi h ALA 413 N 1.51 1.34 -0.76 -0.56 0.00 -2.04 -0.60 119.26 118.13 2ipi h ALA 413 Ca 0.64 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 55.33 2ipi h ALA 413 Cb 2.09 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.75 2ipi h ALA 413 CO -0.20 -0.10 0.29 0.72 0.00 0.00 0.00 179.25 179.95 2ipi n HIS 414 N -3.39 2.53 -0.05 0.00 8.25 -0.38 -4.66 115.22 117.52 2ipi n HIS 414 Ca -0.02 -1.22 -0.13 0.00 -0.26 0.00 0.00 57.72 56.10 2ipi n HIS 414 Cb 0.16 -0.71 -0.07 0.00 1.12 0.00 0.00 29.99 30.50 2ipi n HIS 414 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 2ipi h ASP 415 N 2.71 0.33 -0.67 0.41 5.19 -1.26 -3.15 116.42 119.97 2ipi h ASP 415 Ca 0.28 -0.46 0.03 0.00 -0.62 0.00 0.00 57.03 56.26 2ipi h ASP 415 Cb 2.38 -0.09 -0.04 0.00 0.18 0.00 0.00 39.33 41.75 2ipi h ASP 415 CO 0.76 0.72 0.41 0.44 -3.12 0.00 0.00 179.24 178.46 2ipi h ASP 416 N -0.06 0.67 0.49 6.45 5.19 -1.83 -1.54 116.42 125.79 2ipi h ASP 416 Ca 0.02 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.41 2ipi h ASP 416 Cb 0.62 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.99 2ipi h ASP 416 CO 0.03 0.46 -0.24 0.00 -3.12 0.00 0.00 179.24 176.37 2ipi h ALA 417 N 1.30 -0.66 -0.29 3.45 0.00 -1.89 -1.72 119.26 119.44 2ipi h ALA 417 Ca 0.27 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2ipi h ALA 417 Cb 0.04 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2ipi h ALA 417 CO -0.12 -0.83 0.18 -0.91 0.00 0.00 0.00 179.25 177.58 2ipi h ASN 418 N -0.74 0.31 -0.61 0.00 4.21 -1.53 -2.19 115.58 115.03 2ipi h ASN 418 Ca -0.07 -0.00 0.10 0.00 1.21 0.00 0.00 56.30 57.54 2ipi h ASN 418 Cb 0.55 -0.07 -0.08 0.00 -1.12 0.00 0.00 38.32 37.60 2ipi h ASN 418 CO 0.11 0.23 0.20 -0.07 -1.29 0.00 0.00 177.43 176.61 2ipi h LEU 419 N 0.38 0.16 -0.58 1.61 3.38 -1.20 0.25 115.31 119.30 2ipi h LEU 419 Ca 0.11 0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.29 2ipi h LEU 419 Cb -0.03 0.09 -0.11 0.00 0.09 0.00 0.00 40.66 40.70 2ipi h LEU 419 CO -0.04 0.09 -0.13 0.00 0.09 0.00 0.00 178.44 178.46 2ipi h ALA 420 N 1.44 0.40 0.43 1.53 0.00 -0.86 -2.63 119.26 119.57 2ipi h ALA 420 Ca 0.31 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.43 2ipi h ALA 420 Cb 0.42 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2ipi h ALA 420 CO -0.34 -0.43 -0.44 2.35 0.00 0.00 0.00 179.25 180.39 2ipi h TRP 421 N 0.01 -1.23 -0.07 0.00 2.91 0.09 -0.41 115.95 117.24 2ipi h TRP 421 Ca 0.28 0.01 -0.18 0.00 1.13 0.00 0.00 58.89 60.13 2ipi h TRP 421 Cb 0.43 0.48 -0.01 0.00 -0.51 0.00 0.00 29.16 29.56 2ipi h TRP 421 CO -0.47 -0.58 -0.73 -0.84 -1.03 0.00 0.00 178.44 174.79 2ipi h ILE 422 N -0.87 1.39 -0.97 2.65 -0.00 -1.44 -0.95 117.51 117.31 2ipi h ILE 422 Ca -0.05 -2.16 0.10 0.00 -0.00 0.00 0.00 64.86 62.75 2ipi h ILE 422 Cb 0.76 2.12 -0.07 0.00 -0.00 0.00 0.00 36.82 39.63 2ipi h ILE 422 CO -0.06 0.65 0.62 0.03 -0.00 0.00 0.00 178.15 179.39 2ipi h ARG 423 N 0.25 0.99 -0.21 0.16 3.08 -1.45 -2.87 114.38 114.33 2ipi h ARG 423 Ca -0.03 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 2ipi h ARG 423 Cb 1.30 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 2ipi h ARG 423 CO 0.12 0.65 -0.05 0.93 -1.07 0.00 0.00 179.97 180.56 2ipi h GLU 424 N 1.01 0.40 -0.80 0.04 5.08 0.25 -3.04 114.58 117.52 2ipi h GLU 424 Ca 0.46 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.64 2ipi h GLU 424 Cb 0.38 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 2ipi h GLU 424 CO -0.22 0.64 0.38 0.82 -1.00 0.00 0.00 179.01 179.64 2ipi h ILE 425 N 0.13 1.25 0.57 3.13 2.04 -1.31 -3.01 117.51 120.31 2ipi h ILE 425 Ca 0.05 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 2ipi h ILE 425 Cb 0.49 0.22 0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2ipi h ILE 425 CO 0.02 0.30 -0.27 0.22 0.00 0.00 0.00 178.15 178.42 2ipi h TYR 426 N 1.14 -0.71 0.00 1.37 5.03 -1.40 0.15 116.97 122.56 2ipi h TYR 426 Ca 0.28 -0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.57 2ipi h TYR 426 Cb 0.12 0.23 -0.00 0.00 1.55 0.00 0.00 36.73 38.63 2ipi h TYR 426 CO 0.01 -0.44 -0.01 0.07 -1.32 0.00 0.00 178.16 176.48 2ipi h ARG 427 N -0.83 0.00 -0.20 1.82 -0.00 -1.63 0.73 114.38 114.27 2ipi h ARG 427 Ca -0.08 0.00 -0.20 0.00 -0.00 0.00 0.00 59.98 59.70 2ipi h ARG 427 Cb 0.58 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.56 2ipi h ARG 427 CO 0.13 0.01 -0.65 1.49 -0.00 0.00 0.00 179.97 180.94 2ipi h GLU 428 N 0.00 0.79 0.00 0.08 4.81 -1.34 1.51 114.58 120.44 2ipi h GLU 428 Ca -0.00 -0.58 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 2ipi h GLU 428 Cb 0.01 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2ipi h GLU 428 CO 0.00 1.20 0.00 0.44 -0.73 0.00 0.00 179.01 179.92 2ipi n ILE 429 N -4.01 0.15 -0.72 2.32 -0.00 0.49 -3.16 119.36 114.43 2ipi n ILE 429 Ca -0.06 -0.05 0.08 0.00 -0.00 0.00 0.00 62.75 62.71 2ipi n ILE 429 Cb 0.68 -0.53 0.24 0.00 -0.00 0.00 0.00 39.64 40.02 2ipi n ILE 429 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 2ipi n PHE 430 N -1.66 0.86 -1.20 4.28 3.72 0.15 -4.87 117.46 118.74 2ipi n PHE 430 Ca 0.07 -0.74 -0.31 0.00 -0.05 0.00 0.00 57.45 56.41 2ipi n PHE 430 Cb 0.35 -0.23 0.10 0.00 -0.94 0.00 0.00 39.48 38.77 2ipi n PHE 430 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ipi s ALA 431 N -2.22 2.11 -0.18 4.37 0.00 0.52 0.85 121.76 127.20 2ipi s ALA 431 Ca 0.37 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.71 2ipi s ALA 431 Cb 0.27 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2ipi s ALA 431 CO 0.12 -1.93 0.00 -2.37 0.00 0.00 0.00 175.76 171.58 2ipi n THR 432 N -3.53 0.00 -2.15 0.00 5.66 -1.26 -4.52 114.28 108.48 2ipi n THR 432 Ca 0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 2ipi n THR 432 Cb 0.53 -0.53 -0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2ipi n THR 432 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2ipi n THR 433 N -2.66 0.00 -0.92 1.09 -1.04 -1.17 -5.00 114.28 104.57 2ipi n THR 433 Ca -0.02 -0.29 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 2ipi n THR 433 Cb 0.20 0.55 0.00 0.00 -1.82 0.00 0.00 70.33 69.26 2ipi n THR 433 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ipi n GLY 434 N 0.15 0.75 0.00 3.41 0.00 -1.20 -3.39 105.19 104.91 2ipi n GLY 434 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2ipi n GLY 434 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ipi n GLY 435 N -2.05 1.08 3.21 -0.02 0.00 0.25 -2.97 105.19 104.69 2ipi n GLY 435 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2ipi n GLY 435 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ipi s VAL 436 N -2.00 0.09 -1.18 1.61 -7.23 -1.18 -3.79 120.40 106.72 2ipi s VAL 436 Ca 0.00 -0.74 -0.19 0.00 -1.81 0.00 0.00 61.98 59.23 2ipi s VAL 436 Cb 0.00 -0.85 -0.03 0.00 0.56 0.00 0.00 36.38 36.06 2ipi s VAL 436 CO 0.00 -0.41 1.94 -0.81 -0.31 0.00 0.00 175.10 175.51 2ipi n PRO 437 N 0.77 2.30 -2.18 4.82 -0.04 -1.26 -4.80 135.00 134.61 2ipi n PRO 437 Ca -0.19 -2.59 -0.41 0.00 -0.04 0.00 0.00 63.50 60.27 2ipi n PRO 437 Cb 0.58 -3.39 -0.03 0.00 -0.04 0.00 0.00 33.50 30.63 2ipi n PRO 437 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2ipi s VAL 438 N 6.06 2.94 -0.31 0.52 1.01 -1.26 -2.40 120.40 126.95 2ipi s VAL 438 Ca 0.57 0.89 -0.37 0.00 0.00 0.00 0.00 61.98 63.07 2ipi s VAL 438 Cb 0.07 -3.56 -0.13 0.00 0.00 0.00 0.00 36.38 32.76 2ipi s VAL 438 CO 0.07 0.19 2.04 -2.65 0.00 0.00 0.00 175.10 174.74 2ipi n PRO 439 N 1.39 1.13 -1.78 2.72 -0.02 -1.26 -4.46 135.00 132.73 2ipi n PRO 439 Ca 0.02 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2ipi n PRO 439 Cb 0.42 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2ipi n PRO 439 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2ipi n ASP 440 N 8.18 0.00 0.00 2.55 10.43 -0.40 -4.98 116.55 132.34 2ipi n ASP 440 Ca 0.36 -0.94 0.13 0.00 2.57 0.00 0.00 54.79 56.92 2ipi n ASP 440 Cb 0.19 0.00 0.43 0.00 1.84 0.00 0.00 41.12 43.58 2ipi n ASP 440 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2ipi n ASP 441 N -2.62 0.26 0.00 -2.24 -0.08 -1.26 -4.20 116.55 106.41 2ipi n ASP 441 Ca 0.00 0.12 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 2ipi n ASP 441 Cb 0.00 -0.11 0.00 0.00 2.34 0.00 0.00 41.12 43.35 2ipi n ASP 441 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2ipi n ARG 442 N -1.51 2.58 -4.35 -0.67 1.74 -1.26 -4.58 116.66 108.61 2ipi n ARG 442 Ca 0.06 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.96 2ipi n ARG 442 Cb 0.34 -0.98 -0.10 0.00 -1.02 0.00 0.00 32.46 30.70 2ipi n ARG 442 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2ipi s THR 443 N -1.94 1.12 -0.29 0.55 -4.23 -1.26 -0.09 115.64 109.50 2ipi s THR 443 Ca 0.00 -2.04 0.19 0.00 -1.18 0.00 0.00 61.69 58.66 2ipi s THR 443 Cb 0.00 -2.39 0.49 0.00 1.34 0.00 0.00 72.50 71.93 2ipi s THR 443 CO 0.00 -0.29 1.07 -0.62 -0.54 0.00 0.00 174.62 174.24 2ipi n GLU 444 N -0.46 1.86 0.00 3.99 1.02 0.18 -1.27 120.64 125.96 2ipi n GLU 444 Ca -0.05 -3.56 0.00 0.00 -0.02 0.00 0.00 57.16 53.53 2ipi n GLU 444 Cb 0.64 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2ipi n GLU 444 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ipi n GLY 445 N -0.45 2.85 2.89 0.62 0.00 -1.01 -4.55 105.19 105.55 2ipi n GLY 445 Ca 0.13 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2ipi n GLY 445 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ipi n THR 446 N 0.00 0.00 -4.00 2.61 5.66 0.35 -0.96 114.28 117.93 2ipi n THR 446 Ca 0.00 -1.25 -0.35 0.00 -3.05 0.00 0.00 64.05 59.40 2ipi n THR 446 Cb 0.00 0.88 -0.12 0.00 -1.55 0.00 0.00 70.33 69.53 2ipi n THR 446 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2ipi s PHE 447 N -3.33 3.06 -0.39 1.09 5.36 -1.26 -4.28 117.98 118.22 2ipi s PHE 447 Ca 0.20 -0.43 0.26 0.00 -0.96 0.00 0.00 56.93 55.99 2ipi s PHE 447 Cb -0.02 -2.11 1.04 0.00 -0.34 0.00 0.00 43.02 41.58 2ipi s PHE 447 CO 0.15 -0.25 1.76 -0.84 -1.46 0.00 0.00 175.22 174.58 2ipi h ILE 448 N 5.39 0.00 0.00 3.12 -2.65 -1.85 -0.39 117.51 121.13 2ipi h ILE 448 Ca -0.37 -0.30 0.00 0.00 1.03 0.00 0.00 64.86 65.22 2ipi h ILE 448 Cb 1.18 1.10 0.00 0.00 -2.05 0.00 0.00 36.82 37.04 2ipi h ILE 448 CO 0.61 0.00 0.00 0.59 0.03 0.00 0.00 178.15 179.38 2ipi n ASN 449 N -2.40 0.00 -3.50 2.16 3.02 -1.26 -3.61 115.26 109.67 2ipi n ASN 449 Ca 0.02 -0.91 -0.27 0.00 -0.03 0.00 0.00 54.58 53.40 2ipi n ASN 449 Cb 0.26 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.34 2ipi n ASN 449 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2ipi n TYR 450 N -0.93 2.45 -1.79 3.10 0.53 -0.16 -4.81 117.16 115.55 2ipi n TYR 450 Ca 0.16 -4.02 -0.36 0.00 -1.02 0.00 0.00 57.90 52.66 2ipi n TYR 450 Cb 0.07 -0.46 0.06 0.00 -1.03 0.00 0.00 39.34 37.98 2ipi n TYR 450 CO 0.00 0.00 0.00 -1.25 -1.02 0.00 0.00 176.86 174.59 2ipi s PRO 451 N -1.77 2.63 -0.28 -0.72 0.04 -1.24 -4.71 135.00 128.96 2ipi s PRO 451 Ca 0.35 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.29 2ipi s PRO 451 Cb 0.09 -1.88 0.14 0.00 0.04 0.00 0.00 34.50 32.90 2ipi s PRO 451 CO -0.09 -1.49 0.35 0.34 0.04 0.00 0.00 177.00 176.15 2ipi s ASP 452 N -1.61 0.99 0.14 6.66 2.15 -1.26 -4.70 116.67 119.05 2ipi s ASP 452 Ca 0.79 -0.46 0.19 0.00 0.43 0.00 0.00 52.55 53.50 2ipi s ASP 452 Cb -0.33 0.81 0.82 0.00 -0.30 0.00 0.00 42.92 43.91 2ipi s ASP 452 CO 0.38 -0.36 1.60 0.55 -0.17 0.00 0.00 175.17 177.17 2ipi n VAL 453 N 5.33 0.91 0.31 1.11 3.14 -1.26 -2.34 118.33 125.54 2ipi n VAL 453 Ca -0.01 0.24 0.16 0.00 -2.96 0.00 0.00 64.34 61.77 2ipi n VAL 453 Cb 0.48 -1.10 0.71 0.00 -1.06 0.00 0.00 33.84 32.88 2ipi n VAL 453 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 2ipi h ASP 454 N 0.00 0.00 0.76 6.55 3.45 -1.95 -2.93 116.42 122.30 2ipi h ASP 454 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2ipi h ASP 454 Cb 0.31 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2ipi h ASP 454 CO 0.00 0.00 0.00 0.18 -1.57 0.00 0.00 179.24 177.85 2ipi n LEU 455 N -2.82 0.00 -0.84 1.55 4.77 -0.99 -1.32 117.00 117.36 2ipi n LEU 455 Ca 0.00 0.48 0.09 0.00 -0.03 0.00 0.00 56.01 56.55 2ipi n LEU 455 Cb 0.23 -0.48 0.14 0.00 -2.33 0.00 0.00 43.42 40.99 2ipi n LEU 455 CO 0.23 -0.10 0.60 0.52 -1.33 0.00 0.00 177.39 177.31 2ipi n VAL 456 N -1.48 0.39 -3.76 4.08 0.31 -1.10 -4.47 118.33 112.31 2ipi n VAL 456 Ca 0.06 -0.70 -0.37 0.00 -0.01 0.00 0.00 64.34 63.33 2ipi n VAL 456 Cb 0.26 1.03 -0.13 0.00 -0.91 0.00 0.00 33.84 34.10 2ipi n VAL 456 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2ipi s ASP 457 N -1.30 5.11 0.33 4.52 2.15 -0.43 -4.97 116.67 122.08 2ipi s ASP 457 Ca 0.27 -0.30 0.07 0.00 0.43 0.00 0.00 52.55 53.02 2ipi s ASP 457 Cb 0.17 -1.91 0.57 0.00 -0.30 0.00 0.00 42.92 41.44 2ipi s ASP 457 CO 0.24 -0.07 1.79 -0.33 -0.17 0.00 0.00 175.17 176.62 2ipi h GLU 458 N 8.24 0.28 -2.00 4.34 5.08 -1.85 -3.25 114.58 125.42 2ipi h GLU 458 Ca -0.37 -0.10 -0.21 0.00 -1.00 0.00 0.00 59.36 57.68 2ipi h GLU 458 Cb 1.17 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.32 2ipi h GLU 458 CO 0.59 0.54 -0.33 0.54 -1.00 0.00 0.00 179.01 179.34 2ipi n ARG 459 N -4.13 2.01 0.00 2.33 1.74 -1.26 -4.15 116.66 113.20 2ipi n ARG 459 Ca -0.01 -1.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.00 2ipi n ARG 459 Cb 0.39 -1.99 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 2ipi n ARG 459 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2ipi n TRP 460 N 2.38 0.00 -0.67 -1.55 5.03 -1.23 -5.18 117.44 116.23 2ipi n TRP 460 Ca 0.43 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.96 2ipi n TRP 460 Cb 0.89 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 31.17 2ipi n TRP 460 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2ipi n ASN 461 N 0.00 0.00 -3.12 -0.99 3.02 -1.24 -4.92 115.26 108.00 2ipi n ASN 461 Ca 0.00 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.36 2ipi n ASN 461 Cb 0.00 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2ipi n ASN 461 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2ipi n THR 462 N 0.00 -8.31 -3.74 3.41 -1.04 -1.16 -4.63 114.28 98.81 2ipi n THR 462 Ca 0.00 0.52 -0.37 0.00 -2.04 0.00 0.00 64.05 62.16 2ipi n THR 462 Cb 0.00 -5.84 -0.11 0.00 -1.82 0.00 0.00 70.33 62.56 2ipi n THR 462 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2ipi s SER 463 N -2.24 5.31 0.00 8.00 0.01 -1.26 -4.67 113.70 118.84 2ipi s SER 463 Ca 0.28 -1.71 0.00 0.00 1.31 0.00 0.00 55.95 55.83 2ipi s SER 463 Cb -0.05 -1.86 0.00 0.00 0.21 0.00 0.00 66.02 64.32 2ipi s SER 463 CO 0.81 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 174.58 2ipi n GLY 464 N 4.71 2.92 3.66 3.44 0.00 -1.26 -4.85 105.19 113.80 2ipi n GLY 464 Ca -0.07 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 2ipi n GLY 464 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ipi s VAL 465 N -0.60 5.16 0.91 1.61 1.01 -1.26 -5.08 120.40 122.15 2ipi s VAL 465 Ca 0.00 0.11 -0.11 0.00 0.00 0.00 0.00 61.98 61.98 2ipi s VAL 465 Cb 0.00 -3.37 0.14 0.00 0.00 0.00 0.00 36.38 33.15 2ipi s VAL 465 CO 0.00 0.40 1.11 -2.16 0.00 0.00 0.00 175.10 174.45 2ipi s PRO 466 N 0.73 1.07 0.33 2.72 0.04 -1.26 -4.87 135.00 133.76 2ipi s PRO 466 Ca 0.06 1.22 0.03 0.00 0.04 0.00 0.00 61.00 62.35 2ipi s PRO 466 Cb -0.13 -1.76 0.58 0.00 0.04 0.00 0.00 34.50 33.23 2ipi s PRO 466 CO 0.02 -2.48 1.89 0.11 0.04 0.00 0.00 177.00 176.57 2ipi h TRP 467 N -1.75 0.64 0.00 0.56 5.08 -1.99 -2.20 115.95 116.30 2ipi h TRP 467 Ca -0.47 -0.05 -0.01 0.00 1.08 0.00 0.00 58.89 59.44 2ipi h TRP 467 Cb 1.27 -0.19 -0.00 0.00 -3.00 0.00 0.00 29.16 27.24 2ipi h TRP 467 CO 0.47 0.56 -0.05 0.10 -1.28 0.00 0.00 178.44 178.24 2ipi h TYR 468 N 0.61 0.00 0.03 0.12 -0.00 -1.96 -2.09 116.97 113.68 2ipi h TYR 468 Ca 0.14 0.00 -0.28 0.00 -0.00 0.00 0.00 58.73 58.59 2ipi h TYR 468 Cb 0.25 0.00 0.02 0.00 -0.00 0.00 0.00 36.73 37.01 2ipi h TYR 468 CO 0.01 0.05 -1.10 1.15 -0.00 0.00 0.00 178.16 178.27 2ipi h THR 469 N 0.00 1.29 -0.84 -0.90 2.02 -1.67 0.17 112.91 112.98 2ipi h THR 469 Ca -0.00 -2.32 0.01 0.00 0.77 0.00 0.00 66.41 64.87 2ipi h THR 469 Cb 0.60 2.47 -0.04 0.00 -1.74 0.00 0.00 68.15 69.44 2ipi h THR 469 CO 0.01 0.71 0.55 -0.07 0.37 0.00 0.00 175.52 177.09 2ipi h LEU 470 N 0.36 0.95 0.10 2.58 3.38 -1.29 -2.31 115.31 119.07 2ipi h LEU 470 Ca -0.14 -0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.49 2ipi h LEU 470 Cb 1.76 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.26 2ipi h LEU 470 CO 0.21 0.68 -1.68 1.88 0.09 0.00 0.00 178.44 179.62 2ipi h TYR 471 N 1.11 0.38 -0.06 1.13 0.99 -1.32 1.00 116.97 120.21 2ipi h TYR 471 Ca 0.31 -0.28 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2ipi h TYR 471 Cb -0.10 -0.02 0.00 0.00 1.00 0.00 0.00 36.73 37.61 2ipi h TYR 471 CO -0.00 1.66 0.00 0.66 -0.00 0.00 0.00 178.16 180.48 2ipi n TYR 472 N -3.81 0.06 0.00 4.88 4.01 0.57 -4.73 117.16 118.14 2ipi n TYR 472 Ca -0.30 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 2ipi n TYR 472 Cb 0.93 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.96 2ipi n TYR 472 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2ipi n LYS 473 N 0.36 0.00 -0.63 -0.72 5.02 -0.87 -1.96 118.16 119.35 2ipi n LYS 473 Ca 0.05 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.41 2ipi n LYS 473 Cb 0.22 0.00 0.33 0.00 -0.02 0.00 0.00 35.03 35.56 2ipi n LYS 473 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ipi n GLY 474 N 0.00 2.53 0.38 0.72 0.00 -1.26 -4.32 105.19 103.23 2ipi n GLY 474 Ca 0.00 -0.76 0.14 0.00 0.00 0.00 0.00 46.02 45.39 2ipi n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ipi n ASN 475 N 0.82 1.29 -0.14 1.61 3.02 -0.83 -4.37 115.26 116.67 2ipi n ASN 475 Ca 0.23 -1.23 -0.09 0.00 -0.03 0.00 0.00 54.58 53.46 2ipi n ASN 475 Cb 0.90 0.06 -0.00 0.00 -0.61 0.00 0.00 39.78 40.12 2ipi n ASN 475 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2ipi h TYR 476 N 1.86 0.66 -0.66 3.10 5.03 -1.77 -2.31 116.97 122.87 2ipi h TYR 476 Ca 0.00 -0.06 0.11 0.00 2.58 0.00 0.00 58.73 61.36 2ipi h TYR 476 Cb 0.50 -0.19 -0.08 0.00 1.55 0.00 0.00 36.73 38.51 2ipi h TYR 476 CO 0.00 0.59 0.26 -1.35 -1.32 0.00 0.00 178.16 176.33 2ipi h PRO 477 N 0.54 0.42 0.00 1.82 0.11 -1.94 -0.97 132.00 131.98 2ipi h PRO 477 Ca 0.14 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 2ipi h PRO 477 Cb 0.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 2ipi h PRO 477 CO -0.01 0.28 -0.20 -0.09 -0.21 0.00 0.00 178.00 177.77 2ipi h ARG 478 N 0.43 0.00 -0.07 1.05 2.43 -1.81 -2.67 114.38 113.75 2ipi h ARG 478 Ca 0.34 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.41 2ipi h ARG 478 Cb 0.46 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2ipi h ARG 478 CO -0.34 0.20 -0.36 -0.07 -1.51 0.00 0.00 179.97 177.89 2ipi h LEU 479 N 0.00 0.43 -0.79 3.80 3.38 -0.64 -2.81 115.31 118.67 2ipi h LEU 479 Ca -0.00 -0.66 0.12 0.00 0.09 0.00 0.00 57.88 57.43 2ipi h LEU 479 Cb 0.38 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.92 2ipi h LEU 479 CO 0.03 1.02 0.40 1.56 0.09 0.00 0.00 178.44 181.54 2ipi h GLN 480 N -0.14 0.61 -0.77 1.13 4.20 -1.16 0.25 115.11 119.24 2ipi h GLN 480 Ca -0.03 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 2ipi h GLN 480 Cb 1.02 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.62 2ipi h GLN 480 CO 0.07 0.40 0.40 0.87 -0.67 0.00 0.00 178.83 179.91 2ipi h LYS 481 N 0.63 1.08 -0.17 1.46 1.57 -1.48 0.53 116.57 120.18 2ipi h LYS 481 Ca 0.41 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2ipi h LYS 481 Cb 0.51 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2ipi h LYS 481 CO -0.32 0.80 0.06 0.28 -0.57 0.00 0.00 179.45 179.71 2ipi h VAL 482 N 1.08 1.17 0.00 0.50 2.07 -0.79 -2.24 116.25 118.04 2ipi h VAL 482 Ca 0.27 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2ipi h VAL 482 Cb 0.06 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2ipi h VAL 482 CO -0.04 0.16 -0.08 0.50 0.02 0.00 0.00 177.57 178.13 2ipi h LYS 483 N 0.11 0.00 -0.21 1.57 1.63 0.20 -2.38 116.57 117.50 2ipi h LYS 483 Ca 0.06 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.74 2ipi h LYS 483 Cb 0.20 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.83 2ipi h LYS 483 CO -0.00 0.08 -0.33 0.00 -3.45 0.00 0.00 179.45 175.74 2ipi h ALA 484 N 1.92 0.32 -0.19 5.00 0.00 0.48 -1.98 119.26 124.81 2ipi h ALA 484 Ca -0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 2ipi h ALA 484 Cb 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ipi h ALA 484 CO 0.01 0.37 -0.30 0.00 0.00 0.00 0.00 179.25 179.33 2ipi h ARG 485 N 0.27 0.54 0.00 0.00 3.08 -1.16 -3.27 114.38 113.84 2ipi h ARG 485 Ca 0.02 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.74 2ipi h ARG 485 Cb 0.92 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.00 2ipi h ARG 485 CO 0.08 0.93 -0.82 0.91 -1.07 0.00 0.00 179.97 180.00 2ipi n TRP 486 N -4.35 0.00 -3.13 3.04 8.01 -0.92 -4.61 117.44 115.49 2ipi n TRP 486 Ca -0.06 0.00 -0.22 0.00 -1.31 0.00 0.00 57.50 55.91 2ipi n TRP 486 Cb 0.47 -0.04 -0.04 0.00 -2.01 0.00 0.00 31.31 29.69 2ipi n TRP 486 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 2ipi n ASP 487 N -1.43 2.16 -0.00 -0.99 2.03 -0.74 -3.92 116.55 113.65 2ipi n ASP 487 Ca 0.02 -3.22 0.04 0.00 0.52 0.00 0.00 54.79 52.14 2ipi n ASP 487 Cb 0.25 -0.61 0.41 0.00 -0.72 0.00 0.00 41.12 40.46 2ipi n ASP 487 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2ipi h PRO 488 N 3.21 0.55 -0.25 -0.67 0.13 -1.71 -1.36 132.00 131.89 2ipi h PRO 488 Ca 0.11 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2ipi h PRO 488 Cb 0.78 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2ipi h PRO 488 CO 0.62 0.37 0.00 0.54 -0.23 0.00 0.00 178.00 179.31 2ipi n ARG 489 N -4.46 1.67 -4.03 0.86 1.74 -1.26 -4.92 116.66 106.26 2ipi n ARG 489 Ca 0.03 -1.04 -0.29 0.00 -0.77 0.00 0.00 57.85 55.79 2ipi n ARG 489 Cb 0.07 -1.28 -0.02 0.00 -1.02 0.00 0.00 32.46 30.21 2ipi n ARG 489 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2ipi n ASP 490 N 0.31 -1.64 -0.15 0.55 2.03 -0.51 -4.86 116.55 112.28 2ipi n ASP 490 Ca 0.12 -0.98 -0.07 0.00 0.52 0.00 0.00 54.79 54.37 2ipi n ASP 490 Cb 0.27 -3.06 0.08 0.00 -0.72 0.00 0.00 41.12 37.68 2ipi n ASP 490 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2ipi h VAL 491 N -1.76 1.26 -3.28 5.18 2.07 -1.92 -3.40 116.25 114.41 2ipi h VAL 491 Ca -0.61 -1.15 -0.72 0.00 0.82 0.00 0.00 66.70 65.03 2ipi h VAL 491 Cb 1.38 0.91 -0.21 0.00 -1.52 0.00 0.00 31.29 31.85 2ipi h VAL 491 CO 0.67 0.41 -0.19 -0.36 0.02 0.00 0.00 177.57 178.12 2ipi s PHE 492 N -4.92 3.17 0.06 1.57 0.40 -1.26 -4.66 117.98 112.34 2ipi s PHE 492 Ca -0.10 -0.80 -0.04 0.00 -0.60 0.00 0.00 56.93 55.39 2ipi s PHE 492 Cb 0.14 -3.32 -0.02 0.00 0.51 0.00 0.00 43.02 40.32 2ipi s PHE 492 CO 0.84 -0.89 0.04 0.50 0.70 0.00 0.00 175.22 176.41 2ipi s ARG 493 N 2.00 0.65 -0.19 0.44 3.52 -1.25 -4.53 118.95 119.58 2ipi s ARG 493 Ca 0.08 -1.05 -0.22 0.00 -0.13 0.00 0.00 55.73 54.40 2ipi s ARG 493 Cb -0.23 0.24 0.06 0.00 -1.56 0.00 0.00 34.95 33.47 2ipi s ARG 493 CO 0.08 -0.15 0.61 -1.01 -0.81 0.00 0.00 175.30 174.02 2ipi s HIS 494 N -3.59 -0.64 0.54 5.12 3.76 -1.26 -4.98 115.29 114.24 2ipi s HIS 494 Ca 0.04 1.50 0.21 0.00 -0.15 0.00 0.00 55.06 56.65 2ipi s HIS 494 Cb 0.05 0.25 1.43 0.00 1.11 0.00 0.00 32.58 35.42 2ipi s HIS 494 CO -0.09 -0.37 2.16 0.00 -0.85 0.00 0.00 174.74 175.59 2ipi h ALA 495 N 4.80 1.93 -0.98 -1.40 0.00 -1.99 -1.21 119.26 120.41 2ipi h ALA 495 Ca -0.28 -0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.01 2ipi h ALA 495 Cb 1.16 0.00 -0.37 0.00 0.00 0.00 0.00 17.79 18.59 2ipi h ALA 495 CO 0.17 -0.07 -0.13 1.28 0.00 0.00 0.00 179.25 180.50 2ipi n LEU 496 N -4.33 5.95 -4.72 0.00 4.32 -1.26 -5.03 117.00 111.93 2ipi n LEU 496 Ca -0.02 -4.72 -0.42 0.00 -0.02 0.00 0.00 56.01 50.84 2ipi n LEU 496 Cb 0.15 -0.62 -0.03 0.00 -1.62 0.00 0.00 43.42 41.29 2ipi n LEU 496 CO 0.32 1.92 0.75 -0.55 -1.22 0.00 0.00 177.39 178.61 2ipi s SER 497 N -2.82 7.30 0.33 -1.43 0.15 -0.46 -5.01 113.70 111.77 2ipi s SER 497 Ca 0.54 1.85 -0.28 0.00 0.70 0.00 0.00 55.95 58.76 2ipi s SER 497 Cb 0.44 -2.58 -0.12 0.00 -1.71 0.00 0.00 66.02 62.05 2ipi s SER 497 CO -0.07 -0.27 1.34 1.33 1.20 0.00 0.00 173.24 176.78 2ipi n VAL 498 N 3.43 1.86 -4.60 4.45 0.24 -1.26 -4.97 118.33 117.47 2ipi n VAL 498 Ca 0.05 -0.47 -0.32 0.00 -2.04 0.00 0.00 64.34 61.57 2ipi n VAL 498 Cb 0.49 -1.64 -0.12 0.00 -1.47 0.00 0.00 33.84 31.10 2ipi n VAL 498 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2ipi s ARG 499 N -1.72 2.37 1.09 7.34 0.52 -1.26 -5.03 118.95 122.26 2ipi s ARG 499 Ca 0.57 -0.81 -0.12 0.00 -0.52 0.00 0.00 55.73 54.85 2ipi s ARG 499 Cb -0.56 -2.37 0.24 0.00 0.52 0.00 0.00 34.95 32.78 2ipi s ARG 499 CO 0.61 0.58 1.06 -1.25 0.02 0.00 0.00 175.30 176.32 2ipi s PRO 500 N -1.31 -0.33 0.00 3.54 0.04 -1.26 -4.55 135.00 131.13 2ipi s PRO 500 Ca 0.15 1.05 0.30 0.00 0.04 0.00 0.00 61.00 62.54 2ipi s PRO 500 Cb -0.11 -1.61 1.76 0.00 0.04 0.00 0.00 34.50 34.59 2ipi s PRO 500 CO 0.06 -3.39 2.10 -0.35 0.04 0.00 0.00 177.00 175.45