#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1abb h LYS 11 N 0.00 0.00 0.00 -0.14 1.79 -2.12 0.21 116.57 116.31 1abb h LYS 11 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1abb h LYS 11 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1abb h LYS 11 CO 0.00 0.00 -0.09 0.94 -1.08 0.00 0.00 179.45 179.22 1abb n GLN 12 N -2.58 0.01 -3.21 3.15 0.00 -1.26 -4.14 117.38 109.34 1abb n GLN 12 Ca -0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 57.00 56.54 1abb n GLN 12 Cb 0.86 -1.51 -0.03 0.00 0.00 0.00 0.00 30.24 29.57 1abb n GLN 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1abb s ILE 13 N -3.00 5.28 0.08 1.69 1.01 0.73 -5.00 121.20 121.99 1abb s ILE 13 Ca 0.13 -1.98 0.02 0.00 0.00 0.00 0.00 60.65 58.82 1abb s ILE 13 Cb 0.19 -4.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 1abb s ILE 13 CO 0.56 -1.13 -0.07 -0.55 0.00 0.00 0.00 174.94 173.75 1abb s SER 14 N 2.82 1.08 0.47 3.58 0.15 -1.26 -4.99 113.70 115.55 1abb s SER 14 Ca 0.19 -0.83 0.30 0.00 0.70 0.00 0.00 55.95 56.31 1abb s SER 14 Cb -0.13 0.07 1.12 0.00 -1.71 0.00 0.00 66.02 65.36 1abb s SER 14 CO -0.06 -0.35 1.87 0.58 1.20 0.00 0.00 173.24 176.48 1abb h VAL 15 N 3.55 0.00 -0.39 4.45 2.07 -1.94 -3.41 116.25 120.57 1abb h VAL 15 Ca -0.36 -0.53 0.04 0.00 0.82 0.00 0.00 66.70 66.67 1abb h VAL 15 Cb 1.18 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 32.38 1abb h VAL 15 CO 0.55 0.00 -0.27 0.08 0.02 0.00 0.00 177.57 177.95 1abb h ARG 16 N 0.00 -0.04 -0.77 1.57 0.11 -1.97 -3.26 114.38 110.02 1abb h ARG 16 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1abb h ARG 16 Cb 0.57 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.66 1abb h ARG 16 CO 0.00 -0.03 0.00 0.41 0.10 0.00 0.00 179.97 180.45 1abb n GLY 17 N -1.13 1.81 2.52 0.08 0.00 -1.26 -4.58 105.19 102.62 1abb n GLY 17 Ca 0.00 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1abb n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 18 N 0.24 7.64 -3.15 0.99 7.99 -1.23 -4.92 117.00 124.56 1abb n LEU 18 Ca 0.10 -4.46 0.06 0.00 -0.01 0.00 0.00 56.01 51.70 1abb n LEU 18 Cb 0.55 -1.01 -0.00 0.00 -0.11 0.00 0.00 43.42 42.85 1abb n LEU 18 CO 0.11 1.56 0.57 0.00 -1.51 0.00 0.00 177.39 178.13 1abb s ALA 19 N -3.88 -4.02 -1.68 -1.18 0.00 -1.26 -5.00 121.76 104.74 1abb s ALA 19 Ca 0.60 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.94 1abb s ALA 19 Cb 0.48 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.83 1abb s ALA 19 CO -0.15 -1.95 0.84 0.41 0.00 0.00 0.00 175.76 174.91 1abb n GLY 20 N 5.19 -0.21 1.21 0.00 0.00 -1.26 -4.96 105.19 105.16 1abb n GLY 20 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1abb n GLY 20 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1abb n VAL 21 N -0.34 0.00 -0.95 1.61 3.14 -1.26 -3.94 118.33 116.59 1abb n VAL 21 Ca 0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.95 1abb n VAL 21 Cb 0.08 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 32.79 1abb n VAL 21 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1abb n GLU 22 N 2.41 1.11 -3.50 1.45 -0.58 -1.26 -4.62 120.64 115.65 1abb n GLU 22 Ca 0.00 -1.59 -0.23 0.00 -0.42 0.00 0.00 57.16 54.92 1abb n GLU 22 Cb 0.00 -2.78 -0.13 0.00 -0.57 0.00 0.00 31.44 27.96 1abb n GLU 22 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1abb s ASN 23 N 5.47 2.33 0.31 1.62 3.84 -1.25 -5.00 114.94 122.25 1abb s ASN 23 Ca 0.59 -0.78 0.22 0.00 0.21 0.00 0.00 52.86 53.09 1abb s ASN 23 Cb 0.14 0.08 1.13 0.00 -0.55 0.00 0.00 41.25 42.05 1abb s ASN 23 CO 0.17 -0.39 1.66 0.52 -2.79 0.00 0.00 177.10 176.28 1abb n VAL 24 N 5.29 1.01 -0.03 -5.21 0.31 -1.26 -0.18 118.33 118.26 1abb n VAL 24 Ca -0.05 0.65 -0.12 0.00 -0.01 0.00 0.00 64.34 64.81 1abb n VAL 24 Cb 0.46 -1.64 -0.14 0.00 -0.91 0.00 0.00 33.84 31.61 1abb n VAL 24 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1abb n THR 25 N -2.25 1.62 0.09 2.52 -1.04 -1.26 -3.17 114.28 110.79 1abb n THR 25 Ca -0.01 -0.76 0.03 0.00 -2.04 0.00 0.00 64.05 61.27 1abb n THR 25 Cb 0.07 -1.14 -0.02 0.00 -1.82 0.00 0.00 70.33 67.41 1abb n THR 25 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1abb h GLU 26 N 0.02 0.00 -0.04 -2.82 4.39 -0.89 -2.60 114.58 112.65 1abb h GLU 26 Ca -0.36 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 1abb h GLU 26 Cb 2.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.69 1abb h GLU 26 CO 0.07 0.32 -0.09 -0.07 -1.16 0.00 0.00 179.01 178.07 1abb h LEU 27 N 0.00 0.14 -1.58 1.33 3.38 -1.23 -1.59 115.31 115.77 1abb h LEU 27 Ca -0.08 -0.60 0.09 0.00 0.09 0.00 0.00 57.88 57.38 1abb h LEU 27 Cb 1.42 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 42.09 1abb h LEU 27 CO 0.05 0.72 0.42 0.11 0.09 0.00 0.00 178.44 179.82 1abb h LYS 28 N -0.42 0.47 -0.19 1.13 1.57 -1.63 0.91 116.57 118.40 1abb h LYS 28 Ca -0.00 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1abb h LYS 28 Cb 0.70 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1abb h LYS 28 CO 0.02 0.31 0.01 -0.22 -0.57 0.00 0.00 179.45 179.00 1abb h LYS 29 N 0.48 0.34 -0.00 3.15 3.64 -1.36 -2.65 116.57 120.17 1abb h LYS 29 Ca 0.29 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1abb h LYS 29 Cb 0.49 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1abb h LYS 29 CO -0.09 0.52 -0.27 -0.91 -2.27 0.00 0.00 179.45 176.44 1abb h ASN 30 N 0.10 0.01 0.96 4.20 4.21 -0.16 -0.68 115.58 124.23 1abb h ASN 30 Ca 0.06 -0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.52 1abb h ASN 30 Cb 0.37 -0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.57 1abb h ASN 30 CO 0.01 0.27 -0.46 0.15 -1.29 0.00 0.00 177.43 176.11 1abb h PHE 31 N 0.01 -1.20 -0.98 1.19 3.57 -0.75 -2.53 116.94 116.24 1abb h PHE 31 Ca -0.00 -0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.59 1abb h PHE 31 Cb 0.48 0.40 -0.08 0.00 2.79 0.00 0.00 35.95 39.53 1abb h PHE 31 CO 0.00 -0.74 0.62 -0.91 -2.23 0.00 0.00 178.31 175.05 1abb h ASN 32 N -1.32 0.89 -0.43 0.41 2.35 -1.25 0.70 115.58 116.93 1abb h ASN 32 Ca -0.13 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.68 1abb h ASN 32 Cb 0.99 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.20 1abb h ASN 32 CO 0.22 0.48 0.26 0.03 -1.65 0.00 0.00 177.43 176.76 1abb h ARG 33 N 0.96 0.50 -0.14 0.81 3.08 -1.07 -2.77 114.38 115.75 1abb h ARG 33 Ca 0.48 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.36 1abb h ARG 33 Cb 0.49 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1abb h ARG 33 CO -0.24 0.33 -0.51 0.45 -1.07 0.00 0.00 179.97 178.93 1abb h HIS 34 N 0.52 0.47 -0.43 3.04 3.86 0.75 0.68 115.15 124.03 1abb h HIS 34 Ca 0.17 -0.16 -0.07 0.00 -1.16 0.00 0.00 60.37 59.15 1abb h HIS 34 Cb -0.00 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 1abb h HIS 34 CO -0.07 0.82 -0.04 1.25 0.86 0.00 0.00 177.93 180.75 1abb h LEU 35 N 0.30 0.70 0.00 2.43 5.85 -0.77 -0.67 115.31 123.15 1abb h LEU 35 Ca 0.01 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1abb h LEU 35 Cb 1.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1abb h LEU 35 CO 0.09 0.79 0.00 1.41 -0.34 0.00 0.00 178.44 180.39 1abb n HIS 36 N -4.21 0.00 -0.26 1.25 8.25 -1.05 -2.15 115.22 117.05 1abb n HIS 36 Ca 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.43 1abb n HIS 36 Cb 0.31 -0.12 0.06 0.00 1.12 0.00 0.00 29.99 31.35 1abb n HIS 36 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1abb h PHE 37 N 0.00 0.98 0.03 4.41 0.04 0.23 0.27 116.94 122.90 1abb h PHE 37 Ca 0.00 -0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 1abb h PHE 37 Cb 0.00 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 37.84 1abb h PHE 37 CO 0.00 0.68 -0.17 1.15 -0.60 0.00 0.00 178.31 179.36 1abb h THR 38 N 0.99 1.73 0.00 -1.55 2.02 -1.47 -3.37 112.91 111.27 1abb h THR 38 Ca 0.26 -2.36 -0.14 0.00 0.77 0.00 0.00 66.41 64.93 1abb h THR 38 Cb 0.01 3.33 -0.02 0.00 -1.74 0.00 0.00 68.15 69.72 1abb h THR 38 CO -0.04 0.63 -1.43 0.18 0.37 0.00 0.00 175.52 175.23 1abb n LEU 39 N -4.51 0.77 -3.37 2.58 4.32 -0.30 -4.98 117.00 111.52 1abb n LEU 39 Ca -0.11 0.33 -0.17 0.00 -0.02 0.00 0.00 56.01 56.04 1abb n LEU 39 Cb 0.55 0.07 0.09 0.00 -1.62 0.00 0.00 43.42 42.50 1abb n LEU 39 CO 0.37 0.10 0.12 0.52 -1.22 0.00 0.00 177.39 177.28 1abb n VAL 40 N -2.81 -5.50 -4.58 4.08 0.31 0.95 -5.00 118.33 105.77 1abb n VAL 40 Ca -0.09 -0.43 -0.28 0.00 -0.01 0.00 0.00 64.34 63.53 1abb n VAL 40 Cb 0.79 -4.81 -0.08 0.00 -0.91 0.00 0.00 33.84 28.83 1abb n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1abb s LYS 41 N -5.42 2.00 0.21 5.55 -0.14 -0.91 -5.04 119.74 115.99 1abb s LYS 41 Ca 0.06 -2.24 -0.23 0.00 -1.36 0.00 0.00 55.97 52.21 1abb s LYS 41 Cb -0.03 -0.88 0.05 0.00 -1.68 0.00 0.00 37.83 35.29 1abb s LYS 41 CO 0.71 -0.44 0.72 0.16 -0.76 0.00 0.00 175.35 175.74 1abb s ASP 42 N -3.68 -0.36 0.00 2.83 -4.77 -1.26 -3.90 116.67 105.53 1abb s ASP 42 Ca 0.19 -0.34 0.14 0.00 -3.30 0.00 0.00 52.55 49.24 1abb s ASP 42 Cb 0.02 0.64 0.84 0.00 -1.09 0.00 0.00 42.92 43.33 1abb s ASP 42 CO 0.11 -1.12 1.27 -2.11 0.70 0.00 0.00 175.17 174.02 1abb n ARG 43 N -0.42 0.50 -0.04 2.11 1.85 -1.26 -0.61 116.66 118.79 1abb n ARG 43 Ca -0.09 0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.68 1abb n ARG 43 Cb 0.61 -1.44 -0.14 0.00 -1.05 0.00 0.00 32.46 30.44 1abb n ARG 43 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1abb n ASN 44 N -0.94 0.61 -0.01 2.89 4.13 -1.26 -4.48 115.26 116.20 1abb n ASN 44 Ca 0.11 0.29 0.07 0.00 1.68 0.00 0.00 54.58 56.73 1abb n ASN 44 Cb 0.05 0.29 -0.11 0.00 -1.54 0.00 0.00 39.78 38.47 1abb n ASN 44 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1abb n VAL 45 N -2.94 0.00 -1.84 2.41 0.31 -0.38 -5.06 118.33 110.84 1abb n VAL 45 Ca -0.21 -0.33 -0.36 0.00 -0.01 0.00 0.00 64.34 63.44 1abb n VAL 45 Cb 1.06 0.19 0.05 0.00 -0.91 0.00 0.00 33.84 34.24 1abb n VAL 45 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1abb s ALA 46 N -2.98 2.43 0.30 3.52 0.00 0.22 -4.91 121.76 120.33 1abb s ALA 46 Ca -0.05 1.06 0.10 0.00 0.00 0.00 0.00 51.96 53.07 1abb s ALA 46 Cb 0.09 -3.49 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 1abb s ALA 46 CO 0.60 -1.41 -0.14 0.99 0.00 0.00 0.00 175.76 175.79 1abb s THR 47 N -1.59 2.24 0.28 0.00 2.01 -1.26 -5.00 115.64 112.33 1abb s THR 47 Ca 0.79 -2.29 0.02 0.00 0.31 0.00 0.00 61.69 60.52 1abb s THR 47 Cb -0.33 -2.43 0.27 0.00 0.01 0.00 0.00 72.50 70.03 1abb s THR 47 CO 0.37 -0.33 1.77 1.55 -0.69 0.00 0.00 174.62 177.29 1abb h PRO 48 N 2.20 0.66 -0.05 4.92 0.13 -1.99 -0.53 132.00 137.35 1abb h PRO 48 Ca -0.41 -0.04 0.04 0.00 -0.87 0.00 0.00 66.00 64.72 1abb h PRO 48 Cb 1.25 -0.15 -0.06 0.00 0.13 0.00 0.00 31.00 32.17 1abb h PRO 48 CO 0.65 0.44 -0.36 -0.09 -0.23 0.00 0.00 178.00 178.40 1abb h ARG 49 N 0.68 -0.47 -0.64 0.86 2.43 -1.96 -0.97 114.38 114.31 1abb h ARG 49 Ca 0.52 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.80 1abb h ARG 49 Cb 0.77 0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.36 1abb h ARG 49 CO -0.38 -0.32 0.30 -0.44 -1.51 0.00 0.00 179.97 177.62 1abb h ASP 50 N -0.49 0.38 -0.53 -3.80 3.32 -1.69 -0.35 116.42 113.25 1abb h ASP 50 Ca 0.07 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 1abb h ASP 50 Cb 0.60 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1abb h ASP 50 CO -0.32 0.23 0.12 1.88 -1.72 0.00 0.00 179.24 179.43 1abb h TYR 51 N 0.53 0.94 -0.82 4.55 0.05 -0.76 -1.53 116.97 119.94 1abb h TYR 51 Ca 0.31 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.94 1abb h TYR 51 Cb 0.31 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.74 1abb h TYR 51 CO -0.12 0.80 0.34 -0.92 -1.05 0.00 0.00 178.16 177.20 1abb h TYR 52 N 0.86 1.23 0.00 4.88 3.20 -0.15 0.27 116.97 127.26 1abb h TYR 52 Ca 0.18 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 1abb h TYR 52 Cb 0.35 -0.37 -0.00 0.00 1.54 0.00 0.00 36.73 38.24 1abb h TYR 52 CO 0.02 0.92 -0.07 0.74 -1.64 0.00 0.00 178.16 178.12 1abb h PHE 53 N 1.18 0.00 0.24 -3.82 0.04 -0.13 0.11 116.94 114.57 1abb h PHE 53 Ca 0.27 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.73 1abb h PHE 53 Cb 0.20 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.38 1abb h PHE 53 CO 0.02 0.07 -1.39 0.00 -0.60 0.00 0.00 178.31 176.41 1abb h ALA 54 N 1.93 -0.15 -0.29 2.45 0.00 0.00 -2.36 119.26 120.84 1abb h ALA 54 Ca -0.00 -0.84 0.02 0.00 0.00 0.00 0.00 54.91 54.09 1abb h ALA 54 Cb 0.48 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1abb h ALA 54 CO 0.01 0.65 0.14 1.25 0.00 0.00 0.00 179.25 181.30 1abb h LEU 55 N 0.07 0.20 -0.94 0.00 5.85 -0.17 -0.43 115.31 119.88 1abb h LEU 55 Ca -0.24 0.01 0.29 0.00 0.84 0.00 0.00 57.88 58.78 1abb h LEU 55 Cb 2.09 -0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.95 1abb h LEU 55 CO 0.26 0.15 0.34 0.00 -0.34 0.00 0.00 178.44 178.85 1abb h ALA 56 N 1.15 1.57 0.13 1.25 0.00 -0.79 0.40 119.26 122.96 1abb h ALA 56 Ca 0.12 0.23 -0.32 0.00 0.00 0.00 0.00 54.91 54.95 1abb h ALA 56 Cb 0.04 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1abb h ALA 56 CO -0.09 -0.57 -1.59 0.45 0.00 0.00 0.00 179.25 177.46 1abb h HIS 57 N 0.19 0.50 -0.66 0.00 3.86 -0.91 -2.64 115.15 115.49 1abb h HIS 57 Ca 0.65 -0.37 0.11 0.00 -1.16 0.00 0.00 60.37 59.60 1abb h HIS 57 Cb 1.42 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.83 1abb h HIS 57 CO -0.19 1.44 0.44 1.15 0.86 0.00 0.00 177.93 181.63 1abb h THR 58 N 0.08 0.87 0.11 2.45 2.02 0.73 -2.80 112.91 116.37 1abb h THR 58 Ca -0.27 -0.15 -0.15 0.00 0.77 0.00 0.00 66.41 66.61 1abb h THR 58 Cb 2.03 0.40 0.02 0.00 -1.74 0.00 0.00 68.15 68.86 1abb h THR 58 CO 0.16 0.08 -0.67 0.58 0.37 0.00 0.00 175.52 176.04 1abb h VAL 59 N 0.44 1.55 -0.76 3.16 2.07 -1.37 -3.34 116.25 117.99 1abb h VAL 59 Ca 0.31 -2.46 0.15 0.00 0.82 0.00 0.00 66.70 65.52 1abb h VAL 59 Cb 0.62 3.17 -0.05 0.00 -1.52 0.00 0.00 31.29 33.51 1abb h VAL 59 CO -0.09 0.69 0.51 -0.09 0.02 0.00 0.00 177.57 178.60 1abb h ARG 60 N -0.44 0.40 -0.69 1.57 2.43 -1.20 -1.02 114.38 115.43 1abb h ARG 60 Ca -0.11 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.12 1abb h ARG 60 Cb 1.51 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.90 1abb h ARG 60 CO 0.13 0.27 0.35 -0.44 -1.51 0.00 0.00 179.97 178.76 1abb h ASP 61 N 0.42 0.47 -0.10 -3.80 3.32 -1.65 0.11 116.42 115.19 1abb h ASP 61 Ca 0.37 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.46 1abb h ASP 61 Cb 0.86 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 1abb h ASP 61 CO -0.12 0.28 -0.02 0.45 -1.72 0.00 0.00 179.24 178.10 1abb h HIS 62 N 0.61 0.21 0.07 4.55 3.86 -1.37 -1.90 115.15 121.17 1abb h HIS 62 Ca 0.33 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.51 1abb h HIS 62 Cb 0.32 -0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.70 1abb h HIS 62 CO -0.10 0.50 -0.46 -0.07 0.86 0.00 0.00 177.93 178.65 1abb h LEU 63 N -0.14 -1.41 -1.79 2.43 3.38 -1.15 -3.05 115.31 113.59 1abb h LEU 63 Ca 0.02 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1abb h LEU 63 Cb 0.43 0.52 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1abb h LEU 63 CO 0.01 -0.48 -0.14 -0.37 0.09 0.00 0.00 178.44 177.56 1abb h VAL 64 N -0.63 0.56 -0.29 1.22 -1.51 -0.69 -0.75 116.25 114.15 1abb h VAL 64 Ca -0.00 -0.63 0.05 0.00 -1.23 0.00 0.00 66.70 64.89 1abb h VAL 64 Cb 0.65 1.41 -0.05 0.00 -2.13 0.00 0.00 31.29 31.17 1abb h VAL 64 CO -0.27 0.13 -0.01 1.23 -1.23 0.00 0.00 177.57 177.42 1abb h GLY 65 N 1.04 0.27 1.34 5.19 0.00 -1.29 0.16 103.07 109.79 1abb h GLY 65 Ca -0.00 0.04 -0.13 0.00 0.00 0.00 0.00 47.33 47.24 1abb h GLY 65 CO 0.02 -0.07 -0.33 3.21 0.00 0.00 0.00 176.54 179.37 1abb h ARG 66 N 0.07 0.74 -0.53 4.80 3.08 -1.08 -2.16 114.38 119.30 1abb h ARG 66 Ca 0.14 -0.35 -0.06 0.00 0.07 0.00 0.00 59.98 59.78 1abb h ARG 66 Cb 0.19 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1abb h ARG 66 CO -0.24 0.96 0.07 2.35 -1.07 0.00 0.00 179.97 182.04 1abb h TRP 67 N 0.62 0.88 0.61 3.04 7.01 -0.17 0.96 115.95 128.90 1abb h TRP 67 Ca 0.07 -0.10 -0.03 0.00 2.11 0.00 0.00 58.89 60.93 1abb h TRP 67 Cb 0.86 -0.25 0.01 0.00 -2.10 0.00 0.00 29.16 27.68 1abb h TRP 67 CO 0.04 0.77 -0.29 0.82 -2.79 0.00 0.00 178.44 176.99 1abb h ILE 68 N 0.80 0.00 -0.99 2.65 1.08 -0.46 -0.54 117.51 120.04 1abb h ILE 68 Ca 0.17 -0.15 0.19 0.00 -0.39 0.00 0.00 64.86 64.68 1abb h ILE 68 Cb 0.38 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.03 1abb h ILE 68 CO 0.01 0.00 0.61 0.03 -0.69 0.00 0.00 178.15 178.11 1abb h ARG 69 N -0.96 0.70 0.11 2.37 2.47 -1.22 -2.25 114.38 115.60 1abb h ARG 69 Ca -0.08 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1abb h ARG 69 Cb 0.62 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1abb h ARG 69 CO 0.14 0.46 -0.06 1.15 0.56 0.00 0.00 179.97 182.22 1abb h THR 70 N 0.72 1.08 0.00 2.04 2.02 -0.78 -1.96 112.91 116.02 1abb h THR 70 Ca 0.56 -0.89 -0.03 0.00 0.77 0.00 0.00 66.41 66.82 1abb h THR 70 Cb 0.94 1.63 -0.00 0.00 -1.74 0.00 0.00 68.15 68.97 1abb h THR 70 CO -0.35 0.21 -0.16 1.56 0.37 0.00 0.00 175.52 177.16 1abb h GLN 71 N -0.58 0.00 0.41 6.66 1.08 -0.49 -1.18 115.11 121.01 1abb h GLN 71 Ca -0.02 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 1abb h GLN 71 Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1abb h GLN 71 CO 0.03 0.16 -0.20 1.96 -0.95 0.00 0.00 178.83 179.83 1abb h GLN 72 N 0.00 -0.53 -0.84 1.46 4.20 -1.49 -2.01 115.11 115.91 1abb h GLN 72 Ca -0.00 0.04 0.13 0.00 0.06 0.00 0.00 58.65 58.88 1abb h GLN 72 Cb 0.45 0.12 -0.14 0.00 0.30 0.00 0.00 27.48 28.21 1abb h GLN 72 CO 0.02 -0.22 -0.38 1.25 -0.67 0.00 0.00 178.83 178.83 1abb h HIS 73 N -0.97 -1.08 -0.72 2.96 2.76 -0.45 1.32 115.15 118.98 1abb h HIS 73 Ca -0.06 0.09 0.06 0.00 -2.20 0.00 0.00 60.37 58.27 1abb h HIS 73 Cb 0.55 0.59 -0.04 0.00 1.55 0.00 0.00 27.41 30.06 1abb h HIS 73 CO 0.02 -0.40 0.47 1.88 -1.30 0.00 0.00 177.93 178.61 1abb h TYR 74 N -0.07 0.78 0.00 5.26 0.05 -1.03 -0.51 116.97 121.45 1abb h TYR 74 Ca 0.29 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 59.01 1abb h TYR 74 Cb 0.57 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 1abb h TYR 74 CO -0.79 0.42 -0.39 1.88 -1.05 0.00 0.00 178.16 178.23 1abb h TYR 75 N 0.78 0.00 0.00 4.88 -1.99 0.23 -0.11 116.97 120.76 1abb h TYR 75 Ca 0.30 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.87 1abb h TYR 75 Cb 0.21 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.91 1abb h TYR 75 CO -0.00 0.39 -1.05 0.93 -0.00 0.00 0.00 178.16 178.43 1abb h GLU 76 N 0.00 0.00 -0.00 4.88 4.39 0.12 -3.37 114.58 120.60 1abb h GLU 76 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1abb h GLU 76 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1abb h GLU 76 CO 0.05 0.49 -0.93 1.17 -1.16 0.00 0.00 179.01 178.63 1abb n LYS 77 N -3.09 0.14 -3.90 2.33 3.00 -0.28 -5.03 118.16 111.32 1abb n LYS 77 Ca -0.05 -0.11 -0.25 0.00 -0.00 0.00 0.00 58.31 57.90 1abb n LYS 77 Cb 0.84 -1.50 -0.01 0.00 0.00 0.00 0.00 35.03 34.36 1abb n LYS 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1abb n ASP 78 N -1.33 -0.56 -4.61 3.14 2.03 -0.06 -4.96 116.55 110.20 1abb n ASP 78 Ca 0.05 -0.97 -0.28 0.00 0.52 0.00 0.00 54.79 54.10 1abb n ASP 78 Cb 0.35 -3.25 0.20 0.00 -0.72 0.00 0.00 41.12 37.70 1abb n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1abb s PRO 79 N -6.43 -0.05 0.10 -0.67 0.04 -1.26 -4.92 135.00 121.81 1abb s PRO 79 Ca 0.01 0.62 -0.31 0.00 0.04 0.00 0.00 61.00 61.37 1abb s PRO 79 Cb -0.00 -1.67 -0.07 0.00 0.04 0.00 0.00 34.50 32.80 1abb s PRO 79 CO 0.87 -3.08 1.23 0.21 0.04 0.00 0.00 177.00 176.27 1abb s LYS 80 N -4.80 4.43 -0.17 4.56 2.20 -1.26 -4.98 119.74 119.73 1abb s LYS 80 Ca 0.66 1.84 -0.14 0.00 -0.36 0.00 0.00 55.97 57.97 1abb s LYS 80 Cb -0.21 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.76 1abb s LYS 80 CO 0.60 -0.24 0.32 1.03 -0.36 0.00 0.00 175.35 176.70 1abb s ARG 81 N 0.75 4.25 -0.12 4.03 0.52 -0.60 -4.46 118.95 123.32 1abb s ARG 81 Ca 0.58 0.13 -0.02 0.00 -0.52 0.00 0.00 55.73 55.91 1abb s ARG 81 Cb -0.31 -3.45 -0.03 0.00 0.52 0.00 0.00 34.95 31.68 1abb s ARG 81 CO 0.31 0.18 -0.05 -1.50 0.02 0.00 0.00 175.30 174.26 1abb s ILE 82 N 0.65 3.86 -0.19 1.52 -1.16 -0.03 -2.34 121.20 123.51 1abb s ILE 82 Ca 0.17 -0.39 -0.01 0.00 -0.51 0.00 0.00 60.65 59.92 1abb s ILE 82 Cb -0.13 -2.64 0.01 0.00 0.61 0.00 0.00 42.46 40.30 1abb s ILE 82 CO 0.05 0.55 -0.14 -0.31 -2.81 0.00 0.00 174.94 172.27 1abb s TYR 83 N -0.21 2.83 -0.42 3.50 2.02 -0.03 -0.57 117.35 124.47 1abb s TYR 83 Ca 0.04 -1.35 -0.20 0.00 -0.37 0.00 0.00 57.07 55.19 1abb s TYR 83 Cb -0.13 -1.97 0.02 0.00 -0.40 0.00 0.00 41.96 39.48 1abb s TYR 83 CO 0.02 -0.69 0.61 -0.47 -1.57 0.00 0.00 175.55 173.46 1abb s TYR 84 N 1.29 3.09 -0.41 2.71 5.04 0.19 -1.33 117.35 127.93 1abb s TYR 84 Ca 0.04 -0.05 -0.16 0.00 -2.44 0.00 0.00 57.07 54.47 1abb s TYR 84 Cb -0.14 -3.25 0.02 0.00 0.35 0.00 0.00 41.96 38.94 1abb s TYR 84 CO -0.08 -0.81 0.34 -0.51 -1.34 0.00 0.00 175.55 173.15 1abb s LEU 85 N 2.71 4.96 0.01 6.97 1.43 0.83 -2.44 118.68 133.15 1abb s LEU 85 Ca 0.21 -0.76 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 1abb s LEU 85 Cb -0.15 -2.24 -0.01 0.00 0.03 0.00 0.00 46.19 43.83 1abb s LEU 85 CO 0.18 -0.47 -0.07 -0.55 0.23 0.00 0.00 176.35 175.67 1abb s SER 86 N 1.73 0.82 -0.02 2.29 0.15 -1.14 -2.27 113.70 115.25 1abb s SER 86 Ca 0.08 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.50 1abb s SER 86 Cb -0.18 -0.05 0.13 0.00 -1.71 0.00 0.00 66.02 64.21 1abb s SER 86 CO 0.11 -0.01 0.88 0.18 1.20 0.00 0.00 173.24 175.60 1abb n LEU 87 N 2.43 1.34 -3.66 3.45 4.32 -1.26 -3.97 117.00 119.66 1abb n LEU 87 Ca -0.16 -0.68 -0.08 0.00 -0.02 0.00 0.00 56.01 55.08 1abb n LEU 87 Cb 0.57 -0.34 -0.09 0.00 -1.62 0.00 0.00 43.42 41.94 1abb n LEU 87 CO 0.24 0.25 0.09 -0.70 -1.22 0.00 0.00 177.39 176.05 1abb s GLU 88 N -1.53 0.40 -0.17 3.23 2.12 -1.26 -4.77 118.70 116.72 1abb s GLU 88 Ca 0.09 1.07 -0.02 0.00 0.36 0.00 0.00 54.97 56.47 1abb s GLU 88 Cb 0.06 0.33 0.05 0.00 0.26 0.00 0.00 34.13 34.84 1abb s GLU 88 CO 0.04 -0.22 0.00 -0.06 -0.54 0.00 0.00 175.26 174.48 1abb s PHE 89 N 2.36 1.27 -1.04 5.30 0.40 0.84 -4.19 117.98 122.92 1abb s PHE 89 Ca -0.04 -0.90 -0.11 0.00 -0.60 0.00 0.00 56.93 55.27 1abb s PHE 89 Cb -0.11 -1.12 0.25 0.00 0.51 0.00 0.00 43.02 42.55 1abb s PHE 89 CO -0.14 -0.59 1.05 -0.47 0.70 0.00 0.00 175.22 175.77 1abb s TYR 90 N 1.77 4.07 0.02 0.36 6.14 -0.66 -3.36 117.35 125.69 1abb s TYR 90 Ca -0.00 -2.45 -0.21 0.00 0.64 0.00 0.00 57.07 55.05 1abb s TYR 90 Cb -0.16 -3.88 -0.17 0.00 0.42 0.00 0.00 41.96 38.17 1abb s TYR 90 CO -0.07 -1.01 1.25 0.52 0.64 0.00 0.00 175.55 176.89 1abb h MET 91 N 7.04 0.32 -3.78 4.97 2.86 -1.87 -3.39 114.93 121.07 1abb h MET 91 Ca 0.17 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1abb h MET 91 Cb 0.92 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1abb h MET 91 CO 0.96 0.81 -0.90 0.41 1.06 0.00 0.00 176.91 179.26 1abb n GLY 92 N 0.46 -4.06 0.00 8.32 0.00 -1.26 -4.86 105.19 103.79 1abb n GLY 92 Ca -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1abb n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1abb n ARG 93 N -1.65 0.00 0.08 1.61 1.74 -1.25 -4.56 116.66 112.63 1abb n ARG 93 Ca 0.00 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.09 1abb n ARG 93 Cb 0.20 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.60 1abb n ARG 93 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1abb h THR 94 N 2.03 0.67 0.07 0.55 2.02 -1.89 -3.42 112.91 112.95 1abb h THR 94 Ca 0.00 -2.11 -0.00 0.00 0.77 0.00 0.00 66.41 65.07 1abb h THR 94 Cb 0.00 2.20 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1abb h THR 94 CO 0.00 0.38 -0.03 0.25 0.37 0.00 0.00 175.52 176.49 1abb h LEU 95 N 0.00 -0.08 -1.56 2.58 6.46 -1.96 -1.37 115.31 119.39 1abb h LEU 95 Ca -0.09 -0.54 0.08 0.00 -0.12 0.00 0.00 57.88 57.20 1abb h LEU 95 Cb 1.50 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 41.41 1abb h LEU 95 CO 0.06 0.59 0.41 -0.61 -0.62 0.00 0.00 178.44 178.26 1abb h GLN 96 N -0.83 0.51 -0.43 1.25 4.15 -1.96 -2.30 115.11 115.51 1abb h GLN 96 Ca -0.01 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.26 1abb h GLN 96 Cb 0.62 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 1abb h GLN 96 CO 0.02 0.34 -0.22 -0.97 -1.93 0.00 0.00 178.83 176.06 1abb h ASN 97 N 0.52 0.89 0.19 -0.69 -0.73 -1.81 -2.48 115.58 111.48 1abb h ASN 97 Ca 0.28 -0.33 -0.13 0.00 1.87 0.00 0.00 56.30 57.99 1abb h ASN 97 Cb 0.40 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 1abb h ASN 97 CO -0.08 1.08 -0.48 0.74 -0.37 0.00 0.00 177.43 178.31 1abb h THR 98 N 0.75 1.33 0.01 -3.57 2.02 -0.88 -3.09 112.91 109.49 1abb h THR 98 Ca 0.10 -1.70 -0.00 0.00 0.77 0.00 0.00 66.41 65.58 1abb h THR 98 Cb 0.77 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1abb h THR 98 CO 0.06 0.51 -0.01 0.24 0.37 0.00 0.00 175.52 176.70 1abb h MET 99 N 0.27 -0.02 -0.73 6.66 2.86 -1.14 -3.22 114.93 119.62 1abb h MET 99 Ca 0.01 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.74 1abb h MET 99 Cb 0.95 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.54 1abb h MET 99 CO 0.08 0.50 0.38 -0.39 1.06 0.00 0.00 176.91 178.54 1abb h VAL 100 N -0.55 0.88 0.00 -2.22 -1.51 -1.56 -0.37 116.25 110.92 1abb h VAL 100 Ca -0.00 -0.22 -0.01 0.00 -1.23 0.00 0.00 66.70 65.23 1abb h VAL 100 Cb 0.53 0.17 -0.00 0.00 -2.13 0.00 0.00 31.29 29.86 1abb h VAL 100 CO 0.00 0.12 -0.07 0.78 -1.23 0.00 0.00 177.57 177.18 1abb h ASN 101 N 0.66 0.00 -0.27 4.19 4.21 -1.62 -1.33 115.58 121.41 1abb h ASN 101 Ca 0.35 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.86 1abb h ASN 101 Cb 0.33 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.53 1abb h ASN 101 CO -0.25 0.07 0.00 0.18 -1.29 0.00 0.00 177.43 176.14 1abb n LEU 102 N -3.45 3.37 0.00 1.61 4.32 -0.50 -0.33 117.00 122.02 1abb n LEU 102 Ca -0.02 -2.59 0.00 0.00 -0.02 0.00 0.00 56.01 53.38 1abb n LEU 102 Cb 0.20 -0.40 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 1abb n LEU 102 CO 0.27 0.69 0.00 0.00 -1.22 0.00 0.00 177.39 177.13 1abb n ALA 103 N -0.17 0.00 0.89 -1.18 0.00 -0.31 -4.81 120.51 114.94 1abb n ALA 103 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.64 1abb n ALA 103 Cb 0.68 -0.27 0.20 0.00 0.00 0.00 0.00 19.45 20.06 1abb n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1abb n LEU 104 N 0.00 0.00 -0.12 0.00 4.77 -0.30 -4.10 117.00 117.24 1abb n LEU 104 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1abb n LEU 104 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1abb n LEU 104 CO 0.00 0.00 0.87 -0.08 -1.33 0.00 0.00 177.39 176.85 1abb h GLU 105 N 0.00 0.58 0.54 3.23 4.81 -1.87 -1.87 114.58 119.99 1abb h GLU 105 Ca 0.00 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1abb h GLU 105 Cb 0.00 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1abb h GLU 105 CO 0.00 0.60 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.68 1abb h ASN 106 N 0.44 -0.70 -0.57 1.04 4.21 -1.95 -1.94 115.58 116.12 1abb h ASN 106 Ca 0.12 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 57.64 1abb h ASN 106 Cb 0.27 0.19 -0.03 0.00 -1.12 0.00 0.00 38.32 37.63 1abb h ASN 106 CO -0.00 -0.47 0.30 0.00 -1.29 0.00 0.00 177.43 175.96 1abb h ALA 107 N -0.32 1.41 0.00 -0.83 0.00 -1.77 -1.94 119.26 115.80 1abb h ALA 107 Ca -0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1abb h ALA 107 Cb 0.61 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1abb h ALA 107 CO 0.10 0.47 -0.20 0.00 0.00 0.00 0.00 179.25 179.62 1abb h ASP 109 N 0.00 -0.01 0.20 0.00 3.58 -0.59 0.29 116.42 119.89 1abb h ASP 109 Ca -0.00 -0.49 0.01 0.00 0.42 0.00 0.00 57.03 56.96 1abb h ASP 109 Cb 0.50 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.51 1abb h ASP 109 CO 0.03 0.49 -0.48 -0.08 -2.88 0.00 0.00 179.24 176.32 1abb h GLU 110 N -0.53 -0.74 -0.35 0.28 4.22 -1.01 0.23 114.58 116.68 1abb h GLU 110 Ca -0.00 0.05 0.08 0.00 0.08 0.00 0.00 59.36 59.57 1abb h GLU 110 Cb 0.51 0.17 -0.08 0.00 0.50 0.00 0.00 28.75 29.84 1abb h GLU 110 CO 0.00 -0.49 -0.26 0.00 -2.18 0.00 0.00 179.01 176.08 1abb h ALA 111 N -0.45 -0.07 -0.11 2.92 0.00 -1.13 -0.97 119.26 119.45 1abb h ALA 111 Ca -0.01 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1abb h ALA 111 Cb 0.75 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1abb h ALA 111 CO -0.22 -0.65 -0.39 1.79 0.00 0.00 0.00 179.25 179.77 1abb h THR 112 N -0.21 1.30 -0.17 0.00 1.35 -0.25 -2.30 112.91 112.63 1abb h THR 112 Ca 0.17 -1.47 0.01 0.00 -0.55 0.00 0.00 66.41 64.57 1abb h THR 112 Cb 0.48 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.55 1abb h THR 112 CO -0.48 0.44 0.08 0.22 -0.25 0.00 0.00 175.52 175.54 1abb h TYR 113 N 0.20 0.16 -0.51 4.73 3.20 0.08 0.24 116.97 125.06 1abb h TYR 113 Ca 0.02 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1abb h TYR 113 Cb 0.78 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 1abb h TYR 113 CO 0.01 0.09 0.33 1.96 -1.64 0.00 0.00 178.16 178.92 1abb h GLN 114 N 0.18 0.65 0.00 1.82 4.20 -0.95 0.26 115.11 121.28 1abb h GLN 114 Ca 0.07 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1abb h GLN 114 Cb 0.01 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.64 1abb h GLN 114 CO -0.05 0.43 0.00 -0.07 -0.67 0.00 0.00 178.83 178.48 1abb h LEU 115 N 0.67 0.00 -2.72 1.46 3.38 -0.93 -3.45 115.31 113.72 1abb h LEU 115 Ca 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1abb h LEU 115 Cb -0.05 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.72 1abb h LEU 115 CO -0.05 0.00 -0.09 0.61 0.09 0.00 0.00 178.44 178.99 1abb n GLY 116 N -0.95 0.62 2.92 0.83 0.00 0.92 -5.09 105.19 104.45 1abb n GLY 116 Ca -0.02 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 1abb n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1abb s LEU 117 N -3.08 2.11 -0.43 0.99 1.43 -0.15 -5.01 118.68 114.55 1abb s LEU 117 Ca 0.04 -0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 52.74 1abb s LEU 117 Cb -0.01 0.05 0.03 0.00 0.03 0.00 0.00 46.19 46.29 1abb s LEU 117 CO 0.08 -0.14 0.42 -0.62 0.23 0.00 0.00 176.35 176.32 1abb s ASP 118 N -0.68 6.18 0.58 2.29 2.15 -1.26 -3.28 116.67 122.65 1abb s ASP 118 Ca -0.07 -0.78 0.27 0.00 0.43 0.00 0.00 52.55 52.40 1abb s ASP 118 Cb -0.05 -2.21 1.63 0.00 -0.30 0.00 0.00 42.92 42.00 1abb s ASP 118 CO -0.00 -0.58 2.15 -0.03 -0.17 0.00 0.00 175.17 176.54 1abb h MET 119 N 8.73 0.00 0.00 4.34 1.85 -1.92 0.16 114.93 128.09 1abb h MET 119 Ca -0.27 0.00 -0.16 0.00 -0.61 0.00 0.00 59.70 58.66 1abb h MET 119 Cb 1.11 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.12 1abb h MET 119 CO 0.80 0.00 -0.78 0.93 -0.40 0.00 0.00 176.91 177.46 1abb h GLU 120 N 0.00 0.00 -0.33 0.39 5.08 -2.00 -2.20 114.58 115.52 1abb h GLU 120 Ca 0.06 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1abb h GLU 120 Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 1abb h GLU 120 CO -0.00 0.78 0.12 0.93 -1.00 0.00 0.00 179.01 179.83 1abb h GLU 121 N 0.00 0.25 -0.46 2.33 4.39 -1.12 -2.94 114.58 117.03 1abb h GLU 121 Ca -0.01 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.56 1abb h GLU 121 Cb 1.40 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.98 1abb h GLU 121 CO 0.10 0.17 -0.17 -0.07 -1.16 0.00 0.00 179.01 177.88 1abb h LEU 122 N 0.26 0.91 -0.76 1.33 3.38 -1.41 -3.09 115.31 115.93 1abb h LEU 122 Ca 0.15 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1abb h LEU 122 Cb 0.12 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1abb h LEU 122 CO -0.15 1.07 0.29 -0.33 0.09 0.00 0.00 178.44 179.40 1abb h GLU 123 N 0.79 1.15 0.00 1.13 5.08 -1.23 -3.00 114.58 118.51 1abb h GLU 123 Ca 0.12 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1abb h GLU 123 Cb 0.71 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1abb h GLU 123 CO 0.05 0.94 0.00 0.39 -1.00 0.00 0.00 179.01 179.40 1abb n GLU 124 N -4.30 0.19 0.00 2.33 -0.58 -1.14 -2.35 120.64 114.79 1abb n GLU 124 Ca 0.06 0.16 0.13 0.00 -0.42 0.00 0.00 57.16 57.09 1abb n GLU 124 Cb 0.19 -1.50 0.42 0.00 -0.57 0.00 0.00 31.44 29.98 1abb n GLU 124 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1abb n ILE 125 N -1.27 0.00 -2.82 -3.67 2.08 -1.13 -4.91 119.36 107.65 1abb n ILE 125 Ca 0.06 -0.02 -0.37 0.00 0.56 0.00 0.00 62.75 62.98 1abb n ILE 125 Cb 0.09 0.01 -0.06 0.00 -0.75 0.00 0.00 39.64 38.93 1abb n ILE 125 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1abb s GLU 126 N -2.86 4.58 0.20 0.38 2.12 -0.99 -5.00 118.70 117.12 1abb s GLU 126 Ca 0.16 1.29 -0.17 0.00 0.36 0.00 0.00 54.97 56.61 1abb s GLU 126 Cb 0.18 -2.88 -0.08 0.00 0.26 0.00 0.00 34.13 31.62 1abb s GLU 126 CO 0.60 0.33 0.66 -1.21 -0.54 0.00 0.00 175.26 175.10 1abb s GLU 127 N -1.92 4.13 -0.18 4.30 0.41 -1.26 -4.88 118.70 119.29 1abb s GLU 127 Ca 0.48 0.71 -0.29 0.00 -0.41 0.00 0.00 54.97 55.46 1abb s GLU 127 Cb -0.19 -2.87 -0.03 0.00 -1.78 0.00 0.00 34.13 29.26 1abb s GLU 127 CO 0.24 0.41 1.48 -0.51 -0.49 0.00 0.00 175.26 176.39 1abb s ASP 128 N -1.72 6.65 -0.51 -0.19 1.11 -1.26 -3.92 116.67 116.82 1abb s ASP 128 Ca 0.42 1.72 -0.30 0.00 0.18 0.00 0.00 52.55 54.57 1abb s ASP 128 Cb -0.16 -2.54 -0.11 0.00 1.07 0.00 0.00 42.92 41.19 1abb s ASP 128 CO 0.20 -1.02 2.38 0.00 1.18 0.00 0.00 175.17 177.92 1abb n ALA 129 N 7.51 0.91 -0.20 5.23 0.00 -1.26 -4.77 120.51 127.92 1abb n ALA 129 Ca 0.16 -0.50 -0.04 0.00 0.00 0.00 0.00 53.44 53.07 1abb n ALA 129 Cb 0.45 -2.83 -0.02 0.00 0.00 0.00 0.00 19.45 17.05 1abb n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1abb n GLY 130 N 6.22 1.65 1.08 0.00 0.00 -1.26 -4.00 105.19 108.87 1abb n GLY 130 Ca 0.43 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 46.29 1abb n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1abb n LEU 131 N 3.60 3.88 0.00 0.99 4.32 -1.26 -3.65 117.00 124.87 1abb n LEU 131 Ca 0.10 -2.41 -0.05 0.00 -0.02 0.00 0.00 56.01 53.64 1abb n LEU 131 Cb 0.12 -0.45 0.02 0.00 -1.62 0.00 0.00 43.42 41.50 1abb n LEU 131 CO 0.35 0.76 0.66 0.61 -1.22 0.00 0.00 177.39 178.55 1abb n GLY 132 N 0.54 0.80 1.06 -0.72 0.00 -1.21 -0.11 105.19 105.55 1abb n GLY 132 Ca 0.20 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1abb n GLY 132 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1abb n ASN 133 N -1.35 0.25 0.00 1.61 5.15 -1.26 -4.69 115.26 114.96 1abb n ASN 133 Ca -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 1abb n ASN 133 Cb 0.55 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.80 1abb n ASN 133 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1abb n GLY 134 N 1.75 5.42 0.22 8.20 0.00 -1.26 -5.00 105.19 114.51 1abb n GLY 134 Ca 0.00 -1.28 0.07 0.00 0.00 0.00 0.00 46.02 44.82 1abb n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1abb h GLY 135 N 0.00 0.00 1.38 -0.02 0.00 -2.02 -0.95 103.07 101.47 1abb h GLY 135 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1abb h GLY 135 CO 0.00 0.00 -0.18 -2.00 0.00 0.00 0.00 176.54 174.36 1abb h LEU 136 N 0.00 0.72 -0.01 3.11 7.12 -1.95 -1.60 115.31 122.69 1abb h LEU 136 Ca -0.00 -0.24 -0.03 0.00 0.13 0.00 0.00 57.88 57.75 1abb h LEU 136 Cb 0.54 -0.20 0.00 0.00 -0.53 0.00 0.00 40.66 40.48 1abb h LEU 136 CO 0.03 0.90 -0.10 1.23 -0.13 0.00 0.00 178.44 180.37 1abb h GLY 137 N 0.98 0.09 1.62 3.75 0.00 -1.56 -3.11 103.07 104.83 1abb h GLY 137 Ca 0.10 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 1abb h GLY 137 CO 0.05 0.13 0.04 -0.09 0.00 0.00 0.00 176.54 176.66 1abb h ARG 138 N -0.60 0.48 0.20 4.80 9.65 -1.21 -1.61 114.38 126.08 1abb h ARG 138 Ca -0.01 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 1abb h ARG 138 Cb 0.82 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1abb h ARG 138 CO 0.02 0.48 -0.10 1.25 2.80 0.00 0.00 179.97 184.43 1abb h LEU 139 N 0.47 -0.23 -1.02 3.80 5.85 -1.32 -1.32 115.31 121.54 1abb h LEU 139 Ca 0.11 -0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.95 1abb h LEU 139 Cb 0.25 0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.25 1abb h LEU 139 CO 0.00 -0.12 0.62 0.00 -0.34 0.00 0.00 178.44 178.60 1abb h ALA 140 N 0.48 1.59 -0.29 1.25 0.00 -1.42 0.39 119.26 121.27 1abb h ALA 140 Ca -0.03 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1abb h ALA 140 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1abb h ALA 140 CO 0.05 0.11 -0.03 0.00 0.00 0.00 0.00 179.25 179.37 1abb h ALA 141 N 1.58 0.40 0.34 0.00 0.00 -1.34 -1.20 119.26 119.04 1abb h ALA 141 Ca 0.53 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1abb h ALA 141 Cb 0.66 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1abb h ALA 141 CO -0.31 0.18 -0.25 0.00 0.00 0.00 0.00 179.25 178.88 1abb h PHE 143 N -0.58 0.75 -0.42 0.00 -1.00 -0.36 0.84 116.94 116.16 1abb h PHE 143 Ca -0.03 0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1abb h PHE 143 Cb 0.50 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.85 1abb h PHE 143 CO -0.12 0.06 0.17 -0.07 -1.61 0.00 0.00 178.31 176.74 1abb h LEU 144 N 0.52 0.59 -0.92 1.54 3.38 -0.25 0.31 115.31 120.47 1abb h LEU 144 Ca 0.53 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 58.24 1abb h LEU 144 Cb 0.92 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1abb h LEU 144 CO -0.46 0.60 -0.22 -0.78 0.09 0.00 0.00 178.44 177.67 1abb h ASP 145 N 0.54 0.54 -0.15 -0.43 1.82 -0.01 -2.43 116.42 116.30 1abb h ASP 145 Ca 0.14 -0.18 -0.17 0.00 -0.39 0.00 0.00 57.03 56.43 1abb h ASP 145 Cb 0.19 -0.15 0.01 0.00 0.68 0.00 0.00 39.33 40.06 1abb h ASP 145 CO -0.01 0.76 -0.59 0.28 -1.61 0.00 0.00 179.24 178.07 1abb h SER 146 N 0.48 0.78 -0.04 2.28 0.02 0.22 -1.02 113.55 116.27 1abb h SER 146 Ca 0.07 -0.62 -0.01 0.00 -0.84 0.00 0.00 61.79 60.40 1abb h SER 146 Cb 0.64 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 1abb h SER 146 CO 0.05 1.26 0.01 0.24 -1.14 0.00 0.00 176.83 177.25 1abb h MET 147 N 0.34 0.10 0.06 3.45 2.86 -0.08 -1.38 114.93 120.27 1abb h MET 147 Ca -0.03 -0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 1abb h MET 147 Cb 1.22 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 1abb h MET 147 CO 0.12 0.10 -0.70 0.00 1.06 0.00 0.00 176.91 177.49 1abb h ALA 148 N 1.92 0.05 0.00 6.32 0.00 -1.40 0.27 119.26 126.43 1abb h ALA 148 Ca 0.03 -0.78 -0.00 0.00 0.00 0.00 0.00 54.91 54.15 1abb h ALA 148 Cb 0.05 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1abb h ALA 148 CO -0.00 0.38 -0.01 1.15 0.00 0.00 0.00 179.25 180.76 1abb h THR 149 N -0.70 0.42 -0.90 0.00 2.02 -0.59 -2.13 112.91 111.03 1abb h THR 149 Ca -0.15 -0.07 -0.62 0.00 0.77 0.00 0.00 66.41 66.34 1abb h THR 149 Cb 1.37 1.04 -0.33 0.00 -1.74 0.00 0.00 68.15 68.49 1abb h THR 149 CO 0.02 0.01 0.27 0.18 0.37 0.00 0.00 175.52 176.37 1abb n LEU 150 N -3.66 6.64 -2.51 2.58 4.77 -0.57 -4.61 117.00 119.64 1abb n LEU 150 Ca -0.03 -4.41 -0.13 0.00 -0.03 0.00 0.00 56.01 51.41 1abb n LEU 150 Cb 0.10 -0.75 -0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1abb n LEU 150 CO 0.26 1.67 -0.14 0.61 -1.33 0.00 0.00 177.39 178.46 1abb n GLY 151 N -0.86 -0.50 3.74 -0.72 0.00 -0.80 -2.82 105.19 103.23 1abb n GLY 151 Ca 0.56 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 46.20 1abb n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1abb s LEU 152 N -5.67 4.35 -1.21 0.99 1.43 0.97 -4.82 118.68 114.72 1abb s LEU 152 Ca 0.03 1.08 -0.16 0.00 -1.03 0.00 0.00 54.13 54.05 1abb s LEU 152 Cb -0.02 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 1abb s LEU 152 CO 0.04 0.01 2.20 0.00 0.23 0.00 0.00 176.35 178.83 1abb n ALA 153 N 3.27 4.96 -2.59 4.21 0.00 -1.26 -4.50 120.51 124.59 1abb n ALA 153 Ca -0.05 -3.52 -0.23 0.00 0.00 0.00 0.00 53.44 49.64 1abb n ALA 153 Cb 0.51 -3.52 -0.07 0.00 0.00 0.00 0.00 19.45 16.38 1abb n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1abb s ALA 154 N 3.70 3.35 -0.07 0.00 0.00 -1.26 -0.85 121.76 126.63 1abb s ALA 154 Ca 0.52 -1.74 -0.09 0.00 0.00 0.00 0.00 51.96 50.65 1abb s ALA 154 Cb 0.14 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.52 1abb s ALA 154 CO -0.01 0.15 0.24 0.71 0.00 0.00 0.00 175.76 176.84 1abb s TYR 155 N -2.37 -0.21 -0.05 0.00 2.02 0.26 -4.11 117.35 112.89 1abb s TYR 155 Ca 0.35 0.49 0.05 0.00 -0.37 0.00 0.00 57.07 57.58 1abb s TYR 155 Cb -0.04 0.07 -0.02 0.00 -0.40 0.00 0.00 41.96 41.57 1abb s TYR 155 CO 0.21 -0.19 -0.18 0.20 -1.57 0.00 0.00 175.55 174.03 1abb s GLY 156 N -0.27 1.45 -0.09 0.71 0.00 -0.19 -0.64 107.32 108.28 1abb s GLY 156 Ca -0.04 -1.01 -0.01 0.00 0.00 0.00 0.00 44.72 43.66 1abb s GLY 156 CO 0.01 -0.75 -0.04 -0.19 0.00 0.00 0.00 173.10 172.13 1abb s TYR 157 N -0.56 1.09 0.00 1.90 1.51 -1.02 -1.44 117.35 118.83 1abb s TYR 157 Ca 0.08 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1abb s TYR 157 Cb -0.11 -1.02 0.00 0.00 -0.11 0.00 0.00 41.96 40.72 1abb s TYR 157 CO 0.01 -0.42 0.00 0.41 -1.11 0.00 0.00 175.55 174.44 1abb n GLY 158 N 5.02 5.01 3.54 0.71 0.00 -1.20 -2.87 105.19 115.40 1abb n GLY 158 Ca -0.10 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 1abb n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1abb s ILE 159 N 0.82 3.15 -0.24 -0.61 1.01 -1.26 -2.31 121.20 121.76 1abb s ILE 159 Ca 0.00 -1.35 -0.14 0.00 0.00 0.00 0.00 60.65 59.16 1abb s ILE 159 Cb 0.00 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1abb s ILE 159 CO 0.00 0.12 0.32 -0.60 0.00 0.00 0.00 174.94 174.78 1abb s ARG 160 N -2.14 4.07 -0.23 2.79 3.52 0.12 -4.54 118.95 122.54 1abb s ARG 160 Ca 0.20 0.00 -0.10 0.00 -0.13 0.00 0.00 55.73 55.70 1abb s ARG 160 Cb -0.11 -3.59 -0.05 0.00 -1.56 0.00 0.00 34.95 29.64 1abb s ARG 160 CO 0.12 -0.12 0.14 0.71 -0.81 0.00 0.00 175.30 175.34 1abb s TYR 161 N 1.59 3.30 0.23 5.12 2.02 -1.26 -4.68 117.35 123.67 1abb s TYR 161 Ca 0.14 0.18 0.04 0.00 -0.37 0.00 0.00 57.07 57.06 1abb s TYR 161 Cb -0.15 -2.23 0.23 0.00 -0.40 0.00 0.00 41.96 39.41 1abb s TYR 161 CO 0.08 0.08 1.55 0.93 -1.57 0.00 0.00 175.55 176.62 1abb h GLU 162 N 7.36 0.25 -0.26 -0.62 5.08 -1.61 -3.35 114.58 121.43 1abb h GLU 162 Ca -0.38 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1abb h GLU 162 Cb 1.17 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1abb h GLU 162 CO 0.67 0.79 0.00 1.19 -1.00 0.00 0.00 179.01 180.66 1abb n PHE 163 N -3.87 0.34 0.00 4.33 3.72 -0.99 -3.96 117.46 117.03 1abb n PHE 163 Ca -0.02 -0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.07 1abb n PHE 163 Cb 0.62 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 1abb n PHE 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1abb n GLY 164 N 0.75 2.53 3.39 1.37 0.00 -1.24 -2.64 105.19 109.36 1abb n GLY 164 Ca 0.12 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1abb n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1abb s ILE 165 N 0.00 0.02 1.04 -0.61 -1.16 -1.26 -2.04 121.20 117.19 1abb s ILE 165 Ca 0.00 -1.60 -0.14 0.00 -0.51 0.00 0.00 60.65 58.40 1abb s ILE 165 Cb 0.00 -2.18 0.12 0.00 0.61 0.00 0.00 42.46 41.01 1abb s ILE 165 CO 0.00 -0.10 0.52 2.22 -2.81 0.00 0.00 174.94 174.77 1abb n PHE 166 N -0.29 -1.02 -3.97 3.50 -1.74 -1.26 -4.24 117.46 108.44 1abb n PHE 166 Ca -0.02 0.16 -0.31 0.00 -0.56 0.00 0.00 57.45 56.72 1abb n PHE 166 Cb 0.63 -1.74 -0.05 0.00 1.52 0.00 0.00 39.48 39.84 1abb n PHE 166 CO 0.00 0.00 0.00 1.21 -0.56 0.00 0.00 176.76 177.41 1abb s ASN 167 N -2.14 6.06 0.13 5.98 3.84 0.12 -4.87 114.94 124.05 1abb s ASN 167 Ca 0.60 0.18 0.03 0.00 0.21 0.00 0.00 52.86 53.88 1abb s ASN 167 Cb -0.19 -1.79 -0.04 0.00 -0.55 0.00 0.00 41.25 38.67 1abb s ASN 167 CO 0.65 0.18 0.22 -1.58 -2.79 0.00 0.00 177.10 173.78 1abb s GLN 168 N -2.40 3.28 -0.25 0.43 0.74 -1.26 -1.11 119.66 119.07 1abb s GLN 168 Ca 0.32 -0.63 -0.12 0.00 0.05 0.00 0.00 55.36 54.99 1abb s GLN 168 Cb -0.13 -2.89 0.09 0.00 1.10 0.00 0.00 33.01 31.18 1abb s GLN 168 CO 0.25 0.54 0.59 0.21 -0.55 0.00 0.00 175.29 176.32 1abb s LYS 169 N -2.97 0.56 -0.16 1.67 2.20 -0.39 -4.76 119.74 115.88 1abb s LYS 169 Ca 0.33 1.19 -0.16 0.00 -0.36 0.00 0.00 55.97 56.98 1abb s LYS 169 Cb -0.11 0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 36.52 1abb s LYS 169 CO 0.27 -0.18 0.37 0.42 -0.36 0.00 0.00 175.35 175.87 1abb s ILE 170 N 2.11 5.24 -0.26 5.43 -1.09 -1.26 -0.07 121.20 131.30 1abb s ILE 170 Ca -0.08 0.70 -0.01 0.00 -2.23 0.00 0.00 60.65 59.03 1abb s ILE 170 Cb -0.09 -3.71 0.08 0.00 -1.58 0.00 0.00 42.46 37.16 1abb s ILE 170 CO -0.17 0.33 0.05 0.00 -1.23 0.00 0.00 174.94 173.92 1abb n GLY 172 N 4.89 1.24 1.96 0.00 0.00 -1.26 -2.54 105.19 109.47 1abb n GLY 172 Ca -0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1abb n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1abb n GLY 173 N -0.93 0.50 3.77 -0.02 0.00 -1.26 -5.01 105.19 102.24 1abb n GLY 173 Ca -0.18 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1abb n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1abb s TRP 174 N -2.00 3.33 0.21 1.61 0.52 -1.05 -3.88 118.94 117.68 1abb s TRP 174 Ca 0.00 0.30 -0.30 0.00 0.02 0.00 0.00 56.10 56.12 1abb s TRP 174 Cb 0.00 -1.82 -0.08 0.00 -1.15 0.00 0.00 33.47 30.42 1abb s TRP 174 CO 0.00 0.57 1.07 -1.14 0.02 0.00 0.00 176.95 177.47 1abb s GLN 175 N -1.18 4.65 -0.06 4.98 0.74 -1.26 -0.90 119.66 126.64 1abb s GLN 175 Ca 0.17 1.69 0.01 0.00 0.05 0.00 0.00 55.36 57.27 1abb s GLN 175 Cb -0.12 -3.26 0.02 0.00 1.10 0.00 0.00 33.01 30.75 1abb s GLN 175 CO 0.06 0.19 -0.06 -1.64 -0.55 0.00 0.00 175.29 173.29 1abb s MET 176 N -0.74 1.09 -0.22 1.67 -1.94 0.89 -4.95 119.30 115.09 1abb s MET 176 Ca 0.47 -0.16 -0.24 0.00 -1.71 0.00 0.00 55.69 54.04 1abb s MET 176 Cb -0.29 -1.08 -0.01 0.00 2.01 0.00 0.00 34.83 35.46 1abb s MET 176 CO 0.36 -0.11 0.80 -1.83 -0.01 0.00 0.00 175.02 174.22 1abb s GLU 177 N 1.10 4.21 0.30 2.03 1.03 -1.26 -1.26 118.70 124.85 1abb s GLU 177 Ca -0.08 0.90 0.07 0.00 0.03 0.00 0.00 54.97 55.90 1abb s GLU 177 Cb -0.14 -3.62 -0.03 0.00 -0.80 0.00 0.00 34.13 29.54 1abb s GLU 177 CO -0.01 -0.44 0.28 -1.21 -1.33 0.00 0.00 175.26 172.55 1abb s GLU 178 N 2.56 2.88 0.55 -4.83 2.02 -0.27 -4.91 118.70 116.71 1abb s GLU 178 Ca 0.35 -1.14 -0.08 0.00 0.02 0.00 0.00 54.97 54.11 1abb s GLU 178 Cb -0.16 -2.57 -0.03 0.00 0.10 0.00 0.00 34.13 31.48 1abb s GLU 178 CO 0.09 0.23 0.90 0.00 0.02 0.00 0.00 175.26 176.50 1abb s ALA 179 N -2.21 3.26 -0.87 5.21 0.00 -1.26 0.11 121.76 126.00 1abb s ALA 179 Ca 0.38 -0.37 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 1abb s ALA 179 Cb -0.07 -2.79 0.21 0.00 0.00 0.00 0.00 23.12 20.47 1abb s ALA 179 CO 0.26 -0.56 0.75 -3.47 0.00 0.00 0.00 175.76 172.75 1abb n ASP 180 N -2.51 4.05 -4.49 0.00 2.03 -1.08 -4.56 116.55 109.99 1abb n ASP 180 Ca 0.03 -3.16 -0.44 0.00 0.52 0.00 0.00 54.79 51.75 1abb n ASP 180 Cb 0.55 -1.00 -0.01 0.00 -0.72 0.00 0.00 41.12 39.94 1abb n ASP 180 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 1abb s ASP 181 N -0.44 6.92 0.40 1.67 -4.77 -1.26 -3.64 116.67 115.55 1abb s ASP 181 Ca 0.28 -2.64 0.19 0.00 -3.30 0.00 0.00 52.55 47.08 1abb s ASP 181 Cb -0.06 -2.44 0.83 0.00 -1.09 0.00 0.00 42.92 40.16 1abb s ASP 181 CO -0.13 -0.92 1.82 4.11 0.70 0.00 0.00 175.17 180.74 1abb h TRP 182 N 7.67 0.00 0.00 2.11 5.08 -1.86 -2.85 115.95 126.11 1abb h TRP 182 Ca 0.31 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.28 1abb h TRP 182 Cb 0.91 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.07 1abb h TRP 182 CO 1.18 0.33 0.00 1.28 -1.28 0.00 0.00 178.44 179.95 1abb n LEU 183 N -3.66 0.00 -0.42 0.11 4.77 -1.26 -4.48 117.00 112.05 1abb n LEU 183 Ca -0.01 0.02 0.34 0.00 -0.03 0.00 0.00 56.01 56.33 1abb n LEU 183 Cb 0.44 -0.02 0.63 0.00 -2.33 0.00 0.00 43.42 42.14 1abb n LEU 183 CO 0.36 -0.00 1.25 -0.09 -1.33 0.00 0.00 177.39 177.57 1abb h ARG 184 N 0.00 0.14 -0.48 3.23 2.43 -1.85 -2.31 114.38 115.54 1abb h ARG 184 Ca 0.00 -0.01 -0.35 0.00 -0.81 0.00 0.00 59.98 58.81 1abb h ARG 184 Cb 0.02 -0.03 -0.32 0.00 -0.42 0.00 0.00 29.97 29.21 1abb h ARG 184 CO 0.00 0.09 -0.80 0.66 -1.51 0.00 0.00 179.97 178.41 1abb n TYR 185 N -4.62 1.73 -0.83 2.20 4.01 -1.26 -5.09 117.16 113.31 1abb n TYR 185 Ca 0.34 -1.94 0.03 0.00 -0.16 0.00 0.00 57.90 56.17 1abb n TYR 185 Cb 1.32 -0.29 -0.01 0.00 -0.31 0.00 0.00 39.34 40.05 1abb n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1abb n GLY 186 N -0.72 -2.16 2.87 2.72 0.00 -0.87 -4.90 105.19 102.13 1abb n GLY 186 Ca 0.31 -1.45 -0.24 0.00 0.00 0.00 0.00 46.02 44.63 1abb n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1abb s ASN 187 N -3.08 1.70 0.00 1.61 2.47 -1.26 -4.70 114.94 111.67 1abb s ASN 187 Ca 0.00 -0.19 0.31 0.00 0.42 0.00 0.00 52.86 53.39 1abb s ASN 187 Cb 0.00 -0.63 1.59 0.00 -1.45 0.00 0.00 41.25 40.76 1abb s ASN 187 CO 0.00 -0.12 2.06 -0.81 -3.72 0.00 0.00 177.10 174.51 1abb n PRO 188 N 4.75 0.89 0.02 0.43 -0.04 -1.26 -4.12 135.00 135.67 1abb n PRO 188 Ca -0.14 -0.16 0.02 0.00 -0.04 0.00 0.00 63.50 63.18 1abb n PRO 188 Cb 0.50 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 1abb n PRO 188 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1abb n TRP 189 N -0.92 0.75 -1.82 0.54 7.02 -1.26 -4.90 117.44 116.84 1abb n TRP 189 Ca 0.19 0.24 -0.30 0.00 -1.02 0.00 0.00 57.50 56.62 1abb n TRP 189 Cb 0.20 -0.98 0.05 0.00 -2.42 0.00 0.00 31.31 28.16 1abb n TRP 189 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1abb s GLU 190 N -3.02 2.81 -0.26 -0.99 -1.05 -1.26 -4.54 118.70 110.39 1abb s GLU 190 Ca -0.04 0.52 -0.03 0.00 -0.15 0.00 0.00 54.97 55.28 1abb s GLU 190 Cb 0.09 -2.01 0.08 0.00 -0.44 0.00 0.00 34.13 31.86 1abb s GLU 190 CO 0.82 -1.09 0.09 0.21 0.95 0.00 0.00 175.26 176.24 1abb s LYS 191 N -5.31 0.51 0.14 -4.83 2.36 -0.06 -4.94 119.74 107.60 1abb s LYS 191 Ca 0.58 -0.64 -0.31 0.00 -2.55 0.00 0.00 55.97 53.05 1abb s LYS 191 Cb -0.12 -1.80 -0.11 0.00 -1.05 0.00 0.00 37.83 34.76 1abb s LYS 191 CO 0.52 -0.86 1.79 0.00 1.55 0.00 0.00 175.35 178.35 1abb s ALA 192 N 1.86 3.80 -0.85 3.13 0.00 -1.26 -2.73 121.76 125.71 1abb s ALA 192 Ca 0.05 1.46 0.01 0.00 0.00 0.00 0.00 51.96 53.48 1abb s ALA 192 Cb -0.17 -3.74 0.24 0.00 0.00 0.00 0.00 23.12 19.45 1abb s ALA 192 CO -0.22 -1.14 0.86 0.54 0.00 0.00 0.00 175.76 175.80 1abb n ARG 193 N 5.27 2.82 -0.26 0.00 5.12 -0.95 -4.95 116.66 123.71 1abb n ARG 193 Ca 0.17 -4.54 0.17 0.00 -1.93 0.00 0.00 57.85 51.72 1abb n ARG 193 Cb 0.38 -2.38 0.46 0.00 -1.16 0.00 0.00 32.46 29.76 1abb n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1abb h PRO 194 N 5.41 0.49 -0.06 5.56 0.13 -1.94 -2.59 132.00 139.00 1abb h PRO 194 Ca 0.18 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.29 1abb h PRO 194 Cb 0.74 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 1abb h PRO 194 CO 0.91 0.33 0.05 0.93 -0.23 0.00 0.00 178.00 179.99 1abb h GLU 195 N 0.51 0.00 -0.73 0.86 5.08 -1.97 -1.73 114.58 116.60 1abb h GLU 195 Ca 0.47 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 58.42 1abb h GLU 195 Cb 1.03 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.05 1abb h GLU 195 CO -0.20 0.00 0.29 1.19 -1.00 0.00 0.00 179.01 179.29 1abb n PHE 196 N -4.04 2.30 -2.27 4.33 3.72 -0.98 -5.01 117.46 115.51 1abb n PHE 196 Ca -0.02 -1.96 -0.41 0.00 -0.05 0.00 0.00 57.45 55.02 1abb n PHE 196 Cb 0.15 -0.80 -0.03 0.00 -0.94 0.00 0.00 39.48 37.86 1abb n PHE 196 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1abb s THR 197 N -3.59 3.09 0.10 4.37 2.01 -0.65 -4.38 115.64 116.58 1abb s THR 197 Ca 0.53 1.06 0.08 0.00 0.31 0.00 0.00 61.69 63.67 1abb s THR 197 Cb 0.45 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 1abb s THR 197 CO 0.04 0.24 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.25 1abb s LEU 198 N -1.38 2.29 0.48 4.42 1.43 0.03 -4.93 118.68 121.03 1abb s LEU 198 Ca 0.48 -0.68 -0.08 0.00 -1.03 0.00 0.00 54.13 52.83 1abb s LEU 198 Cb -0.36 -0.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.96 1abb s LEU 198 CO 0.46 0.05 0.83 -2.16 0.23 0.00 0.00 176.35 175.76 1abb s PRO 199 N -1.88 3.63 -0.00 1.29 0.04 -1.26 0.65 135.00 137.46 1abb s PRO 199 Ca 0.06 0.39 0.04 0.00 0.04 0.00 0.00 61.00 61.52 1abb s PRO 199 Cb -0.10 -2.32 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 1abb s PRO 199 CO 0.04 -0.22 -0.12 0.08 0.04 0.00 0.00 177.00 176.82 1abb s VAL 200 N -2.71 0.93 -0.11 -0.36 1.01 -0.61 -4.83 120.40 113.72 1abb s VAL 200 Ca 0.50 -0.54 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 1abb s VAL 200 Cb -0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 1abb s VAL 200 CO 0.42 0.24 -0.08 -1.00 0.00 0.00 0.00 175.10 174.67 1abb s HIS 201 N -0.33 2.91 0.11 5.22 3.76 -1.26 -2.48 115.29 123.22 1abb s HIS 201 Ca 0.04 -0.25 0.05 0.00 -0.15 0.00 0.00 55.06 54.75 1abb s HIS 201 Cb -0.05 -1.81 -0.04 0.00 1.11 0.00 0.00 32.58 31.80 1abb s HIS 201 CO -0.00 0.08 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.77 1abb s PHE 202 N -0.18 1.30 0.00 1.40 0.08 -0.23 -4.93 117.98 115.42 1abb s PHE 202 Ca 0.02 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.49 1abb s PHE 202 Cb -0.13 -0.69 0.00 0.00 -0.57 0.00 0.00 43.02 41.63 1abb s PHE 202 CO 0.03 0.10 0.00 0.66 -0.10 0.00 0.00 175.22 175.91 1abb n TYR 203 N 0.58 0.00 -0.82 0.36 4.01 0.13 -0.35 117.16 121.08 1abb n TYR 203 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1abb n TYR 203 Cb 0.57 0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1abb n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1abb n GLY 204 N 0.00 -1.78 3.39 2.72 0.00 -1.15 -4.57 105.19 103.80 1abb n GLY 204 Ca 0.00 -1.91 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 1abb n GLY 204 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1abb s ARG 205 N 0.00 0.76 -0.42 1.61 3.52 -0.17 -4.88 118.95 119.37 1abb s ARG 205 Ca 0.00 0.30 -0.16 0.00 -0.13 0.00 0.00 55.73 55.74 1abb s ARG 205 Cb 0.00 0.36 0.03 0.00 -1.56 0.00 0.00 34.95 33.77 1abb s ARG 205 CO 0.00 -0.18 0.38 0.08 -0.81 0.00 0.00 175.30 174.77 1abb s VAL 206 N -0.66 5.17 -0.19 7.11 1.01 -1.26 -0.14 120.40 131.44 1abb s VAL 206 Ca -0.08 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 1abb s VAL 206 Cb -0.03 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1abb s VAL 206 CO 0.05 -0.40 1.01 -0.70 0.00 0.00 0.00 175.10 175.05 1abb s GLU 207 N 1.91 4.31 -0.61 2.72 2.12 0.42 -4.82 118.70 124.74 1abb s GLU 207 Ca 0.08 1.33 -0.18 0.00 0.36 0.00 0.00 54.97 56.57 1abb s GLU 207 Cb -0.19 -3.61 0.12 0.00 0.26 0.00 0.00 34.13 30.72 1abb s GLU 207 CO 0.11 -0.51 0.69 -1.01 -0.54 0.00 0.00 175.26 174.00 1abb s HIS 208 N 2.77 3.11 -0.21 5.30 3.76 -1.26 0.10 115.29 128.85 1abb s HIS 208 Ca 0.45 -1.12 0.01 0.00 -0.15 0.00 0.00 55.06 54.24 1abb s HIS 208 Cb -0.16 -3.97 0.03 0.00 1.11 0.00 0.00 32.58 29.59 1abb s HIS 208 CO 0.10 -1.23 -0.14 0.95 -0.85 0.00 0.00 174.74 173.57 1abb s THR 209 N 2.29 2.30 0.00 1.30 -4.23 0.15 -4.94 115.64 112.51 1abb s THR 209 Ca 0.11 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1abb s THR 209 Cb -0.24 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.49 1abb s THR 209 CO 0.04 0.33 0.00 -1.54 -0.54 0.00 0.00 174.62 172.90 1abb n SER 210 N 4.59 0.00 -0.33 3.99 3.41 -1.26 -0.99 113.62 123.03 1abb n SER 210 Ca -0.18 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.51 1abb n SER 210 Cb 0.47 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1abb n SER 210 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1abb n GLN 211 N 0.00 1.59 -3.84 4.33 -0.06 -1.26 -5.02 117.38 113.12 1abb n GLN 211 Ca 0.00 -0.71 -0.05 0.00 -2.00 0.00 0.00 57.00 54.24 1abb n GLN 211 Cb 0.00 -1.31 0.01 0.00 -4.06 0.00 0.00 30.24 24.88 1abb n GLN 211 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 1abb s GLY 212 N -2.10 0.10 0.33 1.69 0.00 -0.17 -5.07 107.32 102.11 1abb s GLY 212 Ca 0.13 -0.35 0.07 0.00 0.00 0.00 0.00 44.72 44.57 1abb s GLY 212 CO 0.48 1.06 0.40 0.00 0.00 0.00 0.00 173.10 175.04 1abb s ALA 213 N -2.54 4.08 -0.03 3.20 0.00 -1.26 0.30 121.76 125.51 1abb s ALA 213 Ca 0.18 -1.51 0.02 0.00 0.00 0.00 0.00 51.96 50.64 1abb s ALA 213 Cb -0.03 -1.50 0.01 0.00 0.00 0.00 0.00 23.12 21.60 1abb s ALA 213 CO 0.06 0.00 -0.07 0.15 0.00 0.00 0.00 175.76 175.90 1abb s LYS 214 N -4.10 0.90 -0.22 0.00 1.02 0.28 -4.82 119.74 112.81 1abb s LYS 214 Ca 0.43 -0.22 -0.16 0.00 0.02 0.00 0.00 55.97 56.04 1abb s LYS 214 Cb -0.08 -0.85 -0.04 0.00 -0.52 0.00 0.00 37.83 36.34 1abb s LYS 214 CO 0.29 0.03 0.40 -0.46 -0.92 0.00 0.00 175.35 174.70 1abb s TRP 215 N 0.46 3.34 0.43 3.18 -0.00 -1.26 0.16 118.94 125.25 1abb s TRP 215 Ca -0.07 0.58 0.03 0.00 -0.00 0.00 0.00 56.10 56.64 1abb s TRP 215 Cb -0.11 -2.55 -0.02 0.00 -0.00 0.00 0.00 33.47 30.79 1abb s TRP 215 CO 0.01 -0.08 0.09 0.14 -0.00 0.00 0.00 176.95 177.10 1abb s VAL 216 N 1.55 0.83 -0.90 5.86 -7.23 0.80 -4.89 120.40 116.43 1abb s VAL 216 Ca 0.18 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.21 1abb s VAL 216 Cb -0.15 -2.34 0.02 0.00 0.56 0.00 0.00 36.38 34.47 1abb s VAL 216 CO 0.08 0.00 0.28 0.47 -0.31 0.00 0.00 175.10 175.62 1abb n ASP 217 N -1.25 -1.43 -4.76 4.85 9.92 -1.26 -1.00 116.55 121.62 1abb n ASP 217 Ca -0.09 -0.87 -0.31 0.00 -0.53 0.00 0.00 54.79 52.99 1abb n ASP 217 Cb 0.66 -1.05 -0.07 0.00 -0.64 0.00 0.00 41.12 40.02 1abb n ASP 217 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1abb s THR 218 N -3.98 4.47 0.58 -3.53 -4.23 -1.26 -2.93 115.64 104.75 1abb s THR 218 Ca 0.20 -0.78 -0.15 0.00 -1.18 0.00 0.00 61.69 59.78 1abb s THR 218 Cb -0.11 -3.14 -0.05 0.00 1.34 0.00 0.00 72.50 70.53 1abb s THR 218 CO 0.66 0.14 1.03 -1.58 -0.54 0.00 0.00 174.62 174.33 1abb s GLN 219 N -2.34 3.51 -0.04 3.99 0.74 0.53 -4.80 119.66 121.25 1abb s GLN 219 Ca 0.28 1.09 0.00 0.00 0.05 0.00 0.00 55.36 56.78 1abb s GLN 219 Cb -0.12 -2.07 0.02 0.00 1.10 0.00 0.00 33.01 31.95 1abb s GLN 219 CO 0.21 -0.64 -0.02 0.08 -0.55 0.00 0.00 175.29 174.37 1abb s VAL 220 N -2.58 0.35 0.17 1.34 1.01 -1.26 -1.06 120.40 118.36 1abb s VAL 220 Ca 0.61 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.67 1abb s VAL 220 Cb -0.14 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1abb s VAL 220 CO 0.37 0.19 0.00 -0.69 0.00 0.00 0.00 175.10 174.98 1abb s VAL 221 N 1.11 3.75 -0.03 2.92 1.01 -1.04 -4.59 120.40 123.53 1abb s VAL 221 Ca -0.08 -1.40 0.06 0.00 0.00 0.00 0.00 61.98 60.56 1abb s VAL 221 Cb -0.14 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 1abb s VAL 221 CO -0.01 -0.10 -0.20 -0.76 0.00 0.00 0.00 175.10 174.02 1abb s LEU 222 N -2.93 2.38 -0.21 3.92 1.43 -0.14 -1.58 118.68 121.56 1abb s LEU 222 Ca 0.27 -0.34 -0.04 0.00 -1.03 0.00 0.00 54.13 53.00 1abb s LEU 222 Cb -0.09 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.67 1abb s LEU 222 CO 0.19 0.33 -0.04 0.00 0.23 0.00 0.00 176.35 177.06 1abb s ALA 223 N -0.67 2.85 -0.20 4.21 0.00 0.21 -0.41 121.76 127.75 1abb s ALA 223 Ca 0.11 -1.11 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 1abb s ALA 223 Cb -0.10 -1.70 -0.05 0.00 0.00 0.00 0.00 23.12 21.28 1abb s ALA 223 CO -0.00 -0.33 0.10 1.41 0.00 0.00 0.00 175.76 176.94 1abb s MET 224 N 1.31 4.06 0.42 0.00 1.75 0.16 -0.79 119.30 126.21 1abb s MET 224 Ca 0.04 -0.29 -0.13 0.00 -1.25 0.00 0.00 55.69 54.06 1abb s MET 224 Cb -0.14 -3.35 -0.07 0.00 2.84 0.00 0.00 34.83 34.11 1abb s MET 224 CO -0.01 0.24 0.82 -1.25 -0.65 0.00 0.00 175.02 174.17 1abb s PRO 225 N 0.51 3.88 -0.05 4.11 0.04 -1.26 -0.45 135.00 141.78 1abb s PRO 225 Ca 0.06 0.65 0.02 0.00 0.04 0.00 0.00 61.00 61.77 1abb s PRO 225 Cb -0.12 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.10 1abb s PRO 225 CO 0.00 -0.06 -0.10 0.71 0.04 0.00 0.00 177.00 177.59 1abb s TYR 226 N -2.36 1.15 -0.11 0.56 1.51 -0.38 -2.25 117.35 115.48 1abb s TYR 226 Ca 0.54 -0.36 -0.01 0.00 -1.01 0.00 0.00 57.07 56.23 1abb s TYR 226 Cb -0.10 -0.86 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 1abb s TYR 226 CO 0.28 -0.20 -0.07 -0.51 -1.11 0.00 0.00 175.55 173.95 1abb s ASP 227 N 0.54 4.59 -0.13 2.29 1.01 -1.10 -2.48 116.67 121.39 1abb s ASP 227 Ca -0.10 -0.11 0.02 0.00 0.71 0.00 0.00 52.55 53.07 1abb s ASP 227 Cb -0.13 -1.46 0.02 0.00 1.01 0.00 0.00 42.92 42.35 1abb s ASP 227 CO 0.02 0.26 -0.17 -0.89 0.21 0.00 0.00 175.17 174.60 1abb s THR 228 N -0.19 1.68 0.17 -1.27 2.01 -0.16 -0.88 115.64 117.00 1abb s THR 228 Ca 0.02 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 61.00 1abb s THR 228 Cb -0.13 -1.53 -0.08 0.00 0.01 0.00 0.00 72.50 70.78 1abb s THR 228 CO 0.03 0.48 0.92 -2.16 -0.69 0.00 0.00 174.62 173.19 1abb s PRO 229 N 1.07 4.75 -0.27 4.92 0.04 -1.26 0.11 135.00 144.35 1abb s PRO 229 Ca -0.04 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.38 1abb s PRO 229 Cb -0.14 -3.32 0.03 0.00 0.04 0.00 0.00 34.50 31.10 1abb s PRO 229 CO -0.04 0.40 -0.01 0.14 0.04 0.00 0.00 177.00 177.53 1abb s VAL 230 N -0.68 3.19 0.09 -0.36 -7.23 0.14 -4.90 120.40 110.64 1abb s VAL 230 Ca 0.42 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 59.28 1abb s VAL 230 Cb -0.24 -2.67 -0.06 0.00 0.56 0.00 0.00 36.38 33.97 1abb s VAL 230 CO 0.30 0.11 1.19 -2.16 -0.31 0.00 0.00 175.10 174.22 1abb s PRO 231 N 1.36 4.46 1.05 4.82 0.04 -1.26 0.57 135.00 146.03 1abb s PRO 231 Ca -0.00 1.78 -0.16 0.00 0.04 0.00 0.00 61.00 62.65 1abb s PRO 231 Cb -0.17 -3.32 0.22 0.00 0.04 0.00 0.00 34.50 31.26 1abb s PRO 231 CO -0.02 -0.20 1.19 0.20 0.04 0.00 0.00 177.00 178.21 1abb s GLY 232 N 0.80 1.65 -0.38 0.56 0.00 -0.60 -4.78 107.32 104.57 1abb s GLY 232 Ca 0.57 -0.93 -0.19 0.00 0.00 0.00 0.00 44.72 44.16 1abb s GLY 232 CO 0.31 -0.17 0.58 -0.47 0.00 0.00 0.00 173.10 173.35 1abb s TYR 233 N -3.38 3.14 -0.14 1.90 5.04 -1.26 -4.48 117.35 118.17 1abb s TYR 233 Ca 0.70 0.12 -0.02 0.00 -2.44 0.00 0.00 57.07 55.44 1abb s TYR 233 Cb -0.09 -3.11 0.02 0.00 0.35 0.00 0.00 41.96 39.13 1abb s TYR 233 CO 0.54 -0.67 0.04 0.54 -1.34 0.00 0.00 175.55 174.66 1abb n ARG 234 N 5.98 -2.78 -0.14 4.97 3.00 0.55 -4.74 116.66 123.50 1abb n ARG 234 Ca -0.03 0.01 0.04 0.00 -0.01 0.00 0.00 57.85 57.86 1abb n ARG 234 Cb 0.48 -4.39 0.11 0.00 0.00 0.00 0.00 32.46 28.67 1abb n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1abb n ASN 235 N -1.53 2.70 0.00 0.55 2.04 -1.26 -4.91 115.26 112.85 1abb n ASN 235 Ca 0.01 -2.14 0.00 0.00 -0.44 0.00 0.00 54.58 52.01 1abb n ASN 235 Cb 0.48 -0.20 0.00 0.00 -2.53 0.00 0.00 39.78 37.54 1abb n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1abb n ASN 236 N 0.03 -3.74 -4.68 0.53 3.02 -1.26 -0.22 115.26 108.94 1abb n ASN 236 Ca 0.09 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.23 1abb n ASN 236 Cb 0.42 -2.59 -0.05 0.00 -0.61 0.00 0.00 39.78 36.96 1abb n ASN 236 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1abb s VAL 237 N -0.74 4.94 -0.24 2.41 -7.23 -1.26 -4.79 120.40 113.49 1abb s VAL 237 Ca 0.00 1.51 0.02 0.00 -1.81 0.00 0.00 61.98 61.70 1abb s VAL 237 Cb 0.00 -4.08 0.05 0.00 0.56 0.00 0.00 36.38 32.91 1abb s VAL 237 CO 0.00 0.09 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.07 1abb s VAL 238 N 1.85 2.03 0.65 1.32 1.01 -1.26 -1.56 120.40 124.45 1abb s VAL 238 Ca 0.36 -1.41 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 1abb s VAL 238 Cb -0.17 -2.10 0.13 0.00 0.00 0.00 0.00 36.38 34.25 1abb s VAL 238 CO 0.13 0.09 0.89 0.59 0.00 0.00 0.00 175.10 176.80 1abb n ASN 239 N 4.51 0.92 -4.49 3.32 4.13 0.19 -4.44 115.26 119.40 1abb n ASN 239 Ca -0.15 -1.84 -0.34 0.00 1.68 0.00 0.00 54.58 53.93 1abb n ASN 239 Cb 0.44 -0.60 -0.12 0.00 -1.54 0.00 0.00 39.78 37.96 1abb n ASN 239 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1abb s THR 240 N -2.72 3.75 -0.18 3.41 2.01 -1.26 -0.68 115.64 119.97 1abb s THR 240 Ca 0.57 -0.42 -0.05 0.00 0.31 0.00 0.00 61.69 62.11 1abb s THR 240 Cb -0.03 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.84 1abb s THR 240 CO 0.38 0.51 -0.01 -0.32 -0.69 0.00 0.00 174.62 174.49 1abb s MET 241 N 0.19 3.66 -0.32 4.92 1.75 0.12 -1.02 119.30 128.59 1abb s MET 241 Ca -0.03 -0.51 0.00 0.00 -1.25 0.00 0.00 55.69 53.91 1abb s MET 241 Cb -0.14 -3.02 0.10 0.00 2.84 0.00 0.00 34.83 34.61 1abb s MET 241 CO 0.03 0.13 0.09 0.50 -0.65 0.00 0.00 175.02 175.12 1abb s ARG 242 N 0.69 0.90 -0.02 4.11 6.06 -0.52 -0.99 118.95 129.19 1abb s ARG 242 Ca -0.01 -1.29 -0.15 0.00 -2.50 0.00 0.00 55.73 51.79 1abb s ARG 242 Cb -0.14 -2.28 -0.05 0.00 0.06 0.00 0.00 34.95 32.53 1abb s ARG 242 CO 0.02 -0.98 0.41 -0.51 -2.50 0.00 0.00 175.30 171.75 1abb s LEU 243 N 1.42 4.44 -0.12 -0.88 2.01 -1.03 -3.24 118.68 121.28 1abb s LEU 243 Ca 0.10 0.93 -0.06 0.00 0.01 0.00 0.00 54.13 55.12 1abb s LEU 243 Cb -0.18 -2.60 -0.04 0.00 0.01 0.00 0.00 46.19 43.39 1abb s LEU 243 CO -0.21 0.28 0.11 0.26 1.01 0.00 0.00 176.35 177.80 1abb s TRP 244 N -0.81 3.48 -0.10 0.29 0.52 -0.98 -1.25 118.94 120.09 1abb s TRP 244 Ca 0.24 0.43 0.02 0.00 0.02 0.00 0.00 56.10 56.80 1abb s TRP 244 Cb -0.16 -1.92 -0.02 0.00 -1.15 0.00 0.00 33.47 30.22 1abb s TRP 244 CO 0.13 0.63 -0.15 0.45 0.02 0.00 0.00 176.95 178.03 1abb s SER 245 N -0.87 3.85 0.09 2.95 0.15 0.40 0.12 113.70 120.39 1abb s SER 245 Ca 0.14 -0.33 -0.22 0.00 0.70 0.00 0.00 55.95 56.23 1abb s SER 245 Cb -0.12 -1.34 -0.07 0.00 -1.71 0.00 0.00 66.02 62.78 1abb s SER 245 CO 0.03 0.22 0.67 0.00 1.20 0.00 0.00 173.24 175.35 1abb s ALA 246 N 0.04 3.50 0.01 5.45 0.00 -1.26 -0.66 121.76 128.84 1abb s ALA 246 Ca -0.06 0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.09 1abb s ALA 246 Cb -0.15 -2.81 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 1abb s ALA 246 CO 0.05 0.28 -0.04 0.15 0.00 0.00 0.00 175.76 176.20 1abb s LYS 247 N -0.82 0.31 0.34 0.00 1.02 0.45 -4.63 119.74 116.41 1abb s LYS 247 Ca 0.33 -0.30 -0.18 0.00 0.02 0.00 0.00 55.97 55.84 1abb s LYS 247 Cb -0.21 -0.20 -0.09 0.00 -0.52 0.00 0.00 37.83 36.81 1abb s LYS 247 CO 0.22 0.05 0.80 0.00 -0.92 0.00 0.00 175.35 175.49 1abb s ALA 248 N -0.51 3.26 -0.02 5.17 0.00 -1.26 -0.97 121.76 127.43 1abb s ALA 248 Ca -0.03 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.79 1abb s ALA 248 Cb -0.04 -2.89 -0.05 0.00 0.00 0.00 0.00 23.12 20.14 1abb s ALA 248 CO -0.00 0.28 1.33 -2.14 0.00 0.00 0.00 175.76 175.23 1abb s PRO 249 N -2.86 4.31 -0.68 0.00 0.02 -1.26 -4.93 135.00 129.60 1abb s PRO 249 Ca 0.55 1.87 -0.01 0.00 0.02 0.00 0.00 61.00 63.42 1abb s PRO 249 Cb -0.11 -3.56 0.43 0.00 0.02 0.00 0.00 34.50 31.28 1abb s PRO 249 CO 0.17 -0.53 1.98 0.09 -0.33 0.00 0.00 177.00 178.39 1abb n ASN 250 N 5.28 7.51 0.16 2.53 5.03 -1.26 -4.32 115.26 130.19 1abb n ASN 250 Ca 0.12 -3.80 0.13 0.00 0.87 0.00 0.00 54.58 51.91 1abb n ASN 250 Cb 0.44 -0.96 0.45 0.00 -1.02 0.00 0.00 39.78 38.70 1abb n ASN 250 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1abb h ASP 251 N 2.18 0.00 -1.01 6.41 3.32 -1.92 -3.42 116.42 121.97 1abb h ASP 251 Ca 0.59 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 57.30 1abb h ASP 251 Cb 0.72 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 1abb h ASP 251 CO 1.52 0.00 1.24 0.49 -1.72 0.00 0.00 179.24 180.77 1abb n PHE 252 N -2.50 1.19 0.00 4.55 3.72 -1.26 -2.28 117.46 120.89 1abb n PHE 252 Ca 0.03 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 1abb n PHE 252 Cb 0.35 -2.50 0.00 0.00 -0.94 0.00 0.00 39.48 36.39 1abb n PHE 252 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1abb n ASN 253 N 15.59 0.00 0.00 4.37 0.23 -1.26 -4.99 115.26 129.20 1abb n ASN 253 Ca 0.45 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.50 1abb n ASN 253 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 1abb n ASN 253 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1abb n LEU 254 N 0.00 0.36 -4.64 -4.53 4.32 -0.96 -3.76 117.00 107.78 1abb n LEU 254 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 56.01 55.56 1abb n LEU 254 Cb 0.00 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 1abb n LEU 254 CO 0.00 -0.11 1.19 -0.75 -1.22 0.00 0.00 177.39 176.49 1abb s LYS 255 N -1.56 4.00 0.00 3.23 2.36 -1.00 -3.35 119.74 123.42 1abb s LYS 255 Ca 0.00 1.52 0.00 0.00 -2.55 0.00 0.00 55.97 54.94 1abb s LYS 255 Cb 0.00 -3.89 0.00 0.00 -1.05 0.00 0.00 37.83 32.89 1abb s LYS 255 CO 0.00 -1.02 0.00 -3.47 1.55 0.00 0.00 175.35 172.41 1abb n ASP 256 N 7.48 0.00 -0.70 1.43 2.03 -1.26 -4.24 116.55 121.29 1abb n ASP 256 Ca 0.16 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.40 1abb n ASP 256 Cb 0.45 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.84 1abb n ASP 256 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1abb n PHE 257 N 0.00 -0.23 -0.07 -0.67 3.01 -1.21 -4.93 117.46 113.35 1abb n PHE 257 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 1abb n PHE 257 Cb 0.00 -1.83 -0.06 0.00 -0.01 0.00 0.00 39.48 37.58 1abb n PHE 257 CO 0.00 0.00 0.00 -2.95 1.01 0.00 0.00 176.76 174.82 1abb h ASN 258 N 0.00 0.00 -2.57 4.37 -1.07 -1.88 -3.48 115.58 110.95 1abb h ASN 258 Ca -0.15 -0.35 -0.27 0.00 0.07 0.00 0.00 56.30 55.60 1abb h ASN 258 Cb 0.94 0.00 0.15 0.00 -2.07 0.00 0.00 38.32 37.33 1abb h ASN 258 CO 0.19 0.92 -0.03 1.33 0.07 0.00 0.00 177.43 179.91 1abb n VAL 259 N -4.61 0.00 0.00 6.14 0.24 -1.24 -3.51 118.33 115.35 1abb n VAL 259 Ca -0.12 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 1abb n VAL 259 Cb 0.34 -0.91 0.00 0.00 -1.47 0.00 0.00 33.84 31.80 1abb n VAL 259 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1abb n GLY 260 N -3.43 2.13 0.18 7.63 0.00 -1.25 -3.98 105.19 106.47 1abb n GLY 260 Ca 0.10 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1abb n GLY 260 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1abb h GLY 261 N 0.00 0.61 -5.50 -0.02 0.00 -1.93 -3.44 103.07 92.79 1abb h GLY 261 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 46.76 1abb h GLY 261 CO 0.00 0.44 -0.24 -0.47 0.00 0.00 0.00 176.54 176.27 1abb s TYR 262 N -4.87 -0.67 -1.13 5.60 6.14 -1.23 -5.00 117.35 116.20 1abb s TYR 262 Ca -0.13 1.42 0.18 0.00 0.64 0.00 0.00 57.07 59.18 1abb s TYR 262 Cb 0.08 0.32 0.72 0.00 0.42 0.00 0.00 41.96 43.50 1abb s TYR 262 CO 0.77 -0.36 1.63 0.44 0.64 0.00 0.00 175.55 178.67 1abb n ILE 263 N 4.15 1.82 0.21 3.14 -5.35 -1.26 -3.66 119.36 118.41 1abb n ILE 263 Ca -0.22 -1.21 0.13 0.00 -0.27 0.00 0.00 62.75 61.19 1abb n ILE 263 Cb 0.56 0.13 0.72 0.00 -1.74 0.00 0.00 39.64 39.31 1abb n ILE 263 CO 0.00 0.00 0.00 0.06 -1.76 0.00 0.00 176.55 174.85 1abb h GLN 264 N 4.06 0.00 -1.06 6.28 3.07 -1.97 0.18 115.11 125.67 1abb h GLN 264 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1abb h GLN 264 Cb 1.44 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.00 1abb h GLN 264 CO 0.23 0.00 0.00 0.00 0.09 0.00 0.00 178.83 179.15 1abb n ALA 265 N -1.83 2.39 0.22 0.06 0.00 -1.26 -2.91 120.51 117.18 1abb n ALA 265 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1abb n ALA 265 Cb 0.08 -1.00 0.37 0.00 0.00 0.00 0.00 19.45 18.90 1abb n ALA 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1abb h VAL 266 N 0.08 0.35 0.16 0.00 2.07 -0.99 -3.18 116.25 114.74 1abb h VAL 266 Ca 0.00 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 1abb h VAL 266 Cb 0.81 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1abb h VAL 266 CO 0.00 0.17 -0.08 -0.07 0.02 0.00 0.00 177.57 177.61 1abb h LEU 267 N 0.00 -0.19 -0.84 2.57 3.38 -1.77 -2.33 115.31 116.14 1abb h LEU 267 Ca -0.00 -0.35 0.12 0.00 0.09 0.00 0.00 57.88 57.73 1abb h LEU 267 Cb 0.86 0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.54 1abb h LEU 267 CO 0.02 0.32 -0.37 -0.67 0.09 0.00 0.00 178.44 177.83 1abb n ASP 268 N -4.95 -0.63 -0.09 -0.43 -0.08 -1.20 0.43 116.55 109.59 1abb n ASP 268 Ca -0.08 1.47 -0.12 0.00 -1.51 0.00 0.00 54.79 54.55 1abb n ASP 268 Cb 0.27 -0.30 -0.06 0.00 2.34 0.00 0.00 41.12 43.36 1abb n ASP 268 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1abb h ARG 269 N 0.00 -0.39 -0.17 -0.67 1.12 -1.69 0.69 114.38 113.27 1abb h ARG 269 Ca 0.25 0.03 -0.10 0.00 -1.11 0.00 0.00 59.98 59.04 1abb h ARG 269 Cb 0.46 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 30.50 1abb h ARG 269 CO -0.82 -0.26 -0.35 -0.91 -3.11 0.00 0.00 179.97 174.52 1abb h ASN 270 N -0.40 0.36 -0.18 -3.80 2.35 0.56 0.45 115.58 114.91 1abb h ASN 270 Ca 0.10 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1abb h ASN 270 Cb 0.61 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1abb h ASN 270 CO -0.53 0.69 0.00 0.18 -1.65 0.00 0.00 177.43 176.12 1abb n LEU 271 N -4.07 1.15 -0.03 1.61 4.77 0.33 -1.92 117.00 118.85 1abb n LEU 271 Ca -0.01 -0.54 -0.06 0.00 -0.03 0.00 0.00 56.01 55.37 1abb n LEU 271 Cb 0.45 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.41 1abb n LEU 271 CO 0.42 0.27 -0.45 0.00 -1.33 0.00 0.00 177.39 176.30 1abb n ALA 272 N 0.06 1.89 -0.57 -1.18 0.00 0.22 -4.61 120.51 116.33 1abb n ALA 272 Ca 0.11 -0.46 0.46 0.00 0.00 0.00 0.00 53.44 53.55 1abb n ALA 272 Cb 0.21 0.16 0.75 0.00 0.00 0.00 0.00 19.45 20.57 1abb n ALA 272 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1abb h GLU 273 N -0.53 0.02 -0.94 0.00 5.08 -0.90 -2.28 114.58 115.03 1abb h GLU 273 Ca -0.05 -0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.67 1abb h GLU 273 Cb 0.64 -0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.57 1abb h GLU 273 CO -0.03 0.01 0.53 0.27 -1.00 0.00 0.00 179.01 178.79 1abb n ASN 274 N -4.29 6.90 0.07 1.42 2.04 -0.81 -3.77 115.26 116.83 1abb n ASN 274 Ca 0.41 -3.77 -0.05 0.00 -0.44 0.00 0.00 54.58 50.72 1abb n ASN 274 Cb 1.74 -0.84 -0.09 0.00 -2.53 0.00 0.00 39.78 38.05 1abb n ASN 274 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 1abb h ILE 275 N 1.23 1.41 -0.50 1.53 2.04 -1.71 -3.17 117.51 118.33 1abb h ILE 275 Ca 0.56 -3.05 0.00 0.00 1.00 0.00 0.00 64.86 63.37 1abb h ILE 275 Cb 1.06 2.69 0.00 0.00 -0.74 0.00 0.00 36.82 39.83 1abb h ILE 275 CO 1.39 0.80 0.00 -0.24 0.00 0.00 0.00 178.15 180.11 1abb n SER 276 N -3.28 3.47 0.01 1.72 2.88 -1.25 -4.66 113.62 112.51 1abb n SER 276 Ca -0.01 -1.97 -0.20 0.00 -1.33 0.00 0.00 58.87 55.36 1abb n SER 276 Cb 0.90 -0.33 -0.14 0.00 -0.75 0.00 0.00 64.21 63.89 1abb n SER 276 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1abb n ARG 277 N 1.29 0.75 -3.89 -1.46 0.63 -1.20 -2.69 116.66 110.10 1abb n ARG 277 Ca 0.19 0.27 -0.11 0.00 -0.92 0.00 0.00 57.85 57.28 1abb n ARG 277 Cb 0.55 -1.72 -0.10 0.00 0.45 0.00 0.00 32.46 31.64 1abb n ARG 277 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1abb s VAL 278 N -2.56 0.08 0.68 5.15 0.11 -1.26 -2.34 120.40 120.26 1abb s VAL 278 Ca -0.21 -0.66 -0.11 0.00 -2.93 0.00 0.00 61.98 58.07 1abb s VAL 278 Cb 0.07 -0.36 0.00 0.00 -1.53 0.00 0.00 36.38 34.56 1abb s VAL 278 CO 0.78 -0.36 1.06 -0.22 -3.33 0.00 0.00 175.10 173.03 1abb s LEU 279 N -1.23 3.03 -0.12 2.54 0.20 -0.87 -5.01 118.68 117.23 1abb s LEU 279 Ca -0.13 1.37 0.01 0.00 0.69 0.00 0.00 54.13 56.07 1abb s LEU 279 Cb -0.07 -4.26 -0.01 0.00 -0.43 0.00 0.00 46.19 41.42 1abb s LEU 279 CO 0.01 -1.27 -0.17 -0.31 -0.29 0.00 0.00 176.35 174.31 1abb s TYR 280 N -3.19 2.72 0.00 5.38 2.02 -1.26 -4.91 117.35 118.10 1abb s TYR 280 Ca 0.57 -0.77 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 1abb s TYR 280 Cb -0.12 -1.79 0.00 0.00 -0.40 0.00 0.00 41.96 39.65 1abb s TYR 280 CO 0.54 -0.27 0.00 -0.35 -1.57 0.00 0.00 175.55 173.90 1abb n PRO 281 N 3.49 0.00 0.00 -1.71 -0.04 -1.26 -5.14 135.00 130.34 1abb n PRO 281 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1abb n PRO 281 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1abb n PRO 281 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1abb n ASN 282 N 0.00 0.00 -0.81 3.54 5.15 -1.26 -4.97 115.26 116.91 1abb n ASN 282 Ca 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.99 1abb n ASN 282 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1abb n ASN 282 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1abb n GLU 287 N 0.00 -0.16 -2.17 1.20 4.71 -1.26 -5.72 120.64 117.24 1abb n GLU 287 Ca 0.00 0.11 -0.37 0.00 -0.01 0.00 0.00 57.16 56.89 1abb n GLU 287 Cb 0.00 -0.20 -0.03 0.00 -1.01 0.00 0.00 31.44 30.20 1abb n GLU 287 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1abb n GLY 288 N -0.25 2.15 3.52 0.62 0.00 -1.26 -4.91 105.19 105.05 1abb n GLY 288 Ca 0.00 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.53 1abb n GLY 288 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1abb s LYS 289 N 5.07 3.58 0.47 1.61 2.20 -1.26 -5.00 119.74 126.42 1abb s LYS 289 Ca 0.59 -0.51 0.20 0.00 -0.36 0.00 0.00 55.97 55.89 1abb s LYS 289 Cb 0.04 -2.89 1.20 0.00 -1.51 0.00 0.00 37.83 34.67 1abb s LYS 289 CO 0.09 0.30 1.96 0.93 -0.36 0.00 0.00 175.35 178.26 1abb h GLU 290 N 6.51 0.23 -0.17 4.03 5.08 -1.99 -1.25 114.58 127.02 1abb h GLU 290 Ca -0.33 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 1abb h GLU 290 Cb 1.19 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1abb h GLU 290 CO 0.62 0.15 0.04 1.25 -1.00 0.00 0.00 179.01 180.07 1abb h LEU 291 N 0.23 0.26 -0.16 1.33 6.46 -1.97 -0.51 115.31 120.96 1abb h LEU 291 Ca 0.31 -0.23 -0.00 0.00 -0.12 0.00 0.00 57.88 57.84 1abb h LEU 291 Cb 0.91 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1abb h LEU 291 CO -0.06 0.42 0.10 0.03 -0.62 0.00 0.00 178.44 178.30 1abb h ARG 292 N 0.08 0.21 0.00 1.25 3.08 -1.59 0.19 114.38 117.60 1abb h ARG 292 Ca 0.05 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1abb h ARG 292 Cb 0.26 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1abb h ARG 292 CO 0.00 0.17 -0.22 1.25 -1.07 0.00 0.00 179.97 180.10 1abb h LEU 293 N 0.19 0.00 -0.23 3.04 5.85 -1.46 0.14 115.31 122.84 1abb h LEU 293 Ca 0.06 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 1abb h LEU 293 Cb 0.01 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1abb h LEU 293 CO -0.01 0.22 -0.74 0.11 -0.34 0.00 0.00 178.44 177.69 1abb h LYS 294 N 0.00 0.00 -0.04 1.25 1.57 0.99 -1.82 116.57 118.51 1abb h LYS 294 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1abb h LYS 294 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1abb h LYS 294 CO 0.03 0.74 -0.68 1.96 -0.57 0.00 0.00 179.45 180.92 1abb h GLN 295 N 0.00 0.21 0.42 3.15 4.20 0.60 -3.05 115.11 120.64 1abb h GLN 295 Ca -0.01 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.52 1abb h GLN 295 Cb 1.46 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.28 1abb h GLN 295 CO 0.10 0.81 -0.20 0.93 -0.67 0.00 0.00 178.83 179.79 1abb h GLU 296 N 0.14 -0.55 -0.49 1.46 5.08 -0.78 -2.83 114.58 116.61 1abb h GLU 296 Ca -0.02 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1abb h GLU 296 Cb 1.22 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.55 1abb h GLU 296 CO 0.10 -0.25 0.25 -0.92 -1.00 0.00 0.00 179.01 177.19 1abb h TYR 297 N -1.00 0.46 -0.10 4.33 3.20 -1.45 -2.89 116.97 119.51 1abb h TYR 297 Ca -0.06 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.87 1abb h TYR 297 Cb 0.55 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.63 1abb h TYR 297 CO 0.02 0.23 -0.32 0.35 -1.64 0.00 0.00 178.16 176.79 1abb h PHE 298 N 0.49 -0.89 0.00 -3.82 3.57 -1.60 0.20 116.94 114.89 1abb h PHE 298 Ca 0.22 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 1abb h PHE 298 Cb 0.12 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1abb h PHE 298 CO -0.10 -0.40 -0.25 -0.24 -2.23 0.00 0.00 178.31 175.09 1abb h VAL 299 N -0.42 1.13 -0.14 1.41 3.04 -1.43 -1.64 116.25 118.20 1abb h VAL 299 Ca 0.09 -0.85 -0.04 0.00 -1.01 0.00 0.00 66.70 64.88 1abb h VAL 299 Cb 0.55 1.46 -0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1abb h VAL 299 CO -0.33 0.24 -0.07 0.58 -1.01 0.00 0.00 177.57 176.98 1abb h VAL 300 N 0.00 1.31 0.31 1.51 2.07 -0.88 -0.78 116.25 119.79 1abb h VAL 300 Ca -0.00 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 1abb h VAL 300 Cb 0.45 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1abb h VAL 300 CO 0.03 0.32 -0.15 0.00 0.02 0.00 0.00 177.57 177.80 1abb h ALA 301 N 0.66 -0.41 -0.00 1.67 0.00 -0.48 0.18 119.26 120.88 1abb h ALA 301 Ca 0.03 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1abb h ALA 301 Cb 0.54 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1abb h ALA 301 CO 0.02 -0.69 -0.75 0.00 0.00 0.00 0.00 179.25 177.83 1abb h ALA 302 N 0.17 0.74 -0.02 0.00 0.00 -1.35 -3.16 119.26 115.65 1abb h ALA 302 Ca -0.04 -0.67 -0.12 0.00 0.00 0.00 0.00 54.91 54.07 1abb h ALA 302 Cb 0.37 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1abb h ALA 302 CO 0.07 0.91 -0.46 1.15 0.00 0.00 0.00 179.25 180.92 1abb h THR 303 N 0.03 1.45 0.00 0.00 2.02 -1.00 -3.26 112.91 112.15 1abb h THR 303 Ca -0.01 -1.96 0.00 0.00 0.77 0.00 0.00 66.41 65.20 1abb h THR 303 Cb 1.33 2.55 0.00 0.00 -1.74 0.00 0.00 68.15 70.29 1abb h THR 303 CO 0.10 0.56 0.11 -0.07 0.37 0.00 0.00 175.52 176.59 1abb h LEU 304 N -0.19 0.00 0.09 2.58 4.07 -0.95 -0.35 115.31 120.56 1abb h LEU 304 Ca -0.05 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.63 1abb h LEU 304 Cb 1.17 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.92 1abb h LEU 304 CO 0.09 0.00 -1.23 1.56 -1.08 0.00 0.00 178.44 177.78 1abb h GLN 305 N 0.00 0.38 -0.08 1.13 4.20 -1.63 -1.45 115.11 117.66 1abb h GLN 305 Ca 0.00 -0.58 -0.23 0.00 0.06 0.00 0.00 58.65 57.90 1abb h GLN 305 Cb 0.22 0.20 0.01 0.00 0.30 0.00 0.00 27.48 28.21 1abb h GLN 305 CO 0.00 1.25 -0.87 0.22 -0.67 0.00 0.00 178.83 178.77 1abb h ASP 306 N 0.14 0.79 0.09 1.46 1.82 -1.24 0.20 116.42 119.67 1abb h ASP 306 Ca -0.15 -0.57 -0.00 0.00 -0.39 0.00 0.00 57.03 55.92 1abb h ASP 306 Cb 1.93 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 41.70 1abb h ASP 306 CO 0.21 1.36 -0.04 0.40 -1.61 0.00 0.00 179.24 179.56 1abb h ILE 307 N 0.41 0.99 0.00 2.25 2.04 -1.22 -0.39 117.51 121.58 1abb h ILE 307 Ca -0.07 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1abb h ILE 307 Cb 1.49 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1abb h ILE 307 CO 0.17 0.06 0.00 0.40 0.00 0.00 0.00 178.15 178.78 1abb h ILE 308 N -0.23 0.00 0.38 -0.67 2.04 -1.11 -2.57 117.51 115.33 1abb h ILE 308 Ca -0.01 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1abb h ILE 308 Cb 0.19 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1abb h ILE 308 CO 0.02 0.00 -0.18 -0.09 0.00 0.00 0.00 178.15 177.90 1abb h ARG 309 N 0.00 -0.49 -1.28 2.37 2.43 0.02 -1.92 114.38 115.52 1abb h ARG 309 Ca 0.00 0.03 0.38 0.00 -0.81 0.00 0.00 59.98 59.58 1abb h ARG 309 Cb 0.55 0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 30.11 1abb h ARG 309 CO 0.00 -0.32 0.86 0.00 -1.51 0.00 0.00 179.97 178.99 1abb h ARG 310 N -0.90 0.15 0.52 0.20 3.08 -1.09 0.18 114.38 116.52 1abb h ARG 310 Ca -0.05 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1abb h ARG 310 Cb 0.39 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.41 1abb h ARG 310 CO 0.08 0.10 -0.25 0.35 -1.07 0.00 0.00 179.97 179.18 1abb h PHE 311 N 0.15 -0.65 -0.98 3.04 3.57 -1.33 0.28 116.94 121.01 1abb h PHE 311 Ca 0.72 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 62.37 1abb h PHE 311 Cb 2.32 0.22 -0.09 0.00 2.79 0.00 0.00 35.95 41.19 1abb h PHE 311 CO -0.00 -0.41 0.61 0.87 -2.23 0.00 0.00 178.31 177.15 1abb h LYS 312 N -0.80 0.76 0.00 1.11 1.57 -0.61 -3.28 116.57 115.32 1abb h LYS 312 Ca -0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1abb h LYS 312 Cb 0.54 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1abb h LYS 312 CO 0.12 0.50 -0.02 0.77 -0.57 0.00 0.00 179.45 180.25 1abb h SER 313 N 0.78 0.00 -0.09 0.86 0.02 -0.65 -1.88 113.55 112.59 1abb h SER 313 Ca 0.53 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.46 1abb h SER 313 Cb 0.80 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 1abb h SER 313 CO -0.30 0.40 0.38 -1.20 -1.14 0.00 0.00 176.83 174.97 1abb n SER 314 N -4.15 0.38 0.00 3.07 7.64 0.97 -3.88 113.62 117.64 1abb n SER 314 Ca -0.00 -1.95 0.00 0.00 1.01 0.00 0.00 58.87 57.92 1abb n SER 314 Cb 0.01 -1.37 0.00 0.00 -1.01 0.00 0.00 64.21 61.85 1abb n SER 314 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1abb n LYS 315 N 7.15 -1.55 0.00 1.43 4.01 -1.26 -4.46 118.16 123.48 1abb n LYS 315 Ca 0.33 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 58.25 1abb n LYS 315 Cb 0.45 -1.99 0.16 0.00 -0.51 0.00 0.00 35.03 33.15 1abb n LYS 315 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1abb n PHE 316 N 0.05 0.00 0.11 2.13 -0.00 -1.25 -2.38 117.46 116.12 1abb n PHE 316 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.32 1abb n PHE 316 Cb 0.00 -0.17 -0.06 0.00 -0.00 0.00 0.00 39.48 39.25 1abb n PHE 316 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1abb h GLY 317 N 4.99 -0.51 -0.06 7.13 0.00 -1.49 -2.96 103.07 110.17 1abb h GLY 317 Ca 0.00 0.32 0.06 0.00 0.00 0.00 0.00 47.33 47.71 1abb h GLY 317 CO 0.00 -0.23 -0.37 0.00 0.00 0.00 0.00 176.54 175.94 1abb n ARG 319 N -5.42 3.47 0.14 0.00 0.00 -1.00 -4.55 116.66 109.29 1abb n ARG 319 Ca -0.02 -2.21 -0.14 0.00 -0.00 0.00 0.00 57.85 55.49 1abb n ARG 319 Cb 0.34 -2.85 -0.08 0.00 0.00 0.00 0.00 32.46 29.87 1abb n ARG 319 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 1abb h ASP 320 N 5.25 -0.28 0.00 6.15 1.82 -1.22 -3.43 116.42 124.71 1abb h ASP 320 Ca 0.81 -0.13 0.00 0.00 -0.39 0.00 0.00 57.03 57.32 1abb h ASP 320 Cb 0.33 0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.41 1abb h ASP 320 CO 1.79 -0.03 0.00 -2.65 -1.61 0.00 0.00 179.24 176.73 1abb n PRO 321 N -5.15 0.00 -3.67 0.28 -0.02 -1.26 -1.85 135.00 123.33 1abb n PRO 321 Ca -0.09 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.26 1abb n PRO 321 Cb 0.21 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.57 1abb n PRO 321 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1abb s VAL 322 N -1.65 -0.41 0.00 -1.45 0.11 -1.26 -4.92 120.40 110.83 1abb s VAL 322 Ca 0.00 0.24 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 1abb s VAL 322 Cb 0.00 -0.49 0.00 0.00 -1.53 0.00 0.00 36.38 34.36 1abb s VAL 322 CO 0.00 0.10 0.00 0.54 -3.33 0.00 0.00 175.10 172.41 1abb n ARG 323 N 5.20 -1.49 -3.51 1.54 5.12 -1.26 0.17 116.66 122.42 1abb n ARG 323 Ca -0.09 0.37 -0.19 0.00 -1.93 0.00 0.00 57.85 56.01 1abb n ARG 323 Cb 0.50 -4.79 0.02 0.00 -1.16 0.00 0.00 32.46 27.03 1abb n ARG 323 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1abb n THR 324 N -2.04 -6.54 -1.68 0.55 -1.04 -1.25 -4.33 114.28 97.95 1abb n THR 324 Ca 0.00 -0.46 -0.43 0.00 -2.04 0.00 0.00 64.05 61.12 1abb n THR 324 Cb 0.37 -4.79 -0.03 0.00 -1.82 0.00 0.00 70.33 64.07 1abb n THR 324 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1abb n ASN 325 N -2.39 4.05 0.25 8.00 2.85 0.44 -4.74 115.26 123.73 1abb n ASN 325 Ca -0.13 0.95 0.17 0.00 -0.11 0.00 0.00 54.58 55.46 1abb n ASN 325 Cb 0.59 -1.53 0.88 0.00 1.24 0.00 0.00 39.78 40.97 1abb n ASN 325 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1abb h PHE 326 N 9.34 0.00 -1.01 1.20 0.04 -1.77 0.44 116.94 125.18 1abb h PHE 326 Ca -0.48 0.00 0.24 0.00 2.80 0.00 0.00 57.97 60.53 1abb h PHE 326 Cb 1.23 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.27 1abb h PHE 326 CO 0.86 0.00 0.62 -0.44 -0.60 0.00 0.00 178.31 178.75 1abb h ASP 327 N 0.00 0.62 -0.02 2.17 3.32 -1.88 0.11 116.42 120.74 1abb h ASP 327 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1abb h ASP 327 Cb 0.04 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1abb h ASP 327 CO 0.00 0.14 0.00 0.00 -1.72 0.00 0.00 179.24 177.66 1abb n ALA 328 N -2.37 2.62 -0.05 3.45 0.00 0.15 -4.31 120.51 120.00 1abb n ALA 328 Ca 0.25 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.26 1abb n ALA 328 Cb 0.75 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.85 1abb n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1abb h PHE 329 N 1.20 0.26 0.00 0.00 3.57 -0.76 -0.30 116.94 120.91 1abb h PHE 329 Ca 0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 1abb h PHE 329 Cb 0.26 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 1abb h PHE 329 CO 0.01 0.30 -0.16 -1.00 -2.23 0.00 0.00 178.31 175.23 1abb h PRO 330 N 0.15 0.00 0.00 6.41 0.13 -1.75 0.18 132.00 137.12 1abb h PRO 330 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1abb h PRO 330 Cb 0.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1abb h PRO 330 CO -0.01 0.16 0.00 -0.25 -0.23 0.00 0.00 178.00 177.67 1abb n ASP 331 N -4.09 0.42 -0.00 1.44 9.92 -0.65 -3.66 116.55 119.92 1abb n ASP 331 Ca -0.02 0.54 0.00 0.00 -0.53 0.00 0.00 54.79 54.78 1abb n ASP 331 Cb 0.24 -0.65 -0.00 0.00 -0.64 0.00 0.00 41.12 40.06 1abb n ASP 331 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1abb n LYS 332 N -1.90 6.11 -4.46 -1.24 4.01 0.18 -4.73 118.16 116.13 1abb n LYS 332 Ca 0.06 -0.05 -0.24 0.00 -0.51 0.00 0.00 58.31 57.57 1abb n LYS 332 Cb 0.38 -0.57 -0.10 0.00 -0.51 0.00 0.00 35.03 34.23 1abb n LYS 332 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1abb s VAL 333 N -0.96 2.42 -0.12 -0.18 1.01 0.38 -1.56 120.40 121.40 1abb s VAL 333 Ca 0.00 -2.37 -0.12 0.00 0.00 0.00 0.00 61.98 59.49 1abb s VAL 333 Cb 0.00 -2.27 0.03 0.00 0.00 0.00 0.00 36.38 34.14 1abb s VAL 333 CO 0.02 -0.39 0.33 0.00 0.00 0.00 0.00 175.10 175.06 1abb s ALA 334 N -2.48 -0.82 -0.26 5.51 0.00 -0.99 -4.60 121.76 118.13 1abb s ALA 334 Ca 0.29 0.89 0.01 0.00 0.00 0.00 0.00 51.96 53.15 1abb s ALA 334 Cb -0.05 -0.50 0.07 0.00 0.00 0.00 0.00 23.12 22.64 1abb s ALA 334 CO 0.14 -0.16 -0.01 0.42 0.00 0.00 0.00 175.76 176.15 1abb s ILE 335 N 0.07 1.45 -0.69 0.00 1.01 -0.98 -0.85 121.20 121.21 1abb s ILE 335 Ca -0.01 -1.37 -0.22 0.00 0.00 0.00 0.00 60.65 59.04 1abb s ILE 335 Cb -0.03 -1.85 0.08 0.00 0.01 0.00 0.00 42.46 40.67 1abb s ILE 335 CO 0.01 -0.28 0.99 -1.10 0.00 0.00 0.00 174.94 174.56 1abb s GLN 336 N 1.39 3.17 -0.71 2.79 -1.52 -0.45 -2.11 119.66 122.23 1abb s GLN 336 Ca -0.00 -0.92 -0.26 0.00 -1.95 0.00 0.00 55.36 52.23 1abb s GLN 336 Cb -0.18 -4.31 0.04 0.00 -0.22 0.00 0.00 33.01 28.33 1abb s GLN 336 CO -0.10 -1.82 1.18 -0.51 -0.25 0.00 0.00 175.29 173.78 1abb s LEU 337 N 3.97 3.55 -0.80 2.90 1.02 -0.70 -0.12 118.68 128.49 1abb s LEU 337 Ca 0.24 -0.59 -0.26 0.00 0.02 0.00 0.00 54.13 53.54 1abb s LEU 337 Cb -0.15 -2.54 0.03 0.00 0.02 0.00 0.00 46.19 43.55 1abb s LEU 337 CO 0.08 -1.70 1.35 0.21 0.02 0.00 0.00 176.35 176.31 1abb s ASN 338 N 3.68 6.19 0.17 2.29 2.47 -0.96 -2.06 114.94 126.72 1abb s ASN 338 Ca 0.31 -0.66 0.00 0.00 0.42 0.00 0.00 52.86 52.93 1abb s ASN 338 Cb -0.11 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.13 1abb s ASN 338 CO 0.14 -1.80 0.00 -0.67 -3.72 0.00 0.00 177.10 171.05 1abb n ASP 339 N 9.47 -0.75 -0.09 -4.21 -0.08 0.12 -4.40 116.55 116.60 1abb n ASP 339 Ca 0.11 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.52 1abb n ASP 339 Cb 0.50 0.00 0.38 0.00 2.34 0.00 0.00 41.12 44.34 1abb n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1abb n THR 340 N -0.16 0.00 -0.19 5.18 -2.24 -1.26 -4.39 114.28 111.22 1abb n THR 340 Ca 0.00 -0.04 -0.07 0.00 -2.27 0.00 0.00 64.05 61.67 1abb n THR 340 Cb 0.00 0.15 0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1abb n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1abb h HIS 341 N 0.42 0.72 0.00 4.78 3.86 -1.96 0.20 115.15 123.18 1abb h HIS 341 Ca 0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1abb h HIS 341 Cb 0.48 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.71 1abb h HIS 341 CO 0.00 0.50 0.00 -2.30 0.86 0.00 0.00 177.93 176.99 1abb n PRO 342 N -4.65 0.15 -0.25 2.45 -0.02 -1.26 -4.42 135.00 127.00 1abb n PRO 342 Ca 0.03 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.47 1abb n PRO 342 Cb 0.06 -1.01 0.07 0.00 -0.02 0.00 0.00 33.50 32.60 1abb n PRO 342 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1abb h SER 343 N 0.11 0.74 0.00 2.55 4.64 -0.86 -0.21 113.55 120.52 1abb h SER 343 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1abb h SER 343 Cb 0.01 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1abb h SER 343 CO 0.00 0.52 0.57 -0.07 -0.87 0.00 0.00 176.83 176.98 1abb h LEU 344 N 0.88 0.00 -1.78 5.97 3.38 -1.82 -0.09 115.31 121.84 1abb h LEU 344 Ca 0.28 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.27 1abb h LEU 344 Cb -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1abb h LEU 344 CO -0.10 0.00 0.44 0.00 0.09 0.00 0.00 178.44 178.87 1abb h ALA 345 N 0.77 1.56 0.00 1.53 0.00 -1.38 0.11 119.26 121.85 1abb h ALA 345 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1abb h ALA 345 Cb 1.15 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1abb h ALA 345 CO 0.00 -0.48 -0.45 0.82 0.00 0.00 0.00 179.25 179.14 1abb h ILE 346 N 0.00 0.76 0.00 0.00 2.04 -1.24 -1.93 117.51 117.15 1abb h ILE 346 Ca 0.04 -1.71 -0.02 0.00 1.00 0.00 0.00 64.86 64.17 1abb h ILE 346 Cb 0.91 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 1abb h ILE 346 CO -0.00 0.26 -0.10 1.55 0.00 0.00 0.00 178.15 179.86 1abb h PRO 347 N -1.00 0.00 0.10 2.37 0.13 -1.75 -2.70 132.00 129.14 1abb h PRO 347 Ca -0.09 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.90 1abb h PRO 347 Cb 0.75 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.89 1abb h PRO 347 CO -0.06 0.10 -0.58 1.49 -0.23 0.00 0.00 178.00 178.73 1abb h GLU 348 N 0.00 0.22 -0.71 0.86 4.57 -0.92 -2.63 114.58 115.97 1abb h GLU 348 Ca -0.00 -0.37 0.06 0.00 -1.18 0.00 0.00 59.36 57.87 1abb h GLU 348 Cb 0.28 0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.95 1abb h GLU 348 CO 0.01 1.17 0.42 1.25 -1.18 0.00 0.00 179.01 180.68 1abb h LEU 349 N -0.53 0.64 -2.22 1.64 5.85 -1.41 0.38 115.31 119.66 1abb h LEU 349 Ca -0.10 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1abb h LEU 349 Cb 1.45 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.37 1abb h LEU 349 CO 0.11 0.42 -0.04 0.24 -0.34 0.00 0.00 178.44 178.82 1abb h MET 350 N 0.77 0.00 0.16 1.25 2.86 -1.57 -2.09 114.93 116.31 1abb h MET 350 Ca 0.31 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.95 1abb h MET 350 Cb 0.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1abb h MET 350 CO -0.17 0.04 -0.08 -0.09 1.06 0.00 0.00 176.91 177.68 1abb h ARG 351 N 0.00 -0.20 -0.09 1.72 2.43 -0.56 -1.19 114.38 116.50 1abb h ARG 351 Ca -0.00 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1abb h ARG 351 Cb 0.10 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1abb h ARG 351 CO 0.01 0.03 -0.21 0.28 -1.51 0.00 0.00 179.97 178.56 1abb h VAL 352 N -1.02 0.00 -0.94 0.20 2.07 -1.21 0.25 116.25 115.60 1abb h VAL 352 Ca -0.02 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.67 1abb h VAL 352 Cb 0.32 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.01 1abb h VAL 352 CO 0.04 0.00 0.60 -0.07 0.02 0.00 0.00 177.57 178.15 1abb h LEU 353 N -0.20 0.66 0.00 2.57 3.38 -1.48 0.99 115.31 121.23 1abb h LEU 353 Ca 0.02 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1abb h LEU 353 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1abb h LEU 353 CO -0.19 0.29 -0.55 0.58 0.09 0.00 0.00 178.44 178.66 1abb h VAL 354 N 0.67 0.74 0.06 1.22 2.07 -0.51 -1.89 116.25 118.62 1abb h VAL 354 Ca 0.50 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 1abb h VAL 354 Cb 0.86 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 1abb h VAL 354 CO -0.25 0.25 -0.03 0.44 0.02 0.00 0.00 177.57 178.00 1abb h ASP 355 N -1.00 -0.07 0.06 0.57 3.32 -0.92 -3.11 116.42 115.27 1abb h ASP 355 Ca -0.12 -0.53 -0.00 0.00 0.02 0.00 0.00 57.03 56.39 1abb h ASP 355 Cb 0.81 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1abb h ASP 355 CO -0.07 0.54 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.89 1abb h LEU 356 N -0.74 -0.07 0.00 1.55 4.07 -0.88 -3.42 115.31 115.82 1abb h LEU 356 Ca -0.01 -0.56 0.00 0.00 0.08 0.00 0.00 57.88 57.39 1abb h LEU 356 Cb 0.60 0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.36 1abb h LEU 356 CO 0.01 0.59 0.00 -0.62 -1.08 0.00 0.00 178.44 177.34 1abb n GLU 357 N -4.81 0.00 0.00 1.13 -0.58 -0.96 -5.02 120.64 110.40 1abb n GLU 357 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1abb n GLU 357 Cb 0.31 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.18 1abb n GLU 357 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1abb n ARG 358 N 0.00 0.00 -2.81 3.49 3.00 -0.87 -4.94 116.66 114.54 1abb n ARG 358 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.54 1abb n ARG 358 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.42 1abb n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1abb s LEU 359 N 0.00 3.84 0.82 6.15 1.43 -0.77 -5.00 118.68 125.16 1abb s LEU 359 Ca 0.00 1.33 -0.12 0.00 -1.03 0.00 0.00 54.13 54.31 1abb s LEU 359 Cb 0.00 -4.20 0.09 0.00 0.03 0.00 0.00 46.19 42.10 1abb s LEU 359 CO 0.00 -0.40 1.12 1.51 0.23 0.00 0.00 176.35 178.81 1abb s ASP 360 N -2.83 4.31 0.15 2.29 -4.77 -1.26 -4.46 116.67 110.10 1abb s ASP 360 Ca 0.55 1.10 -0.17 0.00 -3.30 0.00 0.00 52.55 50.73 1abb s ASP 360 Cb -0.10 -1.76 0.06 0.00 -1.09 0.00 0.00 42.92 40.03 1abb s ASP 360 CO 0.26 -2.06 1.70 -0.25 0.70 0.00 0.00 175.17 175.52 1abb h TRP 361 N -1.16 -0.03 -0.07 2.11 7.01 -1.97 0.17 115.95 122.02 1abb h TRP 361 Ca -0.48 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 60.41 1abb h TRP 361 Cb 1.29 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 28.41 1abb h TRP 361 CO 0.39 -0.07 -0.58 -0.44 -2.79 0.00 0.00 178.44 174.96 1abb h ASP 362 N 0.08 0.24 -0.37 2.65 3.32 -1.99 0.22 116.42 120.56 1abb h ASP 362 Ca 0.16 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 1abb h ASP 362 Cb 0.22 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1abb h ASP 362 CO -0.28 0.76 -0.02 0.50 -1.72 0.00 0.00 179.24 178.49 1abb h LYS 363 N 0.16 0.67 -0.78 3.56 1.63 -1.62 -2.58 116.57 117.61 1abb h LYS 363 Ca -0.00 -0.22 -0.04 0.00 -0.85 0.00 0.00 60.65 59.53 1abb h LYS 363 Cb 1.06 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.60 1abb h LYS 363 CO 0.09 0.78 0.31 0.00 -3.45 0.00 0.00 179.45 177.18 1abb h ALA 364 N 0.86 1.08 0.00 5.00 0.00 0.32 -2.90 119.26 123.62 1abb h ALA 364 Ca 0.10 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1abb h ALA 364 Cb 0.49 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1abb h ALA 364 CO 0.02 0.66 -0.38 2.35 0.00 0.00 0.00 179.25 181.90 1abb h TRP 365 N 1.13 0.00 0.46 0.00 2.91 -0.73 -0.86 115.95 118.87 1abb h TRP 365 Ca 0.26 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.26 1abb h TRP 365 Cb 0.21 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.86 1abb h TRP 365 CO 0.02 0.38 -0.24 1.49 -1.03 0.00 0.00 178.44 179.06 1abb h GLU 366 N 0.00 -0.62 -0.03 2.65 4.81 -1.36 -0.87 114.58 119.16 1abb h GLU 366 Ca -0.00 0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1abb h GLU 366 Cb 0.68 0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 1abb h GLU 366 CO 0.05 -0.42 0.00 0.28 -0.73 0.00 0.00 179.01 178.19 1abb h VAL 367 N -0.65 1.24 -0.23 0.32 2.07 -1.24 -0.12 116.25 117.64 1abb h VAL 367 Ca -0.06 -0.72 0.06 0.00 0.82 0.00 0.00 66.70 66.80 1abb h VAL 367 Cb 0.51 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 1abb h VAL 367 CO 0.09 0.19 -0.19 0.74 0.02 0.00 0.00 177.57 178.43 1abb h THR 368 N -0.23 0.49 -0.37 2.57 2.02 -1.09 0.33 112.91 116.63 1abb h THR 368 Ca 0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1abb h THR 368 Cb 0.31 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1abb h THR 368 CO 0.00 0.00 0.18 0.58 0.37 0.00 0.00 175.52 176.65 1abb h VAL 369 N -0.19 1.16 0.00 3.16 2.07 -1.06 0.28 116.25 121.68 1abb h VAL 369 Ca 0.13 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1abb h VAL 369 Cb 0.39 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1abb h VAL 369 CO -0.34 0.17 0.00 0.29 0.02 0.00 0.00 177.57 177.71 1abb n LYS 370 N -4.73 0.15 -0.04 1.57 5.02 -0.07 -2.56 118.16 117.50 1abb n LYS 370 Ca -0.00 0.36 -0.22 0.00 -2.02 0.00 0.00 58.31 56.43 1abb n LYS 370 Cb 0.10 -1.77 -0.13 0.00 -0.02 0.00 0.00 35.03 33.21 1abb n LYS 370 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1abb n THR 371 N -2.05 1.69 -3.36 -0.18 -1.04 0.11 -4.82 114.28 104.63 1abb n THR 371 Ca 0.03 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.20 1abb n THR 371 Cb 0.23 -1.77 -0.06 0.00 -1.82 0.00 0.00 70.33 66.91 1abb n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1abb s ALA 373 N -1.62 -0.82 -0.18 0.00 0.00 -0.90 -0.36 121.76 117.89 1abb s ALA 373 Ca 0.42 1.01 -0.07 0.00 0.00 0.00 0.00 51.96 53.32 1abb s ALA 373 Cb -0.13 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 1abb s ALA 373 CO 0.20 -0.17 0.06 -0.47 0.00 0.00 0.00 175.76 175.38 1abb s TYR 374 N 0.45 3.24 -0.16 0.00 5.04 -0.94 -1.73 117.35 123.26 1abb s TYR 374 Ca -0.02 0.06 -0.04 0.00 -2.44 0.00 0.00 57.07 54.63 1abb s TYR 374 Cb -0.04 -2.08 -0.03 0.00 0.35 0.00 0.00 41.96 40.16 1abb s TYR 374 CO -0.02 0.14 -0.04 0.99 -1.34 0.00 0.00 175.55 175.28 1abb s THR 375 N 0.42 3.89 0.10 4.34 2.01 -0.87 -2.40 115.64 123.12 1abb s THR 375 Ca 0.03 -0.36 0.06 0.00 0.31 0.00 0.00 61.69 61.73 1abb s THR 375 Cb -0.12 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1abb s THR 375 CO 0.00 0.49 -0.04 0.21 -0.69 0.00 0.00 174.62 174.59 1abb s ASN 376 N 0.38 4.75 -0.02 3.53 3.84 -0.86 0.11 114.94 126.67 1abb s ASN 376 Ca -0.04 -0.27 0.03 0.00 0.21 0.00 0.00 52.86 52.79 1abb s ASN 376 Cb -0.14 -1.04 0.04 0.00 -0.55 0.00 0.00 41.25 39.56 1abb s ASN 376 CO 0.03 0.17 0.85 1.41 -2.79 0.00 0.00 177.10 176.78 1abb n HIS 377 N 0.61 0.00 -3.26 0.43 8.25 -1.26 -4.31 115.22 115.68 1abb n HIS 377 Ca -0.12 -0.22 -0.19 0.00 -0.26 0.00 0.00 57.72 56.93 1abb n HIS 377 Cb 0.52 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1abb n HIS 377 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1abb s THR 378 N -0.58 2.69 0.00 1.59 -4.23 -1.26 -4.79 115.64 109.06 1abb s THR 378 Ca 0.05 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1abb s THR 378 Cb 0.04 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 71.04 1abb s THR 378 CO 0.00 0.00 0.00 0.55 -0.54 0.00 0.00 174.62 174.63 1abb n VAL 379 N -1.79 0.00 -2.36 2.29 3.14 -1.26 -4.92 118.33 113.43 1abb n VAL 379 Ca 0.07 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.03 1abb n VAL 379 Cb 0.61 -0.61 -0.03 0.00 -1.06 0.00 0.00 33.84 32.74 1abb n VAL 379 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1abb s ILE 380 N -1.98 3.76 -0.48 1.55 1.09 -1.26 -4.91 121.20 118.97 1abb s ILE 380 Ca 0.00 1.32 0.26 0.00 -1.10 0.00 0.00 60.65 61.13 1abb s ILE 380 Cb 0.00 -3.85 0.29 0.00 -1.06 0.00 0.00 42.46 37.85 1abb s ILE 380 CO 0.00 0.13 1.76 -0.65 -0.10 0.00 0.00 174.94 176.09 1abb h PRO 381 N 6.35 0.00 -0.05 2.79 0.11 -2.00 -2.67 132.00 136.52 1abb h PRO 381 Ca -0.43 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.70 1abb h PRO 381 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1abb h PRO 381 CO 0.80 0.00 0.09 0.93 -0.21 0.00 0.00 178.00 179.61 1abb h GLU 382 N 0.00 0.00 -0.00 1.05 3.07 -2.05 -2.95 114.58 113.69 1abb h GLU 382 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1abb h GLU 382 Cb 0.58 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1abb h GLU 382 CO 0.00 0.00 -0.19 0.00 -1.40 0.00 0.00 179.01 177.42 1abb n ALA 383 N -2.22 2.91 -2.61 3.43 0.00 -1.01 -4.90 120.51 116.11 1abb n ALA 383 Ca -0.02 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.71 1abb n ALA 383 Cb 0.18 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.33 1abb n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1abb s LEU 384 N -2.64 4.20 0.47 0.00 1.02 -1.12 -4.99 118.68 115.63 1abb s LEU 384 Ca 0.23 1.55 -0.23 0.00 0.02 0.00 0.00 54.13 55.70 1abb s LEU 384 Cb 0.19 -3.55 -0.08 0.00 0.02 0.00 0.00 46.19 42.77 1abb s LEU 384 CO 0.53 -0.58 1.19 1.21 0.02 0.00 0.00 176.35 178.72 1abb n GLU 385 N 5.63 1.60 -3.66 1.70 2.13 -1.26 -4.90 120.64 121.89 1abb n GLU 385 Ca 0.11 0.58 -0.06 0.00 0.66 0.00 0.00 57.16 58.45 1abb n GLU 385 Cb 0.47 -2.32 -0.07 0.00 0.27 0.00 0.00 31.44 29.79 1abb n GLU 385 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1abb s ARG 386 N -2.39 0.49 -0.09 5.31 0.52 -1.26 -1.85 118.95 119.68 1abb s ARG 386 Ca 0.66 1.20 0.03 0.00 -0.52 0.00 0.00 55.73 57.10 1abb s ARG 386 Cb -0.48 0.47 -0.01 0.00 0.52 0.00 0.00 34.95 35.45 1abb s ARG 386 CO 0.54 -0.21 -0.19 -1.58 0.02 0.00 0.00 175.30 173.89 1abb s TRP 387 N 2.44 2.63 0.44 -0.53 0.23 -0.84 -4.86 118.94 118.45 1abb s TRP 387 Ca -0.05 -0.69 -0.24 0.00 -2.03 0.00 0.00 56.10 53.09 1abb s TRP 387 Cb -0.11 -1.71 -0.08 0.00 0.03 0.00 0.00 33.47 31.60 1abb s TRP 387 CO -0.16 -0.20 1.18 -2.14 0.96 0.00 0.00 176.95 176.58 1abb s PRO 388 N 0.04 3.87 0.38 4.98 0.02 -1.26 -1.25 135.00 141.78 1abb s PRO 388 Ca -0.08 1.83 0.14 0.00 0.02 0.00 0.00 61.00 62.92 1abb s PRO 388 Cb -0.15 -2.52 0.76 0.00 0.02 0.00 0.00 34.50 32.60 1abb s PRO 388 CO 0.05 -0.48 1.83 -0.39 -0.33 0.00 0.00 177.00 177.69 1abb h VAL 389 N 2.07 1.20 0.00 3.83 -1.51 -1.37 -0.30 116.25 120.17 1abb h VAL 389 Ca -0.49 -1.26 0.00 0.00 -1.23 0.00 0.00 66.70 63.72 1abb h VAL 389 Cb 1.24 1.69 0.00 0.00 -2.13 0.00 0.00 31.29 32.09 1abb h VAL 389 CO 0.61 0.35 0.00 1.12 -1.23 0.00 0.00 177.57 178.42 1abb h HIS 390 N 0.00 0.00 0.00 5.19 2.07 -1.91 0.43 115.15 120.93 1abb h HIS 390 Ca -0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.49 1abb h HIS 390 Cb 0.66 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.64 1abb h HIS 390 CO 0.00 0.00 -0.15 -0.07 -3.07 0.00 0.00 177.93 174.64 1abb h LEU 391 N 0.00 0.00 0.01 6.12 3.38 -1.41 -3.17 115.31 120.24 1abb h LEU 391 Ca 0.00 -0.70 0.03 0.00 0.09 0.00 0.00 57.88 57.29 1abb h LEU 391 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1abb h LEU 391 CO 0.00 0.94 -0.23 -0.07 0.09 0.00 0.00 178.44 179.17 1abb h LEU 392 N -1.00 -0.67 -0.84 1.67 4.07 -1.41 -0.56 115.31 116.57 1abb h LEU 392 Ca -0.04 0.09 0.19 0.00 0.08 0.00 0.00 57.88 58.20 1abb h LEU 392 Cb 0.81 0.27 -0.11 0.00 1.08 0.00 0.00 40.66 42.71 1abb h LEU 392 CO -0.02 -0.30 0.33 -0.08 -1.08 0.00 0.00 178.44 177.29 1abb h GLU 393 N -0.36 0.39 0.09 1.13 4.81 -1.07 -0.08 114.58 119.49 1abb h GLU 393 Ca 0.06 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1abb h GLU 393 Cb 0.44 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1abb h GLU 393 CO -0.20 0.25 -0.05 1.15 -0.73 0.00 0.00 179.01 179.44 1abb h THR 394 N 0.40 0.00 0.00 0.32 2.02 -1.38 -3.30 112.91 110.96 1abb h THR 394 Ca 0.50 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.31 1abb h THR 394 Cb 0.88 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1abb h THR 394 CO -0.50 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 175.33 1abb n LEU 395 N -3.36 0.50 -2.72 2.58 -0.00 -0.27 -4.18 117.00 109.54 1abb n LEU 395 Ca -0.02 0.50 -0.12 0.00 -0.00 0.00 0.00 56.01 56.37 1abb n LEU 395 Cb 0.05 -0.37 0.02 0.00 -0.00 0.00 0.00 43.42 43.12 1abb n LEU 395 CO 0.04 -0.09 -0.10 0.18 -0.00 0.00 0.00 177.39 177.42 1abb n LEU 396 N -1.94 1.75 0.23 1.47 4.32 -0.05 0.22 117.00 123.00 1abb n LEU 396 Ca 0.06 -4.08 0.11 0.00 -0.02 0.00 0.00 56.01 52.09 1abb n LEU 396 Cb 0.39 0.36 0.50 0.00 -1.62 0.00 0.00 43.42 43.05 1abb n LEU 396 CO 0.30 1.74 0.84 1.55 -1.22 0.00 0.00 177.39 180.60 1abb h PRO 397 N 2.96 0.00 -0.05 3.23 0.13 -1.63 -1.62 132.00 135.02 1abb h PRO 397 Ca -0.03 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.01 1abb h PRO 397 Cb 1.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.25 1abb h PRO 397 CO 0.54 0.18 -0.33 -0.09 -0.23 0.00 0.00 178.00 178.06 1abb h ARG 398 N 0.00 0.32 -0.09 0.86 9.65 -1.90 -3.16 114.38 120.05 1abb h ARG 398 Ca -0.00 -0.27 -0.04 0.00 -1.10 0.00 0.00 59.98 58.56 1abb h ARG 398 Cb 0.71 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.34 1abb h ARG 398 CO 0.02 0.93 -0.14 0.45 2.80 0.00 0.00 179.97 184.03 1abb h HIS 399 N -0.21 0.14 -0.08 2.20 3.86 -1.73 -1.58 115.15 117.76 1abb h HIS 399 Ca -0.03 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1abb h HIS 399 Cb 1.01 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.43 1abb h HIS 399 CO 0.14 0.28 0.03 1.25 0.86 0.00 0.00 177.93 180.49 1abb h LEU 400 N 0.13 0.11 0.00 2.43 6.46 -1.38 -1.82 115.31 121.25 1abb h LEU 400 Ca 0.03 -0.16 0.01 0.00 -0.12 0.00 0.00 57.88 57.64 1abb h LEU 400 Cb 0.33 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.19 1abb h LEU 400 CO 0.02 0.24 -0.36 1.56 -0.62 0.00 0.00 178.44 179.28 1abb h GLN 401 N -0.02 -0.44 -0.59 1.25 4.20 -1.29 -1.54 115.11 116.68 1abb h GLN 401 Ca 0.03 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.89 1abb h GLN 401 Cb 0.16 0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.94 1abb h GLN 401 CO -0.00 -0.30 -0.02 0.82 -0.67 0.00 0.00 178.83 178.66 1abb h ILE 402 N -0.46 0.50 -0.86 2.54 2.04 -1.31 0.46 117.51 120.43 1abb h ILE 402 Ca 0.01 -0.03 0.19 0.00 1.00 0.00 0.00 64.86 66.02 1abb h ILE 402 Cb 0.49 0.39 -0.06 0.00 -0.74 0.00 0.00 36.82 36.91 1abb h ILE 402 CO -0.24 0.02 0.57 0.40 0.00 0.00 0.00 178.15 178.90 1abb h ILE 403 N 0.10 0.70 -0.19 -0.67 2.04 -0.43 0.73 117.51 119.80 1abb h ILE 403 Ca 0.30 -0.13 -0.12 0.00 1.00 0.00 0.00 64.86 65.91 1abb h ILE 403 Cb 0.48 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1abb h ILE 403 CO -0.52 0.07 -0.35 1.88 0.00 0.00 0.00 178.15 179.23 1abb h TYR 404 N 0.38 0.73 0.15 1.37 0.05 0.84 0.15 116.97 120.63 1abb h TYR 404 Ca 0.44 -0.26 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 1abb h TYR 404 Cb 1.11 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.71 1abb h TYR 404 CO -0.00 1.00 -0.07 1.49 -1.05 0.00 0.00 178.16 179.52 1abb h GLU 405 N 0.25 -0.20 -0.57 4.88 4.57 -0.54 0.01 114.58 122.99 1abb h GLU 405 Ca 0.01 0.01 0.11 0.00 -1.18 0.00 0.00 59.36 58.32 1abb h GLU 405 Cb 0.94 0.05 -0.11 0.00 -0.16 0.00 0.00 28.75 29.47 1abb h GLU 405 CO 0.08 0.05 -0.12 0.82 -1.18 0.00 0.00 179.01 178.66 1abb h ILE 406 N -0.44 0.45 -0.47 2.32 2.04 -0.98 0.26 117.51 120.68 1abb h ILE 406 Ca -0.02 -0.01 -0.06 0.00 1.00 0.00 0.00 64.86 65.77 1abb h ILE 406 Cb 0.35 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 1abb h ILE 406 CO 0.03 0.00 0.05 -1.13 0.00 0.00 0.00 178.15 177.10 1abb h ASN 407 N 0.02 0.70 0.66 1.72 -1.24 -0.39 -1.45 115.58 115.60 1abb h ASN 407 Ca 0.28 -0.14 -0.03 0.00 0.71 0.00 0.00 56.30 57.11 1abb h ASN 407 Cb 0.43 -0.18 0.01 0.00 0.73 0.00 0.00 38.32 39.30 1abb h ASN 407 CO -0.57 0.74 -0.32 -0.61 -1.29 0.00 0.00 177.43 175.39 1abb h GLN 408 N 0.71 -0.86 -0.94 6.67 4.15 0.95 -2.28 115.11 123.51 1abb h GLN 408 Ca 0.15 0.06 0.09 0.00 0.77 0.00 0.00 58.65 59.72 1abb h GLN 408 Cb 0.37 0.19 -0.07 0.00 0.21 0.00 0.00 27.48 28.18 1abb h GLN 408 CO 0.01 -0.53 0.61 0.00 -1.93 0.00 0.00 178.83 176.98 1abb h ARG 409 N -1.08 0.97 -0.40 1.69 3.08 -1.07 -1.01 114.38 116.55 1abb h ARG 409 Ca -0.09 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.75 1abb h ARG 409 Cb 0.72 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1abb h ARG 409 CO 0.15 0.64 -0.35 0.35 -1.07 0.00 0.00 179.97 179.69 1abb h PHE 410 N 1.00 1.12 0.00 3.04 3.57 -1.22 -2.66 116.94 121.79 1abb h PHE 410 Ca 0.43 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1abb h PHE 410 Cb 0.34 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1abb h PHE 410 CO -0.00 1.15 0.00 1.28 -2.23 0.00 0.00 178.31 178.51 1abb n LEU 411 N -4.07 0.64 0.11 0.59 4.77 -0.49 -0.70 117.00 117.85 1abb n LEU 411 Ca -0.02 0.69 0.12 0.00 -0.03 0.00 0.00 56.01 56.77 1abb n LEU 411 Cb 0.53 -0.64 0.12 0.00 -2.33 0.00 0.00 43.42 41.10 1abb n LEU 411 CO 0.48 -0.66 0.34 0.78 -1.33 0.00 0.00 177.39 177.01 1abb h ASN 412 N 0.00 0.00 0.03 -1.43 -0.26 -0.92 -2.38 115.58 110.61 1abb h ASN 412 Ca 0.00 -0.08 -0.07 0.00 -0.56 0.00 0.00 56.30 55.59 1abb h ASN 412 Cb 0.28 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.54 1abb h ASN 412 CO 0.00 0.04 -0.31 0.03 -1.06 0.00 0.00 177.43 176.13 1abb h ARG 413 N 0.00 0.16 -0.66 0.81 3.08 -0.73 -3.17 114.38 113.87 1abb h ARG 413 Ca 0.00 -0.21 0.07 0.00 0.07 0.00 0.00 59.98 59.91 1abb h ARG 413 Cb 0.89 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.94 1abb h ARG 413 CO 0.00 1.00 0.35 0.28 -1.07 0.00 0.00 179.97 180.53 1abb h VAL 414 N -0.58 0.93 -0.90 2.04 2.07 -1.18 -1.87 116.25 116.76 1abb h VAL 414 Ca -0.05 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.26 1abb h VAL 414 Cb 1.13 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1abb h VAL 414 CO 0.06 0.11 0.58 0.00 0.02 0.00 0.00 177.57 178.35 1abb h ALA 415 N 1.36 1.14 -0.22 1.67 0.00 -1.49 -0.14 119.26 121.59 1abb h ALA 415 Ca 0.30 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 1abb h ALA 415 Cb 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1abb h ALA 415 CO -0.21 0.55 -0.17 0.00 0.00 0.00 0.00 179.25 179.43 1abb h ALA 416 N 1.32 1.30 -0.01 0.00 0.00 -1.34 -0.40 119.26 120.14 1abb h ALA 416 Ca 0.33 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1abb h ALA 416 Cb -0.12 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.56 1abb h ALA 416 CO -0.07 0.46 -0.41 0.00 0.00 0.00 0.00 179.25 179.24 1abb h ALA 417 N 1.48 0.06 -2.74 0.00 0.00 -0.68 -3.37 119.26 114.01 1abb h ALA 417 Ca 0.06 -0.51 -0.61 0.00 0.00 0.00 0.00 54.91 53.86 1abb h ALA 417 Cb 0.50 0.02 -0.41 0.00 0.00 0.00 0.00 17.79 17.90 1abb h ALA 417 CO 0.03 0.21 -0.69 1.19 0.00 0.00 0.00 179.25 179.99 1abb n PHE 418 N -4.37 2.23 -1.52 0.00 3.72 -0.15 -5.06 117.46 112.31 1abb n PHE 418 Ca -0.10 -4.04 -0.60 0.00 -0.05 0.00 0.00 57.45 52.67 1abb n PHE 418 Cb 0.58 -0.41 -0.08 0.00 -0.94 0.00 0.00 39.48 38.62 1abb n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1abb n PRO 419 N 1.94 0.00 -1.07 -1.08 -0.02 -0.18 -1.66 135.00 132.93 1abb n PRO 419 Ca 0.24 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.69 1abb n PRO 419 Cb 0.40 -1.49 -0.01 0.00 -0.02 0.00 0.00 33.50 32.37 1abb n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1abb n GLY 420 N 1.71 0.32 3.59 -1.23 0.00 -1.26 -4.91 105.19 103.40 1abb n GLY 420 Ca 0.21 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1abb n GLY 420 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1abb s ASP 421 N -2.12 6.49 -0.25 1.61 -1.08 -0.66 -4.87 116.67 115.79 1abb s ASP 421 Ca 0.00 0.38 -0.03 0.00 -0.52 0.00 0.00 52.55 52.39 1abb s ASP 421 Cb 0.00 -2.34 -0.17 0.00 -1.46 0.00 0.00 42.92 38.95 1abb s ASP 421 CO 0.00 -0.52 -0.18 0.52 0.52 0.00 0.00 175.17 175.51 1abb n VAL 422 N 5.46 1.53 0.32 1.11 0.31 -1.26 -3.67 118.33 122.13 1abb n VAL 422 Ca -0.01 -0.53 0.11 0.00 -0.01 0.00 0.00 64.34 63.90 1abb n VAL 422 Cb 0.49 -1.56 0.48 0.00 -0.91 0.00 0.00 33.84 32.34 1abb n VAL 422 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1abb n ASP 423 N -3.50 0.55 -0.04 4.52 2.03 -1.26 -0.16 116.55 118.69 1abb n ASP 423 Ca -0.46 0.67 -0.15 0.00 0.52 0.00 0.00 54.79 55.37 1abb n ASP 423 Cb 0.97 -0.77 -0.12 0.00 -0.72 0.00 0.00 41.12 40.47 1abb n ASP 423 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1abb h ARG 424 N 0.00 0.08 -0.48 -0.67 2.43 -1.98 -2.82 114.38 110.95 1abb h ARG 424 Ca 0.00 -0.10 0.10 0.00 -0.81 0.00 0.00 59.98 59.17 1abb h ARG 424 Cb 0.24 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.73 1abb h ARG 424 CO 0.00 0.92 -0.11 -0.07 -1.51 0.00 0.00 179.97 179.20 1abb h LEU 425 N -0.72 -0.43 -1.17 3.80 -0.00 -0.63 -0.06 115.31 116.11 1abb h LEU 425 Ca -0.02 0.14 -0.07 0.00 -0.00 0.00 0.00 57.88 57.93 1abb h LEU 425 Cb 0.98 0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 41.92 1abb h LEU 425 CO 0.03 -0.15 -0.33 0.08 -0.00 0.00 0.00 178.44 178.06 1abb h ARG 426 N 0.01 0.00 0.00 1.13 0.11 -1.48 -2.89 114.38 111.25 1abb h ARG 426 Ca 0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.31 1abb h ARG 426 Cb 0.35 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.43 1abb h ARG 426 CO -0.49 0.33 -0.53 0.00 0.10 0.00 0.00 179.97 179.39 1abb h ARG 427 N 0.00 0.00 0.00 0.08 3.08 -0.81 -3.28 114.38 113.45 1abb h ARG 427 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1abb h ARG 427 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1abb h ARG 427 CO 0.04 0.00 -0.89 -1.33 -1.07 0.00 0.00 179.97 176.72 1abb n MET 428 N -2.47 0.38 -1.27 0.04 2.81 -0.26 -4.97 117.12 111.37 1abb n MET 428 Ca 0.03 0.06 -0.36 0.00 -1.81 0.00 0.00 57.70 55.61 1abb n MET 428 Cb 0.49 -1.68 0.07 0.00 -0.71 0.00 0.00 33.22 31.39 1abb n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1abb n SER 429 N -2.20 -0.86 0.03 7.83 2.88 -1.10 -4.94 113.62 115.27 1abb n SER 429 Ca 0.02 0.60 0.11 0.00 -1.33 0.00 0.00 58.87 58.28 1abb n SER 429 Cb 0.47 -1.25 0.05 0.00 -0.75 0.00 0.00 64.21 62.73 1abb n SER 429 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1abb n LEU 430 N -0.59 0.63 -4.77 2.46 4.77 -1.26 -4.83 117.00 113.40 1abb n LEU 430 Ca 0.11 0.02 -0.36 0.00 -0.03 0.00 0.00 56.01 55.74 1abb n LEU 430 Cb 0.50 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 1abb n LEU 430 CO 0.50 0.03 -0.08 -0.69 -1.33 0.00 0.00 177.39 175.82 1abb s VAL 431 N -3.18 5.34 -0.06 4.08 1.01 -1.26 -0.59 120.40 125.74 1abb s VAL 431 Ca 0.04 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.48 1abb s VAL 431 Cb 0.14 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1abb s VAL 431 CO 0.79 0.47 -0.18 -0.70 0.00 0.00 0.00 175.10 175.48 1abb s GLU 432 N -0.05 2.58 -0.20 2.72 2.12 0.54 -4.95 118.70 121.46 1abb s GLU 432 Ca 0.15 -0.77 -0.03 0.00 0.36 0.00 0.00 54.97 54.67 1abb s GLU 432 Cb -0.13 -2.32 -0.01 0.00 0.26 0.00 0.00 34.13 31.93 1abb s GLU 432 CO 0.03 0.51 -0.06 -1.21 -0.54 0.00 0.00 175.26 173.99 1abb s GLU 433 N -0.44 3.39 0.00 4.30 0.41 -1.26 -1.68 118.70 123.42 1abb s GLU 433 Ca 0.05 -0.63 0.00 0.00 -0.41 0.00 0.00 54.97 53.98 1abb s GLU 433 Cb -0.12 -2.94 0.00 0.00 -1.78 0.00 0.00 34.13 29.29 1abb s GLU 433 CO 0.02 -0.11 0.00 0.41 -0.49 0.00 0.00 175.26 175.09 1abb n GLY 434 N 4.52 1.39 3.68 -1.39 0.00 -1.26 -5.04 105.19 107.09 1abb n GLY 434 Ca -0.18 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1abb n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb s ALA 435 N -1.00 3.48 0.02 4.61 0.00 -1.26 -4.37 121.76 123.25 1abb s ALA 435 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1abb s ALA 435 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1abb s ALA 435 CO 0.00 -0.69 0.00 0.28 0.00 0.00 0.00 175.76 175.35 1abb n VAL 436 N 4.72 -4.19 -2.76 0.00 0.31 -1.26 -4.96 118.33 110.19 1abb n VAL 436 Ca 0.08 0.63 -0.43 0.00 -0.01 0.00 0.00 64.34 64.61 1abb n VAL 436 Cb 0.48 -3.11 -0.03 0.00 -0.91 0.00 0.00 33.84 30.27 1abb n VAL 436 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1abb s LYS 437 N -2.17 3.71 0.30 5.55 2.20 -1.26 -4.70 119.74 123.38 1abb s LYS 437 Ca 0.00 0.44 0.07 0.00 -0.36 0.00 0.00 55.97 56.13 1abb s LYS 437 Cb 0.00 -3.87 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 1abb s LYS 437 CO 0.00 -1.14 0.25 1.03 -0.36 0.00 0.00 175.35 175.14 1abb s ARG 438 N 3.79 2.80 -0.04 4.03 0.52 -0.68 -0.99 118.95 128.38 1abb s ARG 438 Ca 0.40 -1.20 0.05 0.00 -0.52 0.00 0.00 55.73 54.46 1abb s ARG 438 Cb -0.10 -2.51 -0.02 0.00 0.52 0.00 0.00 34.95 32.83 1abb s ARG 438 CO 0.24 0.22 -0.18 0.42 0.02 0.00 0.00 175.30 176.01 1abb s ILE 439 N -2.24 2.71 -0.42 1.52 -1.09 -0.38 -0.34 121.20 120.95 1abb s ILE 439 Ca 0.38 -0.86 -0.11 0.00 -2.23 0.00 0.00 60.65 57.83 1abb s ILE 439 Cb -0.07 -2.03 0.06 0.00 -1.58 0.00 0.00 42.46 38.85 1abb s ILE 439 CO 0.26 0.58 0.29 0.21 -1.23 0.00 0.00 174.94 175.05 1abb s ASN 440 N -0.62 5.81 0.34 3.58 3.84 0.25 -1.99 114.94 126.15 1abb s ASN 440 Ca 0.09 -1.32 0.27 0.00 0.21 0.00 0.00 52.86 52.11 1abb s ASN 440 Cb -0.11 -2.05 0.94 0.00 -0.55 0.00 0.00 41.25 39.48 1abb s ASN 440 CO 0.00 -0.53 1.78 0.24 -2.79 0.00 0.00 177.10 175.80 1abb h MET 441 N 8.52 0.00 -0.02 0.43 2.86 -1.69 -1.79 114.93 123.23 1abb h MET 441 Ca -0.25 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1abb h MET 441 Cb 1.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.76 1abb h MET 441 CO 0.77 0.00 -0.06 0.00 1.06 0.00 0.00 176.91 178.68 1abb h ALA 442 N 2.23 0.04 0.00 6.32 0.00 -1.93 -2.44 119.26 123.48 1abb h ALA 442 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1abb h ALA 442 Cb 0.58 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1abb h ALA 442 CO 0.00 -0.11 -0.18 0.45 0.00 0.00 0.00 179.25 179.41 1abb h HIS 443 N -0.49 0.00 0.26 0.00 3.86 -1.70 -1.21 115.15 115.87 1abb h HIS 443 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1abb h HIS 443 Cb 0.67 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.15 1abb h HIS 443 CO 0.13 0.18 -0.13 1.25 0.86 0.00 0.00 177.93 180.22 1abb h LEU 444 N 0.00 -0.30 -0.47 2.43 6.46 -1.47 -2.18 115.31 119.78 1abb h LEU 444 Ca -0.00 -0.07 0.05 0.00 -0.12 0.00 0.00 57.88 57.74 1abb h LEU 444 Cb 0.48 0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 40.43 1abb h LEU 444 CO 0.02 -0.12 0.20 0.00 -0.62 0.00 0.00 178.44 177.93 1abb h ILE 446 N 0.40 1.26 0.24 0.00 2.04 -1.27 -1.30 117.51 118.87 1abb h ILE 446 Ca 0.22 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 1abb h ILE 446 Cb 0.18 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1abb h ILE 446 CO -0.19 0.37 -0.12 0.00 0.00 0.00 0.00 178.15 178.22 1abb h ALA 447 N 1.15 -0.32 -0.16 1.87 0.00 -1.11 -3.27 119.26 117.42 1abb h ALA 447 Ca 0.19 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1abb h ALA 447 Cb 0.42 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1abb h ALA 447 CO 0.01 -0.48 0.03 0.41 0.00 0.00 0.00 179.25 179.23 1abb n GLY 448 N -0.11 2.01 3.53 0.00 0.00 -0.59 -4.87 105.19 105.16 1abb n GLY 448 Ca -0.09 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 1abb n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1abb s SER 449 N -0.04 3.95 0.00 1.61 0.01 -0.50 -3.96 113.70 114.78 1abb s SER 449 Ca 0.13 -0.84 0.19 0.00 1.31 0.00 0.00 55.95 56.74 1abb s SER 449 Cb 0.10 -0.52 0.42 0.00 0.21 0.00 0.00 66.02 66.23 1abb s SER 449 CO 0.03 0.05 1.34 0.00 0.41 0.00 0.00 173.24 175.07 1abb n HIS 450 N -0.52 0.56 -3.58 2.43 1.44 0.52 -4.91 115.22 111.15 1abb n HIS 450 Ca -0.07 -0.35 -0.02 0.00 -2.01 0.00 0.00 57.72 55.27 1abb n HIS 450 Cb 0.59 -0.01 -0.06 0.00 0.12 0.00 0.00 29.99 30.63 1abb n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1abb s ALA 451 N -1.19 -2.29 0.24 1.59 0.00 -1.26 -4.76 121.76 114.10 1abb s ALA 451 Ca 0.35 2.23 0.08 0.00 0.00 0.00 0.00 51.96 54.62 1abb s ALA 451 Cb 0.19 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 1abb s ALA 451 CO 0.26 -0.59 0.05 0.08 0.00 0.00 0.00 175.76 175.57 1abb s VAL 452 N 1.88 3.76 -0.03 0.00 1.01 0.15 -2.21 120.40 124.96 1abb s VAL 452 Ca -0.07 -1.68 -0.30 0.00 0.00 0.00 0.00 61.98 59.93 1abb s VAL 452 Cb -0.06 -2.99 0.08 0.00 0.00 0.00 0.00 36.38 33.41 1abb s VAL 452 CO -0.17 -0.31 0.73 0.54 0.00 0.00 0.00 175.10 175.88 1abb s ASN 453 N -3.57 -0.59 0.56 3.32 4.22 -1.01 -0.58 114.94 117.30 1abb s ASN 453 Ca 0.31 0.53 0.09 0.00 -2.14 0.00 0.00 52.86 51.65 1abb s ASN 453 Cb -0.07 0.50 0.07 0.00 1.28 0.00 0.00 41.25 43.03 1abb s ASN 453 CO 0.21 -0.62 0.72 -0.83 -2.04 0.00 0.00 177.10 174.53 1abb s GLY 454 N -1.47 1.84 0.00 0.45 0.00 -1.16 -2.03 107.32 104.96 1abb s GLY 454 Ca -0.07 -1.99 0.00 0.00 0.00 0.00 0.00 44.72 42.66 1abb s GLY 454 CO 0.04 -1.72 0.93 1.55 0.00 0.00 0.00 173.10 173.91 1abb n VAL 455 N -2.14 0.87 -3.61 1.40 3.14 -1.26 -0.79 118.33 115.94 1abb n VAL 455 Ca 0.13 -0.88 -0.09 0.00 -2.96 0.00 0.00 64.34 60.53 1abb n VAL 455 Cb 0.62 0.57 -0.06 0.00 -1.06 0.00 0.00 33.84 33.90 1abb n VAL 455 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1abb s ALA 456 N -0.87 -1.98 0.31 1.55 0.00 -1.26 -1.12 121.76 118.39 1abb s ALA 456 Ca 0.00 1.75 0.02 0.00 0.00 0.00 0.00 51.96 53.73 1abb s ALA 456 Cb 0.00 -1.18 0.59 0.00 0.00 0.00 0.00 23.12 22.53 1abb s ALA 456 CO 0.00 -0.25 1.90 0.00 0.00 0.00 0.00 175.76 177.40 1abb h ARG 457 N 3.41 0.92 -0.50 0.00 3.08 -1.92 0.03 114.38 119.41 1abb h ARG 457 Ca -0.24 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.71 1abb h ARG 457 Cb 1.17 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1abb h ARG 457 CO 0.20 0.61 0.12 -0.84 -1.07 0.00 0.00 179.97 178.99 1abb h ILE 458 N 0.95 1.24 -0.64 2.04 3.07 -1.92 -2.03 117.51 120.22 1abb h ILE 458 Ca 0.41 -0.85 -0.06 0.00 1.55 0.00 0.00 64.86 65.90 1abb h ILE 458 Cb 0.32 0.84 -0.03 0.00 -0.27 0.00 0.00 36.82 37.68 1abb h ILE 458 CO -0.17 0.31 0.16 -0.74 -1.05 0.00 0.00 178.15 176.66 1abb h HIS 459 N 0.69 1.05 -0.84 0.16 2.76 -1.71 0.82 115.15 118.08 1abb h HIS 459 Ca 0.16 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1abb h HIS 459 Cb 0.33 -0.30 -0.04 0.00 1.55 0.00 0.00 27.41 28.95 1abb h HIS 459 CO 0.02 0.86 0.53 0.77 -1.30 0.00 0.00 177.93 178.81 1abb h SER 460 N 0.96 0.98 -0.16 3.26 0.02 -0.92 -2.98 113.55 114.72 1abb h SER 460 Ca 0.20 -0.05 -0.17 0.00 -0.84 0.00 0.00 61.79 60.93 1abb h SER 460 Cb 0.34 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 1abb h SER 460 CO 0.00 0.74 -0.54 -0.33 -1.14 0.00 0.00 176.83 175.55 1abb h GLU 461 N 1.14 0.75 0.00 3.45 4.39 -0.18 -2.64 114.58 121.50 1abb h GLU 461 Ca 0.30 -0.47 -0.08 0.00 0.34 0.00 0.00 59.36 59.45 1abb h GLU 461 Cb -0.09 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1abb h GLU 461 CO -0.06 1.10 -0.40 -0.84 -1.16 0.00 0.00 179.01 177.65 1abb h ILE 462 N 0.58 1.11 -0.30 3.13 3.07 -0.98 0.19 117.51 124.31 1abb h ILE 462 Ca 0.01 -1.45 0.00 0.00 1.55 0.00 0.00 64.86 64.97 1abb h ILE 462 Cb 1.12 1.82 -0.01 0.00 -0.27 0.00 0.00 36.82 39.48 1abb h ILE 462 CO 0.11 0.39 0.19 -0.07 -1.05 0.00 0.00 178.15 177.72 1abb h LEU 463 N 0.00 0.35 -0.55 0.16 3.38 -1.36 0.14 115.31 117.43 1abb h LEU 463 Ca -0.00 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 1abb h LEU 463 Cb 0.79 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1abb h LEU 463 CO 0.05 0.28 -0.45 0.11 0.09 0.00 0.00 178.44 178.52 1abb h LYS 464 N 0.39 0.66 0.10 1.13 1.57 -0.95 0.19 116.57 119.66 1abb h LYS 464 Ca 0.11 -0.36 -0.37 0.00 -1.87 0.00 0.00 60.65 58.15 1abb h LYS 464 Cb -0.02 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 1abb h LYS 464 CO -0.02 0.97 -2.12 1.63 -0.57 0.00 0.00 179.45 179.34 1abb n LYS 465 N -4.01 0.73 -0.01 3.15 5.02 -0.04 -4.16 118.16 118.85 1abb n LYS 465 Ca -0.02 0.23 -0.01 0.00 -2.02 0.00 0.00 58.31 56.49 1abb n LYS 465 Cb 0.55 -1.66 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1abb n LYS 465 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1abb n THR 466 N -3.43 0.17 0.43 -0.18 -2.24 0.29 -4.62 114.28 104.71 1abb n THR 466 Ca -0.35 0.33 -0.18 0.00 -2.27 0.00 0.00 64.05 61.57 1abb n THR 466 Cb 1.03 -1.43 -0.09 0.00 -2.10 0.00 0.00 70.33 67.74 1abb n THR 466 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1abb h ILE 467 N -0.08 0.13 -0.75 2.28 5.03 -1.01 -3.07 117.51 120.03 1abb h ILE 467 Ca 0.00 -0.11 -0.38 0.00 -0.12 0.00 0.00 64.86 64.26 1abb h ILE 467 Cb 0.08 0.15 -0.22 0.00 -3.03 0.00 0.00 36.82 33.80 1abb h ILE 467 CO 0.00 0.01 0.37 0.49 -0.68 0.00 0.00 178.15 178.34 1abb n PHE 468 N -5.53 2.33 0.30 1.37 3.72 0.67 -4.83 117.46 115.49 1abb n PHE 468 Ca -0.14 -1.71 0.18 0.00 -0.05 0.00 0.00 57.45 55.73 1abb n PHE 468 Cb 0.44 -0.77 0.97 0.00 -0.94 0.00 0.00 39.48 39.18 1abb n PHE 468 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1abb h LYS 469 N 1.14 0.00 0.00 -1.08 2.10 -1.55 0.20 116.57 117.38 1abb h LYS 469 Ca 0.46 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 59.10 1abb h LYS 469 Cb 2.41 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.73 1abb h LYS 469 CO 0.83 0.03 -0.07 -0.44 -2.00 0.00 0.00 179.45 177.79 1abb h ASP 470 N 0.00 0.00 1.01 7.07 3.32 -1.88 0.48 116.42 126.42 1abb h ASP 470 Ca -0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1abb h ASP 470 Cb 0.17 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1abb h ASP 470 CO 0.00 0.07 -1.03 -0.26 -1.72 0.00 0.00 179.24 176.30 1abb h PHE 471 N 0.00 0.00 -0.48 4.55 -1.00 -1.12 -1.82 116.94 117.07 1abb h PHE 471 Ca -0.00 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 1abb h PHE 471 Cb 1.03 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.57 1abb h PHE 471 CO 0.00 0.82 0.12 -0.92 -1.61 0.00 0.00 178.31 176.72 1abb h TYR 472 N 0.00 0.79 -0.38 -0.55 3.20 -0.46 -1.72 116.97 117.85 1abb h TYR 472 Ca -0.07 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.69 1abb h TYR 472 Cb 1.69 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.72 1abb h TYR 472 CO 0.00 0.71 0.17 0.93 -1.64 0.00 0.00 178.16 178.33 1abb h GLU 473 N 0.64 0.56 -0.06 1.82 5.08 -0.88 -0.98 114.58 120.76 1abb h GLU 473 Ca 0.15 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.26 1abb h GLU 473 Cb 0.31 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1abb h GLU 473 CO -0.00 0.52 -0.66 1.25 -1.00 0.00 0.00 179.01 179.12 1abb h LEU 474 N 0.47 0.30 -6.03 1.33 7.12 -1.35 -3.41 115.31 113.74 1abb h LEU 474 Ca 0.13 -0.18 -0.56 0.00 0.13 0.00 0.00 57.88 57.39 1abb h LEU 474 Cb 0.16 -0.09 -0.39 0.00 -0.53 0.00 0.00 40.66 39.81 1abb h LEU 474 CO -0.01 0.87 -1.09 -0.62 -0.13 0.00 0.00 178.44 177.46 1abb n GLU 475 N -3.83 0.70 0.30 1.25 1.02 -0.65 -4.98 120.64 114.46 1abb n GLU 475 Ca -0.03 -3.24 0.19 0.00 -0.02 0.00 0.00 57.16 54.06 1abb n GLU 475 Cb 0.66 -1.26 0.93 0.00 -0.02 0.00 0.00 31.44 31.75 1abb n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1abb h PRO 476 N 4.11 0.00 0.00 3.49 0.13 -1.36 -1.11 132.00 137.26 1abb h PRO 476 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1abb h PRO 476 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1abb h PRO 476 CO 0.46 0.02 0.00 1.12 -0.23 0.00 0.00 178.00 179.37 1abb h HIS 477 N 0.00 0.00 0.03 1.56 2.07 -1.94 -3.26 115.15 113.61 1abb h HIS 477 Ca -0.00 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 57.25 1abb h HIS 477 Cb 0.26 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.21 1abb h HIS 477 CO 0.00 0.00 -1.49 0.87 -3.07 0.00 0.00 177.93 174.24 1abb h LYS 478 N 0.00 0.06 -5.83 5.12 1.57 -1.49 -3.47 116.57 112.53 1abb h LYS 478 Ca 0.00 -0.10 -0.59 0.00 -1.87 0.00 0.00 60.65 58.09 1abb h LYS 478 Cb 0.22 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.49 1abb h LYS 478 CO 0.00 0.79 0.43 -0.06 -0.57 0.00 0.00 179.45 180.04 1abb s PHE 479 N -2.63 3.35 0.00 -1.35 0.40 -1.23 -0.67 117.98 115.84 1abb s PHE 479 Ca -0.05 1.16 0.00 0.00 -0.60 0.00 0.00 56.93 57.45 1abb s PHE 479 Cb 0.08 -3.03 0.00 0.00 0.51 0.00 0.00 43.02 40.59 1abb s PHE 479 CO 0.83 -0.34 0.00 1.04 0.70 0.00 0.00 175.22 177.44 1abb n GLN 480 N 5.73 2.47 -3.81 0.44 6.02 0.25 -4.94 117.38 123.54 1abb n GLN 480 Ca 0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.92 1abb n GLN 480 Cb 0.48 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.66 1abb n GLN 480 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1abb s ASN 481 N -0.53 -0.06 -0.29 1.08 3.84 -1.26 -2.97 114.94 114.74 1abb s ASN 481 Ca 0.00 -0.18 0.04 0.00 0.21 0.00 0.00 52.86 52.93 1abb s ASN 481 Cb 0.00 0.30 0.19 0.00 -0.55 0.00 0.00 41.25 41.19 1abb s ASN 481 CO 0.00 -0.51 0.56 -0.54 -2.79 0.00 0.00 177.10 173.82 1abb s LYS 482 N -2.06 0.54 0.38 0.43 -0.14 0.03 -4.85 119.74 114.06 1abb s LYS 482 Ca -0.09 0.56 -0.27 0.00 -1.36 0.00 0.00 55.97 54.81 1abb s LYS 482 Cb -0.03 0.20 -0.09 0.00 -1.68 0.00 0.00 37.83 36.23 1abb s LYS 482 CO -0.01 -0.97 1.31 0.99 -0.76 0.00 0.00 175.35 175.91 1abb s THR 483 N 2.79 2.63 1.05 2.17 2.01 -1.26 -4.08 115.64 120.96 1abb s THR 483 Ca 0.12 0.60 -0.16 0.00 0.31 0.00 0.00 61.69 62.56 1abb s THR 483 Cb -0.11 -3.36 0.10 0.00 0.01 0.00 0.00 72.50 69.13 1abb s THR 483 CO -0.26 0.11 0.27 0.59 -0.69 0.00 0.00 174.62 174.65 1abb n ASN 484 N 0.38 -2.13 -3.58 3.53 3.02 -0.27 -4.63 115.26 111.59 1abb n ASN 484 Ca 0.02 0.06 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 1abb n ASN 484 Cb 0.43 -1.09 -0.05 0.00 -0.61 0.00 0.00 39.78 38.46 1abb n ASN 484 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1abb s GLY 485 N -1.98 -0.25 0.21 7.41 0.00 -1.26 -4.81 107.32 106.65 1abb s GLY 485 Ca 0.58 2.02 0.08 0.00 0.00 0.00 0.00 44.72 47.39 1abb s GLY 485 CO 0.66 0.97 0.03 -1.50 0.00 0.00 0.00 173.10 173.25 1abb s ILE 486 N -1.30 3.74 -0.17 0.90 1.10 -1.13 -4.28 121.20 120.05 1abb s ILE 486 Ca 0.00 -1.58 -0.18 0.00 -0.51 0.00 0.00 60.65 58.39 1abb s ILE 486 Cb -0.01 -2.94 -0.04 0.00 0.15 0.00 0.00 42.46 39.63 1abb s ILE 486 CO -0.00 -0.23 0.47 0.28 -2.11 0.00 0.00 174.94 173.35 1abb s THR 487 N -1.98 5.16 -0.37 4.00 -1.32 -1.26 0.33 115.64 120.20 1abb s THR 487 Ca 0.29 0.88 0.04 0.00 -1.21 0.00 0.00 61.69 61.70 1abb s THR 487 Cb -0.08 -3.80 0.04 0.00 -1.51 0.00 0.00 72.50 67.15 1abb s THR 487 CO 0.20 0.25 0.94 -0.81 -2.21 0.00 0.00 174.62 172.99 1abb n PRO 488 N 4.33 0.03 -0.02 7.08 -0.04 -1.26 -2.36 135.00 142.76 1abb n PRO 488 Ca -0.06 0.38 -0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1abb n PRO 488 Cb 0.51 -1.84 -0.00 0.00 -0.04 0.00 0.00 33.50 32.12 1abb n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1abb h ARG 489 N 0.00 0.00 -0.20 0.54 -0.00 -1.94 -1.66 114.38 111.13 1abb h ARG 489 Ca 0.00 0.00 0.04 0.00 -0.50 0.00 0.00 59.98 59.52 1abb h ARG 489 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.44 1abb h ARG 489 CO 0.00 0.00 -0.02 -0.09 0.00 0.00 0.00 179.97 179.86 1abb h ARG 490 N -0.37 0.04 -0.79 0.04 2.43 -1.97 0.31 114.38 114.08 1abb h ARG 490 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1abb h ARG 490 Cb 0.05 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1abb h ARG 490 CO 0.00 0.03 0.00 0.91 -1.51 0.00 0.00 179.97 179.40 1abb n TRP 491 N -5.16 0.53 0.07 2.20 5.03 -1.00 -0.95 117.44 118.16 1abb n TRP 491 Ca -0.02 -0.19 0.00 0.00 3.03 0.00 0.00 57.50 60.32 1abb n TRP 491 Cb 0.11 -0.18 0.00 0.00 -1.03 0.00 0.00 31.31 30.21 1abb n TRP 491 CO 0.00 0.00 0.00 -0.11 -0.03 0.00 0.00 177.69 177.55 1abb n LEU 492 N 0.16 -1.20 -0.05 -0.99 -0.00 -1.14 -4.83 117.00 108.95 1abb n LEU 492 Ca 0.07 0.30 -0.09 0.00 -0.00 0.00 0.00 56.01 56.29 1abb n LEU 492 Cb 0.46 1.40 -0.02 0.00 -0.00 0.00 0.00 43.42 45.26 1abb n LEU 492 CO 0.08 -0.16 0.89 0.58 -0.00 0.00 0.00 177.39 178.79 1abb h VAL 493 N 0.00 0.91 0.27 1.96 2.07 -0.29 0.79 116.25 121.96 1abb h VAL 493 Ca 0.00 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1abb h VAL 493 Cb 0.00 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1abb h VAL 493 CO 0.00 0.02 -0.13 0.25 0.02 0.00 0.00 177.57 177.73 1abb h LEU 494 N 0.13 -0.31 0.20 2.57 6.46 -0.47 -3.23 115.31 120.65 1abb h LEU 494 Ca 0.10 -0.22 -0.30 0.00 -0.12 0.00 0.00 57.88 57.33 1abb h LEU 494 Cb 0.09 0.08 0.02 0.00 -0.73 0.00 0.00 40.66 40.12 1abb h LEU 494 CO -0.13 0.13 -1.41 0.00 -0.62 0.00 0.00 178.44 176.41 1abb n ASN 496 N -3.80 4.99 0.05 0.00 2.85 0.27 -4.92 115.26 114.69 1abb n ASN 496 Ca -0.20 -3.54 0.00 0.00 -0.11 0.00 0.00 54.58 50.74 1abb n ASN 496 Cb 1.01 -0.83 0.32 0.00 1.24 0.00 0.00 39.78 41.52 1abb n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1abb h PRO 497 N 4.11 0.41 -0.04 1.20 0.13 -1.65 -1.41 132.00 134.75 1abb h PRO 497 Ca 0.23 -0.10 0.02 0.00 -0.87 0.00 0.00 66.00 65.28 1abb h PRO 497 Cb 0.56 -0.05 -0.06 0.00 0.13 0.00 0.00 31.00 31.58 1abb h PRO 497 CO 0.98 0.50 -0.53 0.78 -0.23 0.00 0.00 178.00 179.50 1abb h GLY 498 N 0.83 -1.08 0.54 1.56 0.00 -1.91 0.46 103.07 103.46 1abb h GLY 498 Ca 0.08 0.66 0.11 0.00 0.00 0.00 0.00 47.33 48.17 1abb h GLY 498 CO 0.02 -0.22 0.64 -2.00 0.00 0.00 0.00 176.54 174.97 1abb h LEU 499 N -0.64 0.96 -0.62 3.11 5.85 -1.66 0.66 115.31 122.98 1abb h LEU 499 Ca 0.02 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1abb h LEU 499 Cb 0.71 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1abb h LEU 499 CO -0.38 0.54 0.19 0.00 -0.34 0.00 0.00 178.44 178.45 1abb h ALA 500 N 1.52 0.81 0.61 1.25 0.00 0.13 -2.88 119.26 120.70 1abb h ALA 500 Ca 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1abb h ALA 500 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1abb h ALA 500 CO -0.24 0.48 -0.40 1.49 0.00 0.00 0.00 179.25 180.58 1abb h GLU 501 N 0.88 -0.93 -0.66 0.00 4.81 0.47 0.26 114.58 119.41 1abb h GLU 501 Ca 0.20 0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1abb h GLU 501 Cb 0.29 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1abb h GLU 501 CO -0.01 -0.62 0.44 -0.84 -0.73 0.00 0.00 179.01 177.25 1abb h ILE 502 N -0.97 1.10 -0.15 2.32 3.07 -1.49 0.69 117.51 122.08 1abb h ILE 502 Ca -0.07 -0.27 -0.09 0.00 1.55 0.00 0.00 64.86 65.97 1abb h ILE 502 Cb 0.79 0.23 -0.01 0.00 -0.27 0.00 0.00 36.82 37.56 1abb h ILE 502 CO 0.06 0.15 -0.30 0.40 -1.05 0.00 0.00 178.15 177.41 1abb h ILE 503 N 0.80 1.26 -0.17 0.16 2.04 -1.15 -2.98 117.51 117.47 1abb h ILE 503 Ca 0.26 -1.26 -0.12 0.00 1.00 0.00 0.00 64.86 64.74 1abb h ILE 503 Cb 0.06 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1abb h ILE 503 CO -0.07 0.38 -0.37 0.00 0.00 0.00 0.00 178.15 178.09 1abb h ALA 504 N 1.44 0.27 -0.73 1.87 0.00 0.38 -2.36 119.26 120.13 1abb h ALA 504 Ca 0.04 -0.44 0.16 0.00 0.00 0.00 0.00 54.91 54.67 1abb h ALA 504 Cb 0.66 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.29 1abb h ALA 504 CO 0.05 0.35 0.06 0.93 0.00 0.00 0.00 179.25 180.64 1abb h GLU 505 N 0.19 0.15 -0.00 0.00 5.08 -0.92 0.23 114.58 119.31 1abb h GLU 505 Ca 0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1abb h GLU 505 Cb 0.98 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1abb h GLU 505 CO 0.08 0.10 -0.07 0.00 -1.00 0.00 0.00 179.01 178.12 1abb h ARG 506 N 0.16 0.05 -0.00 2.33 2.47 -1.55 -3.42 114.38 114.42 1abb h ARG 506 Ca 0.40 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 59.07 1abb h ARG 506 Cb 0.70 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.03 1abb h ARG 506 CO -0.59 0.78 -0.06 0.44 0.56 0.00 0.00 179.97 181.11 1abb n ILE 507 N -4.67 0.00 -0.40 2.04 -5.35 -0.84 -5.14 119.36 105.01 1abb n ILE 507 Ca -0.09 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 1abb n ILE 507 Cb 0.40 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.37 1abb n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1abb n GLY 508 N 0.50 -1.86 0.09 3.28 0.00 0.76 -4.62 105.19 103.35 1abb n GLY 508 Ca 0.02 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.13 1abb n GLY 508 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1abb n GLU 509 N 0.00 0.63 0.05 1.61 2.13 -1.26 -4.37 120.64 119.43 1abb n GLU 509 Ca 0.00 0.14 0.20 0.00 0.66 0.00 0.00 57.16 58.16 1abb n GLU 509 Cb 0.00 -1.76 0.72 0.00 0.27 0.00 0.00 31.44 30.67 1abb n GLU 509 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1abb h GLU 510 N 0.00 0.00 -0.92 5.31 4.81 -1.95 0.16 114.58 121.98 1abb h GLU 510 Ca -0.13 0.00 0.27 0.00 -0.13 0.00 0.00 59.36 59.37 1abb h GLU 510 Cb 1.42 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.65 1abb h GLU 510 CO 0.03 0.00 0.34 0.10 -0.73 0.00 0.00 179.01 178.75 1abb h TYR 511 N 0.00 0.54 -0.00 0.92 -0.00 -1.83 -0.38 116.97 116.22 1abb h TYR 511 Ca 0.21 0.05 0.00 0.00 0.00 0.00 0.00 58.73 58.99 1abb h TYR 511 Cb 0.93 -0.09 -0.00 0.00 0.00 0.00 0.00 36.73 37.57 1abb h TYR 511 CO 0.00 -0.21 0.00 0.82 -0.00 0.00 0.00 178.16 178.78 1abb h ILE 512 N 0.24 0.80 -0.01 -0.90 2.04 -1.03 0.45 117.51 119.10 1abb h ILE 512 Ca 0.62 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.48 1abb h ILE 512 Cb 1.31 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1abb h ILE 512 CO -0.65 0.00 -0.27 -0.24 0.00 0.00 0.00 178.15 176.99 1abb n SER 513 N -4.25 1.54 -3.23 1.72 2.88 -0.52 -4.74 113.62 107.03 1abb n SER 513 Ca -0.03 -1.27 -0.24 0.00 -1.33 0.00 0.00 58.87 56.00 1abb n SER 513 Cb 0.09 0.43 -0.07 0.00 -0.75 0.00 0.00 64.21 63.91 1abb n SER 513 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1abb n ASP 514 N -0.09 -0.18 0.03 -3.46 -0.08 0.15 -5.04 116.55 107.87 1abb n ASP 514 Ca 0.06 -2.61 0.08 0.00 -1.51 0.00 0.00 54.79 50.81 1abb n ASP 514 Cb 0.30 -0.50 0.35 0.00 2.34 0.00 0.00 41.12 43.61 1abb n ASP 514 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1abb n LEU 515 N 1.88 0.15 -0.01 -2.67 7.94 -0.55 -2.83 117.00 120.91 1abb n LEU 515 Ca 0.23 0.54 0.01 0.00 -1.11 0.00 0.00 56.01 55.68 1abb n LEU 515 Cb 0.52 -0.52 0.34 0.00 0.53 0.00 0.00 43.42 44.29 1abb n LEU 515 CO 0.14 -0.33 1.02 0.44 -1.11 0.00 0.00 177.39 177.55 1abb h ASP 516 N 0.00 0.49 0.00 1.96 3.32 -1.85 -2.04 116.42 118.30 1abb h ASP 516 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1abb h ASP 516 Cb 0.27 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1abb h ASP 516 CO 0.00 0.49 0.06 1.67 -1.72 0.00 0.00 179.24 179.74 1abb n GLN 517 N -4.35 0.00 0.00 3.56 7.27 -1.13 -0.44 117.38 122.29 1abb n GLN 517 Ca 0.02 0.15 0.12 0.00 0.07 0.00 0.00 57.00 57.36 1abb n GLN 517 Cb 0.18 -1.56 0.55 0.00 2.41 0.00 0.00 30.24 31.82 1abb n GLN 517 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1abb n LEU 518 N -1.08 0.00 0.22 1.69 4.77 -0.77 -3.18 117.00 118.66 1abb n LEU 518 Ca 0.00 0.42 0.15 0.00 -0.03 0.00 0.00 56.01 56.55 1abb n LEU 518 Cb 0.06 -0.42 0.80 0.00 -2.33 0.00 0.00 43.42 41.52 1abb n LEU 518 CO 0.00 -0.08 1.13 0.03 -1.33 0.00 0.00 177.39 177.14 1abb h ARG 519 N 0.00 0.00 -0.13 3.23 2.47 -0.19 -0.11 114.38 119.64 1abb h ARG 519 Ca 0.00 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.76 1abb h ARG 519 Cb 0.35 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 1abb h ARG 519 CO 0.00 0.00 0.12 0.87 0.56 0.00 0.00 179.97 181.52 1abb h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.79 0.14 116.57 116.53 1abb h LYS 520 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1abb h LYS 520 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1abb h LYS 520 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1abb n LEU 521 N -4.11 0.18 -0.13 2.94 4.32 -0.06 -1.52 117.00 118.62 1abb n LEU 521 Ca 0.00 0.57 -0.10 0.00 -0.02 0.00 0.00 56.01 56.46 1abb n LEU 521 Cb 0.23 -0.57 0.03 0.00 -1.62 0.00 0.00 43.42 41.49 1abb n LEU 521 CO 0.31 -0.53 0.66 -0.07 -1.22 0.00 0.00 177.39 176.54 1abb h LEU 522 N 0.00 0.93 -1.48 2.23 -0.00 -0.91 -2.26 115.31 113.83 1abb h LEU 522 Ca 0.00 -0.36 0.46 0.00 -0.00 0.00 0.00 57.88 57.98 1abb h LEU 522 Cb 0.11 -0.26 -0.12 0.00 -0.00 0.00 0.00 40.66 40.38 1abb h LEU 522 CO 0.00 1.13 0.93 0.28 -0.00 0.00 0.00 178.44 180.77 1abb h SER 523 N 0.78 0.20 -0.55 -0.43 0.02 -1.46 0.36 113.55 112.46 1abb h SER 523 Ca 0.10 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1abb h SER 523 Cb 0.80 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1abb h SER 523 CO 0.07 -0.18 0.00 -1.22 -1.14 0.00 0.00 176.83 174.35 1abb n TYR 524 N -4.61 1.36 -0.34 3.45 4.02 -0.85 -4.49 117.16 115.70 1abb n TYR 524 Ca 0.39 -0.65 0.06 0.00 -0.01 0.00 0.00 57.90 57.69 1abb n TYR 524 Cb 1.54 -0.26 0.25 0.00 -0.02 0.00 0.00 39.34 40.84 1abb n TYR 524 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1abb h VAL 525 N 3.50 0.97 -0.21 -0.72 2.07 -0.98 -1.54 116.25 119.33 1abb h VAL 525 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1abb h VAL 525 Cb 1.44 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1abb h VAL 525 CO 0.24 0.18 0.00 0.47 0.02 0.00 0.00 177.57 178.48 1abb n ASP 526 N -4.56 3.13 -4.72 0.57 8.00 -1.26 -4.78 116.55 112.92 1abb n ASP 526 Ca 0.17 -1.95 -0.42 0.00 0.71 0.00 0.00 54.79 53.31 1abb n ASP 526 Cb 0.30 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1abb n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1abb s ASP 527 N -1.61 7.00 0.00 -2.24 2.15 -0.58 -4.93 116.67 116.45 1abb s ASP 527 Ca 0.32 2.19 0.30 0.00 0.43 0.00 0.00 52.55 55.78 1abb s ASP 527 Cb 0.20 -2.59 1.50 0.00 -0.30 0.00 0.00 42.92 41.73 1abb s ASP 527 CO 0.29 -0.50 2.01 -0.62 -0.17 0.00 0.00 175.17 176.18 1abb n GLU 528 N 3.47 0.97 0.06 4.34 1.02 -1.26 -3.03 120.64 126.21 1abb n GLU 528 Ca 0.08 -0.25 -0.04 0.00 -0.02 0.00 0.00 57.16 56.94 1abb n GLU 528 Cb 0.44 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.35 1abb n GLU 528 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1abb h ALA 529 N 3.89 -0.27 -0.46 0.62 0.00 -1.94 -3.02 119.26 118.08 1abb h ALA 529 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1abb h ALA 529 Cb 0.23 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 1abb h ALA 529 CO 0.00 -0.25 -0.44 0.35 0.00 0.00 0.00 179.25 178.91 1abb h PHE 530 N -0.94 -1.36 -1.01 0.00 3.57 -1.89 0.95 116.94 116.26 1abb h PHE 530 Ca -0.03 0.08 0.38 0.00 3.53 0.00 0.00 57.97 61.93 1abb h PHE 530 Cb 0.19 0.65 -0.16 0.00 2.79 0.00 0.00 35.95 39.42 1abb h PHE 530 CO 0.01 -0.35 0.56 0.82 -2.23 0.00 0.00 178.31 177.12 1abb h ILE 531 N -0.21 0.14 0.14 1.41 2.04 -1.66 1.24 117.51 120.61 1abb h ILE 531 Ca 0.08 -0.05 -0.33 0.00 1.00 0.00 0.00 64.86 65.55 1abb h ILE 531 Cb 0.41 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1abb h ILE 531 CO -0.54 0.03 -1.69 0.08 0.00 0.00 0.00 178.15 176.02 1abb h ARG 532 N 0.15 0.29 -0.72 2.37 0.11 0.84 -3.12 114.38 114.31 1abb h ARG 532 Ca 0.80 -0.50 0.05 0.00 0.10 0.00 0.00 59.98 60.42 1abb h ARG 532 Cb 1.99 0.19 -0.04 0.00 1.11 0.00 0.00 29.97 33.22 1abb h ARG 532 CO -0.69 1.17 0.47 -0.44 0.10 0.00 0.00 179.97 180.59 1abb h ASP 533 N 0.08 0.71 -0.07 0.08 3.32 0.53 0.43 116.42 121.50 1abb h ASP 533 Ca -0.31 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.71 1abb h ASP 533 Cb 2.05 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 41.44 1abb h ASP 533 CO 0.15 0.48 -0.07 0.58 -1.72 0.00 0.00 179.24 178.66 1abb h VAL 534 N 0.82 1.37 -0.63 -1.35 2.07 0.09 0.75 116.25 119.37 1abb h VAL 534 Ca 0.30 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 1abb h VAL 534 Cb 0.14 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 1abb h VAL 534 CO -0.09 0.34 0.31 0.00 0.02 0.00 0.00 177.57 178.15 1abb h ALA 535 N 0.55 1.35 -0.18 1.67 0.00 -1.45 -1.43 119.26 119.77 1abb h ALA 535 Ca 0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1abb h ALA 535 Cb 0.58 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1abb h ALA 535 CO 0.02 0.51 0.11 -0.22 0.00 0.00 0.00 179.25 179.66 1abb h LYS 536 N 0.89 0.25 -0.20 0.00 1.63 0.19 0.25 116.57 119.59 1abb h LYS 536 Ca 0.22 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.02 1abb h LYS 536 Cb 0.09 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.62 1abb h LYS 536 CO -0.03 0.23 -0.32 0.28 -3.45 0.00 0.00 179.45 176.16 1abb h VAL 537 N 0.21 0.00 -0.45 2.00 2.07 -0.14 -0.30 116.25 119.64 1abb h VAL 537 Ca 0.06 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1abb h VAL 537 Cb 0.04 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 1abb h VAL 537 CO -0.01 0.00 0.30 0.50 0.02 0.00 0.00 177.57 178.37 1abb h LYS 538 N -0.25 0.56 -0.67 1.57 1.63 -0.41 0.29 116.57 119.29 1abb h LYS 538 Ca 0.04 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1abb h LYS 538 Cb 0.35 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.82 1abb h LYS 538 CO -0.32 0.37 0.34 0.37 -3.45 0.00 0.00 179.45 176.76 1abb h GLN 539 N 0.57 0.94 0.13 1.90 4.15 0.11 -1.10 115.11 121.82 1abb h GLN 539 Ca 0.17 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 1abb h GLN 539 Cb -0.02 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.49 1abb h GLN 539 CO -0.04 0.71 -0.06 0.93 -1.93 0.00 0.00 178.83 178.44 1abb h GLU 540 N 0.95 -0.17 -0.09 1.69 3.07 0.85 -2.37 114.58 118.51 1abb h GLU 540 Ca 0.24 0.01 0.04 0.00 -0.50 0.00 0.00 59.36 59.15 1abb h GLU 540 Cb 0.07 0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 27.96 1abb h GLU 540 CO -0.03 0.11 -0.26 -0.91 -1.40 0.00 0.00 179.01 176.51 1abb h ASN 541 N -0.44 -0.81 -0.10 1.42 -0.26 -0.72 -0.38 115.58 114.29 1abb h ASN 541 Ca -0.02 0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.83 1abb h ASN 541 Cb 0.35 0.35 -0.01 0.00 -1.06 0.00 0.00 38.32 37.95 1abb h ASN 541 CO 0.03 -0.32 0.02 0.11 -1.06 0.00 0.00 177.43 176.21 1abb h LYS 542 N -0.36 0.23 -0.03 0.81 1.57 -1.24 -1.33 116.57 116.23 1abb h LYS 542 Ca 0.09 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1abb h LYS 542 Cb 0.49 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 1abb h LYS 542 CO -0.29 0.24 0.01 -0.07 -0.57 0.00 0.00 179.45 178.76 1abb h LEU 543 N 0.23 0.05 0.09 2.94 -0.00 -0.57 -0.70 115.31 117.36 1abb h LEU 543 Ca 0.06 -0.23 0.01 0.00 -0.00 0.00 0.00 57.88 57.72 1abb h LEU 543 Cb 0.12 -0.01 -0.05 0.00 -0.00 0.00 0.00 40.66 40.72 1abb h LEU 543 CO -0.00 0.27 -0.49 0.11 -0.00 0.00 0.00 178.44 178.33 1abb h LYS 544 N -0.17 -0.66 -0.32 1.13 1.57 -0.07 -1.39 116.57 116.66 1abb h LYS 544 Ca 0.01 0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 1abb h LYS 544 Cb 0.24 0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1abb h LYS 544 CO 0.00 -0.44 -0.08 0.35 -0.57 0.00 0.00 179.45 178.71 1abb h PHE 545 N -0.69 -0.18 -0.76 -1.35 3.57 -1.39 0.57 116.94 116.71 1abb h PHE 545 Ca -0.00 0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.64 1abb h PHE 545 Cb 0.70 0.13 -0.08 0.00 2.79 0.00 0.00 35.95 39.49 1abb h PHE 545 CO -0.46 -0.14 0.37 0.00 -2.23 0.00 0.00 178.31 175.85 1abb h ALA 546 N 1.31 1.09 -0.49 2.41 0.00 -0.93 0.23 119.26 122.89 1abb h ALA 546 Ca 0.15 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1abb h ALA 546 Cb 0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1abb h ALA 546 CO -0.33 -0.08 0.18 0.00 0.00 0.00 0.00 179.25 179.02 1abb h ALA 547 N 1.49 1.41 -0.13 0.00 0.00 0.13 -0.80 119.26 121.35 1abb h ALA 547 Ca 0.40 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1abb h ALA 547 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1abb h ALA 547 CO -0.32 0.45 0.03 -0.92 0.00 0.00 0.00 179.25 178.49 1abb h TYR 548 N 0.69 0.06 0.00 0.00 3.20 -0.16 -2.11 116.97 118.65 1abb h TYR 548 Ca 0.17 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1abb h TYR 548 Cb 0.16 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1abb h TYR 548 CO 0.01 0.02 0.00 1.28 -1.64 0.00 0.00 178.16 177.83 1abb n LEU 549 N -5.08 0.04 0.00 2.82 4.32 -0.23 -0.08 117.00 118.79 1abb n LEU 549 Ca -0.04 -0.02 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1abb n LEU 549 Cb 0.06 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 1abb n LEU 549 CO 0.30 0.01 -0.21 -0.62 -1.22 0.00 0.00 177.39 175.65 1abb n GLU 550 N -0.12 1.18 0.01 3.23 -0.58 -1.06 -1.43 120.64 121.87 1abb n GLU 550 Ca 0.00 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.85 1abb n GLU 550 Cb 0.01 -0.71 -0.08 0.00 -0.57 0.00 0.00 31.44 30.09 1abb n GLU 550 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1abb n ARG 551 N -1.36 0.37 -3.38 3.49 0.63 0.89 -4.35 116.66 112.95 1abb n ARG 551 Ca 0.00 -0.06 -0.22 0.00 -0.92 0.00 0.00 57.85 56.64 1abb n ARG 551 Cb 0.21 -1.56 -0.09 0.00 0.45 0.00 0.00 32.46 31.47 1abb n ARG 551 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1abb s GLU 552 N -3.28 0.67 0.00 -0.14 2.02 -0.39 -5.03 118.70 112.55 1abb s GLU 552 Ca 0.00 -1.24 0.00 0.00 0.02 0.00 0.00 54.97 53.75 1abb s GLU 552 Cb 0.14 -1.01 0.00 0.00 0.10 0.00 0.00 34.13 33.36 1abb s GLU 552 CO 0.85 -1.24 0.00 0.66 0.02 0.00 0.00 175.26 175.56 1abb n TYR 553 N 3.89 0.00 -4.02 1.61 4.02 -1.26 -4.48 117.16 116.91 1abb n TYR 553 Ca 0.15 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.91 1abb n TYR 553 Cb 0.43 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.62 1abb n TYR 553 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1abb s LYS 554 N -2.56 0.28 0.00 -0.72 3.01 -1.23 -2.57 119.74 115.94 1abb s LYS 554 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 55.97 54.68 1abb s LYS 554 Cb 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 37.83 36.64 1abb s LYS 554 CO 0.00 0.04 0.00 0.28 0.51 0.00 0.00 175.35 176.18 1abb n VAL 555 N 2.56 0.00 -1.59 3.17 0.31 -0.51 -4.87 118.33 117.40 1abb n VAL 555 Ca -0.16 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1abb n VAL 555 Cb 0.58 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.51 1abb n VAL 555 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1abb n HIS 556 N -1.21 -0.33 -2.30 3.52 -0.00 -1.26 -5.11 115.22 108.53 1abb n HIS 556 Ca 0.00 0.16 -0.27 0.00 0.46 0.00 0.00 57.72 58.07 1abb n HIS 556 Cb 0.00 -1.70 0.16 0.00 -0.12 0.00 0.00 29.99 28.33 1abb n HIS 556 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1abb s ILE 557 N -0.10 2.02 -0.37 3.57 -1.09 -1.26 -5.02 121.20 118.94 1abb s ILE 557 Ca -0.01 -0.33 0.03 0.00 -2.23 0.00 0.00 60.65 58.11 1abb s ILE 557 Cb 0.00 -2.69 0.16 0.00 -1.58 0.00 0.00 42.46 38.35 1abb s ILE 557 CO 0.06 0.00 0.37 0.21 -1.23 0.00 0.00 174.94 174.35 1abb s ASN 558 N -4.87 1.24 0.00 3.58 3.84 -1.26 -5.02 114.94 112.45 1abb s ASN 558 Ca 0.72 -1.66 0.00 0.00 0.21 0.00 0.00 52.86 52.13 1abb s ASN 558 Cb -0.03 0.51 0.00 0.00 -0.55 0.00 0.00 41.25 41.17 1abb s ASN 558 CO 0.49 -0.26 0.48 -2.65 -2.79 0.00 0.00 177.10 172.38 1abb n PRO 559 N 4.18 0.00 0.10 0.43 -0.02 -1.26 -2.06 135.00 136.38 1abb n PRO 559 Ca 0.12 0.11 0.07 0.00 -2.02 0.00 0.00 63.50 61.77 1abb n PRO 559 Cb 0.45 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1abb n PRO 559 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1abb h ASN 560 N 0.00 0.00 -4.14 2.55 4.21 -1.95 -3.44 115.58 112.81 1abb h ASN 560 Ca 0.00 0.00 -0.45 0.00 1.21 0.00 0.00 56.30 57.06 1abb h ASN 560 Cb 0.42 0.00 0.14 0.00 -1.12 0.00 0.00 38.32 37.76 1abb h ASN 560 CO 0.00 0.24 0.30 -0.94 -1.29 0.00 0.00 177.43 175.74 1abb s SER 561 N -5.75 3.20 -0.77 5.81 1.04 -0.87 -5.01 113.70 111.34 1abb s SER 561 Ca 0.00 0.84 -0.24 0.00 0.48 0.00 0.00 55.95 57.03 1abb s SER 561 Cb 0.08 -1.31 0.05 0.00 0.10 0.00 0.00 66.02 64.95 1abb s SER 561 CO 0.77 -2.73 1.20 -0.22 0.98 0.00 0.00 173.24 173.24 1abb s LEU 562 N -6.11 3.73 -0.76 2.42 0.20 0.66 -4.85 118.68 113.97 1abb s LEU 562 Ca 0.66 -0.89 -0.25 0.00 0.69 0.00 0.00 54.13 54.34 1abb s LEU 562 Cb -0.13 -2.51 -0.16 0.00 -0.43 0.00 0.00 46.19 42.96 1abb s LEU 562 CO 0.53 -1.61 2.47 0.49 -0.29 0.00 0.00 176.35 177.94 1abb n PHE 563 N 8.58 0.94 -3.28 5.38 3.01 -1.26 -2.68 117.46 128.16 1abb n PHE 563 Ca 0.07 0.16 -0.40 0.00 1.01 0.00 0.00 57.45 58.28 1abb n PHE 563 Cb 0.48 -2.29 -0.08 0.00 -0.01 0.00 0.00 39.48 37.59 1abb n PHE 563 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1abb s ASP 564 N 9.50 6.32 -0.01 4.37 2.15 -0.61 -1.17 116.67 137.22 1abb s ASP 564 Ca 1.13 0.15 -0.01 0.00 0.43 0.00 0.00 52.55 54.25 1abb s ASP 564 Cb -0.58 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 39.79 1abb s ASP 564 CO 0.34 -0.36 0.03 0.54 -0.17 0.00 0.00 175.17 175.54 1abb s VAL 565 N 2.28 0.00 -0.13 1.11 0.11 -0.70 -1.82 120.40 121.25 1abb s VAL 565 Ca 0.18 -0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.20 1abb s VAL 565 Cb -0.16 -0.06 0.02 0.00 -1.53 0.00 0.00 36.38 34.65 1abb s VAL 565 CO 0.12 -0.02 -0.12 -1.58 -3.33 0.00 0.00 175.10 170.16 1abb s GLN 566 N -0.05 2.01 -0.39 1.54 0.74 -0.91 -0.51 119.66 122.10 1abb s GLN 566 Ca -0.01 -0.45 0.02 0.00 0.05 0.00 0.00 55.36 54.97 1abb s GLN 566 Cb -0.01 -1.89 0.15 0.00 1.10 0.00 0.00 33.01 32.37 1abb s GLN 566 CO 0.00 -0.22 0.28 0.14 -0.55 0.00 0.00 175.29 174.94 1abb s VAL 567 N 1.48 0.37 0.14 1.34 -7.23 -1.26 -2.05 120.40 113.19 1abb s VAL 567 Ca 0.03 -2.25 0.02 0.00 -1.81 0.00 0.00 61.98 57.98 1abb s VAL 567 Cb -0.13 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.49 1abb s VAL 567 CO -0.08 -1.10 -0.04 -0.54 -0.31 0.00 0.00 175.10 173.03 1abb s LYS 568 N 0.51 0.99 -0.08 4.82 -0.14 -1.14 -5.01 119.74 119.69 1abb s LYS 568 Ca 0.25 -1.44 -0.31 0.00 -1.36 0.00 0.00 55.97 53.11 1abb s LYS 568 Cb -0.11 -0.28 -0.09 0.00 -1.68 0.00 0.00 37.83 35.67 1abb s LYS 568 CO -0.09 -0.06 2.02 -2.13 -0.76 0.00 0.00 175.35 174.33 1abb n ARG 569 N -0.15 2.38 -1.82 1.68 0.63 -1.26 -4.08 116.66 114.04 1abb n ARG 569 Ca -0.09 0.83 -0.21 0.00 -0.92 0.00 0.00 57.85 57.46 1abb n ARG 569 Cb 0.62 -2.92 -0.08 0.00 0.45 0.00 0.00 32.46 30.52 1abb n ARG 569 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1abb s ILE 570 N 5.35 3.26 0.32 5.15 -1.09 -1.26 -4.76 121.20 128.17 1abb s ILE 570 Ca 0.94 -0.39 0.03 0.00 -2.23 0.00 0.00 60.65 59.00 1abb s ILE 570 Cb -0.51 -4.08 -0.06 0.00 -1.58 0.00 0.00 42.46 36.23 1abb s ILE 570 CO 0.44 -0.48 0.06 -2.28 -1.23 0.00 0.00 174.94 171.45 1abb s HIS 571 N 13.88 1.92 0.35 3.97 2.46 -1.26 -4.52 115.29 132.08 1abb s HIS 571 Ca 0.77 -0.99 0.04 0.00 0.47 0.00 0.00 55.06 55.35 1abb s HIS 571 Cb -0.05 -1.24 0.64 0.00 -0.13 0.00 0.00 32.58 31.81 1abb s HIS 571 CO 0.13 -0.04 1.92 0.93 -2.47 0.00 0.00 174.74 175.22 1abb h GLU 572 N 2.14 0.58 -0.00 2.88 5.08 -1.97 -3.04 114.58 120.24 1abb h GLU 572 Ca -0.40 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1abb h GLU 572 Cb 1.25 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1abb h GLU 572 CO 0.68 0.53 -0.10 2.48 -1.00 0.00 0.00 179.01 181.60 1abb n TYR 573 N -4.34 0.00 1.43 4.33 4.11 -1.26 -2.85 117.16 118.58 1abb n TYR 573 Ca 0.02 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.07 1abb n TYR 573 Cb 0.18 -0.29 0.64 0.00 -0.00 0.00 0.00 39.34 39.87 1abb n TYR 573 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 1abb n LYS 574 N -1.23 0.67 -0.58 -3.48 3.00 -1.15 -3.50 118.16 111.89 1abb n LYS 574 Ca 0.12 -0.21 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 1abb n LYS 574 Cb 0.29 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.82 1abb n LYS 574 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1abb n ARG 575 N -0.98 -0.53 0.24 1.64 3.00 -1.13 -4.64 116.66 114.25 1abb n ARG 575 Ca 0.15 0.12 0.00 0.00 -0.01 0.00 0.00 57.85 58.11 1abb n ARG 575 Cb 0.27 -4.37 0.00 0.00 0.00 0.00 0.00 32.46 28.36 1abb n ARG 575 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1abb n GLN 576 N -1.04 0.02 0.00 5.56 0.00 -1.26 0.48 117.38 121.14 1abb n GLN 576 Ca 0.00 0.69 -0.13 0.00 0.00 0.00 0.00 57.00 57.57 1abb n GLN 576 Cb 0.12 -2.32 -0.00 0.00 0.00 0.00 0.00 30.24 28.04 1abb n GLN 576 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1abb h LEU 577 N 0.00 0.71 0.17 2.61 3.38 -1.92 0.12 115.31 120.39 1abb h LEU 577 Ca 0.00 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1abb h LEU 577 Cb 1.68 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.20 1abb h LEU 577 CO 0.00 1.20 -0.31 0.25 0.09 0.00 0.00 178.44 179.67 1abb h LEU 578 N 0.44 -0.88 0.00 1.67 5.85 -0.37 0.27 115.31 122.28 1abb h LEU 578 Ca -0.02 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1abb h LEU 578 Cb 1.27 0.31 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1abb h LEU 578 CO 0.13 -0.36 0.00 -3.20 -0.34 0.00 0.00 178.44 174.68 1abb n ASN 579 N -4.20 0.00 -0.02 1.25 4.05 -1.19 -0.43 115.26 114.72 1abb n ASN 579 Ca -0.06 -0.02 -0.18 0.00 0.45 0.00 0.00 54.58 54.77 1abb n ASN 579 Cb 0.25 -0.09 -0.13 0.00 1.23 0.00 0.00 39.78 41.04 1abb n ASN 579 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1abb h LEU 581 N -0.67 -0.90 -1.77 0.00 3.38 0.22 0.67 115.31 116.24 1abb h LEU 581 Ca -0.15 0.03 0.23 0.00 0.09 0.00 0.00 57.88 58.07 1abb h LEU 581 Cb 1.39 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 42.34 1abb h LEU 581 CO 0.03 -0.64 0.75 -0.74 0.09 0.00 0.00 178.44 177.93 1abb h HIS 582 N -1.09 0.00 0.24 1.13 2.76 -1.31 0.16 115.15 117.04 1abb h HIS 582 Ca -0.11 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 57.74 1abb h HIS 582 Cb 0.82 0.00 0.04 0.00 1.55 0.00 0.00 27.41 29.82 1abb h HIS 582 CO -0.02 0.00 -1.39 0.28 -1.30 0.00 0.00 177.93 175.51 1abb h VAL 583 N 0.00 1.31 -0.61 5.26 2.07 -0.92 -2.89 116.25 120.47 1abb h VAL 583 Ca 0.37 -2.67 -0.07 0.00 0.82 0.00 0.00 66.70 65.15 1abb h VAL 583 Cb 1.86 3.07 -0.03 0.00 -1.52 0.00 0.00 31.29 34.68 1abb h VAL 583 CO -0.00 0.80 0.11 0.40 0.02 0.00 0.00 177.57 178.90 1abb h ILE 584 N 0.07 1.25 0.27 4.57 2.04 -0.03 -1.89 117.51 123.79 1abb h ILE 584 Ca -0.24 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 64.67 1abb h ILE 584 Cb 2.10 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.81 1abb h ILE 584 CO 0.26 0.35 -0.42 0.74 0.00 0.00 0.00 178.15 179.09 1abb h THR 585 N 0.92 0.00 -0.93 -0.27 2.02 -1.23 -0.18 112.91 113.24 1abb h THR 585 Ca 0.19 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.64 1abb h THR 585 Cb 0.38 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 1abb h THR 585 CO 0.01 0.00 0.97 -0.07 0.37 0.00 0.00 175.52 176.79 1abb h LEU 586 N -0.73 0.00 0.24 2.58 4.07 -1.23 0.13 115.31 120.37 1abb h LEU 586 Ca -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 1abb h LEU 586 Cb 0.67 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1abb h LEU 586 CO -0.13 0.00 -0.11 0.22 -1.08 0.00 0.00 178.44 177.34 1abb h TYR 587 N 0.00 -0.29 -0.85 1.13 3.20 -0.67 -2.64 116.97 116.85 1abb h TYR 587 Ca 0.44 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.52 1abb h TYR 587 Cb 2.38 0.10 -0.15 0.00 1.54 0.00 0.00 36.73 40.60 1abb h TYR 587 CO 0.00 -0.18 0.07 -0.91 -1.64 0.00 0.00 178.16 175.50 1abb h ASN 588 N -0.90 -0.29 0.23 -2.11 2.35 0.55 0.68 115.58 116.09 1abb h ASN 588 Ca -0.03 0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 1abb h ASN 588 Cb 0.24 0.36 0.00 0.00 0.05 0.00 0.00 38.32 38.97 1abb h ASN 588 CO 0.05 -0.21 -0.11 0.03 -1.65 0.00 0.00 177.43 175.54 1abb h ARG 589 N 0.11 -0.29 -0.19 0.81 3.08 -0.93 0.13 114.38 117.10 1abb h ARG 589 Ca 0.49 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.62 1abb h ARG 589 Cb 0.94 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 1abb h ARG 589 CO -0.73 0.04 0.24 0.82 -1.07 0.00 0.00 179.97 179.27 1abb h ILE 590 N -0.66 0.39 0.00 2.04 2.04 -0.76 -0.99 117.51 119.57 1abb h ILE 590 Ca -0.03 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.68 1abb h ILE 590 Cb 0.47 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1abb h ILE 590 CO 0.05 0.00 -2.10 0.29 0.00 0.00 0.00 178.15 176.39 1abb n LYS 591 N -3.66 0.67 -0.09 2.37 5.02 0.08 -2.95 118.16 119.60 1abb n LYS 591 Ca 0.02 -0.10 -0.12 0.00 -2.02 0.00 0.00 58.31 56.08 1abb n LYS 591 Cb 0.36 -1.54 -0.04 0.00 -0.02 0.00 0.00 35.03 33.79 1abb n LYS 591 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1abb h LYS 592 N 0.00 0.59 -2.48 1.97 3.64 0.51 -3.36 116.57 117.43 1abb h LYS 592 Ca -0.21 -0.27 -0.69 0.00 -1.27 0.00 0.00 60.65 58.21 1abb h LYS 592 Cb 1.49 -0.01 -0.36 0.00 -0.41 0.00 0.00 32.23 32.94 1abb h LYS 592 CO 0.01 0.85 -0.01 0.39 -2.27 0.00 0.00 179.45 178.42 1abb n GLU 593 N -4.41 3.39 0.00 1.90 1.02 -0.53 -4.98 120.64 117.03 1abb n GLU 593 Ca -0.04 -4.64 0.00 0.00 -0.02 0.00 0.00 57.16 52.47 1abb n GLU 593 Cb 0.38 -2.36 0.00 0.00 -0.02 0.00 0.00 31.44 29.44 1abb n GLU 593 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1abb n PRO 594 N 0.99 0.00 0.00 3.49 -0.02 -1.15 -2.07 135.00 136.23 1abb n PRO 594 Ca 0.29 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1abb n PRO 594 Cb 0.37 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1abb n PRO 594 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1abb n ASN 595 N -1.24 0.72 -4.76 2.55 3.02 -1.26 -4.98 115.26 109.31 1abb n ASN 595 Ca 0.00 -1.20 -0.33 0.00 -0.03 0.00 0.00 54.58 53.02 1abb n ASN 595 Cb 0.02 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.25 1abb n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1abb s LYS 596 N -0.20 2.65 -0.06 3.52 2.36 -0.88 -4.96 119.74 122.17 1abb s LYS 596 Ca 0.00 1.41 -0.22 0.00 -2.55 0.00 0.00 55.97 54.61 1abb s LYS 596 Cb 0.00 -1.93 -0.04 0.00 -1.05 0.00 0.00 37.83 34.81 1abb s LYS 596 CO 0.00 -1.37 0.64 0.12 1.55 0.00 0.00 175.35 176.29 1abb s PHE 597 N -2.35 3.59 -0.08 4.03 5.36 -1.26 -5.02 117.98 122.24 1abb s PHE 597 Ca 0.67 1.18 0.02 0.00 -0.96 0.00 0.00 56.93 57.84 1abb s PHE 597 Cb -0.21 -2.73 0.01 0.00 -0.34 0.00 0.00 43.02 39.75 1abb s PHE 597 CO 0.43 0.15 -0.14 0.54 -1.46 0.00 0.00 175.22 174.74 1abb s VAL 598 N 0.59 1.31 0.00 3.12 0.11 -1.26 -5.08 120.40 119.19 1abb s VAL 598 Ca 0.34 -0.57 -0.30 0.00 -2.93 0.00 0.00 61.98 58.52 1abb s VAL 598 Cb -0.17 -1.19 -0.07 0.00 -1.53 0.00 0.00 36.38 33.42 1abb s VAL 598 CO 0.17 0.40 1.69 -0.69 -3.33 0.00 0.00 175.10 173.33 1abb s VAL 599 N 0.68 3.31 0.37 2.04 1.01 -1.26 -4.98 120.40 121.58 1abb s VAL 599 Ca -0.14 0.54 -0.21 0.00 0.00 0.00 0.00 61.98 62.17 1abb s VAL 599 Cb -0.16 -3.35 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 1abb s VAL 599 CO 0.04 -0.03 0.90 -2.16 0.00 0.00 0.00 175.10 173.85 1abb s PRO 600 N 3.55 4.28 0.30 2.72 0.04 -1.26 -4.97 135.00 139.65 1abb s PRO 600 Ca 0.75 1.08 0.06 0.00 0.04 0.00 0.00 61.00 62.94 1abb s PRO 600 Cb -0.37 -2.42 -0.06 0.00 0.04 0.00 0.00 34.50 31.69 1abb s PRO 600 CO 0.32 0.10 -0.03 1.03 0.04 0.00 0.00 177.00 178.46 1abb s ARG 601 N -2.79 1.60 -0.30 4.56 0.52 -1.16 -0.25 118.95 121.14 1abb s ARG 601 Ca 0.57 -1.83 -0.01 0.00 -0.52 0.00 0.00 55.73 53.94 1abb s ARG 601 Cb -0.12 -1.13 0.09 0.00 0.52 0.00 0.00 34.95 34.32 1abb s ARG 601 CO 0.17 -0.01 0.08 0.99 0.02 0.00 0.00 175.30 176.55 1abb s THR 602 N -3.05 0.94 0.01 0.02 2.01 -1.09 -3.14 115.64 111.34 1abb s THR 602 Ca 0.31 -1.35 -0.27 0.00 0.31 0.00 0.00 61.69 60.69 1abb s THR 602 Cb 0.05 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 1abb s THR 602 CO 0.13 -0.60 0.86 -0.69 -0.69 0.00 0.00 174.62 173.63 1abb s VAL 603 N 1.60 4.83 -0.14 3.82 1.01 -0.33 -1.57 120.40 129.62 1abb s VAL 603 Ca 0.08 1.81 -0.00 0.00 0.00 0.00 0.00 61.98 63.87 1abb s VAL 603 Cb -0.17 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.03 1abb s VAL 603 CO -0.22 0.25 -0.10 -0.04 0.00 0.00 0.00 175.10 174.99 1abb s MET 604 N 0.59 1.79 -0.04 2.72 -1.94 -0.75 -0.60 119.30 121.05 1abb s MET 604 Ca 0.45 -0.41 0.03 0.00 -1.71 0.00 0.00 55.69 54.04 1abb s MET 604 Cb -0.20 -1.85 0.01 0.00 2.01 0.00 0.00 34.83 34.80 1abb s MET 604 CO 0.25 -0.29 -0.12 0.42 -0.01 0.00 0.00 175.02 175.27 1abb s ILE 605 N 1.61 1.06 -0.05 2.53 1.01 0.62 -2.14 121.20 125.84 1abb s ILE 605 Ca 0.04 -0.48 -0.13 0.00 0.00 0.00 0.00 60.65 60.08 1abb s ILE 605 Cb -0.13 -0.94 0.02 0.00 0.01 0.00 0.00 42.46 41.42 1abb s ILE 605 CO -0.09 0.32 0.31 -0.83 0.00 0.00 0.00 174.94 174.65 1abb s GLY 606 N 0.34 -0.17 -0.11 6.18 0.00 -0.87 -0.22 107.32 112.46 1abb s GLY 606 Ca -0.07 0.51 -0.33 0.00 0.00 0.00 0.00 44.72 44.83 1abb s GLY 606 CO 0.02 0.34 1.37 -0.32 0.00 0.00 0.00 173.10 174.51 1abb s GLY 607 N -0.78 -0.42 -0.17 0.20 0.00 -1.26 -2.89 107.32 102.00 1abb s GLY 607 Ca -0.09 1.07 -0.01 0.00 0.00 0.00 0.00 44.72 45.70 1abb s GLY 607 CO 0.03 0.26 -0.13 0.54 0.00 0.00 0.00 173.10 173.80 1abb s LYS 608 N -2.18 3.28 0.00 2.90 1.02 -1.26 -4.65 119.74 118.85 1abb s LYS 608 Ca 0.14 -0.71 0.00 0.00 0.02 0.00 0.00 55.97 55.42 1abb s LYS 608 Cb 0.05 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.65 1abb s LYS 608 CO -0.05 -0.01 0.18 0.00 -0.92 0.00 0.00 175.35 174.55 1abb n ALA 609 N 4.15 0.00 0.00 5.17 0.00 -1.26 -3.98 120.51 124.59 1abb n ALA 609 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1abb n ALA 609 Cb 0.52 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1abb n ALA 609 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1abb n ALA 610 N -2.22 0.00 -1.76 0.00 0.00 -1.26 -4.59 120.51 110.67 1abb n ALA 610 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1abb n ALA 610 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1abb n ALA 610 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1abb s PRO 611 N -2.98 4.42 0.00 0.00 0.02 -1.26 -2.26 135.00 132.95 1abb s PRO 611 Ca 0.00 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1abb s PRO 611 Cb 0.00 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.52 1abb s PRO 611 CO 0.00 0.00 0.00 0.41 -0.33 0.00 0.00 177.00 177.08 1abb n GLY 612 N 0.92 2.91 3.55 0.52 0.00 -1.26 -4.96 105.19 106.86 1abb n GLY 612 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1abb n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1abb s TYR 613 N -2.15 2.97 0.30 1.61 5.04 -0.96 -4.93 117.35 119.24 1abb s TYR 613 Ca 0.00 0.21 0.07 0.00 -2.44 0.00 0.00 57.07 54.91 1abb s TYR 613 Cb 0.00 -3.74 0.47 0.00 0.35 0.00 0.00 41.96 39.04 1abb s TYR 613 CO 0.00 -1.02 1.71 1.25 -1.34 0.00 0.00 175.55 176.15 1abb h HIS 614 N 9.01 0.26 0.30 4.97 -0.00 -1.94 -2.78 115.15 124.97 1abb h HIS 614 Ca -0.25 -0.07 -0.01 0.00 -0.00 0.00 0.00 60.37 60.04 1abb h HIS 614 Cb 1.08 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.44 1abb h HIS 614 CO 0.82 0.60 -0.14 1.98 -0.00 0.00 0.00 177.93 181.18 1abb h MET 615 N 0.19 -0.39 -0.86 5.26 -1.53 -1.98 -1.78 114.93 113.84 1abb h MET 615 Ca 0.02 0.03 0.19 0.00 -3.44 0.00 0.00 59.70 56.49 1abb h MET 615 Cb 0.81 0.09 -0.16 0.00 -0.55 0.00 0.00 31.60 31.79 1abb h MET 615 CO 0.06 -0.05 -0.14 0.00 0.14 0.00 0.00 176.91 176.92 1abb h ALA 616 N -0.39 0.69 -0.70 0.39 0.00 -1.79 0.41 119.26 117.87 1abb h ALA 616 Ca -0.04 0.32 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1abb h ALA 616 Cb 0.52 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 1abb h ALA 616 CO 0.07 -0.43 0.46 0.87 0.00 0.00 0.00 179.25 180.23 1abb h LYS 617 N 0.02 0.91 0.23 0.00 1.57 -1.25 -2.69 116.57 115.37 1abb h LYS 617 Ca 0.44 -0.05 -0.33 0.00 -1.87 0.00 0.00 60.65 58.83 1abb h LYS 617 Cb 0.73 -0.21 0.03 0.00 0.08 0.00 0.00 32.23 32.87 1abb h LYS 617 CO -0.85 0.60 -1.46 0.52 -0.57 0.00 0.00 179.45 177.69 1abb h MET 618 N 0.94 0.49 -0.76 3.15 2.86 0.66 -3.16 114.93 119.11 1abb h MET 618 Ca 0.26 -0.85 0.14 0.00 -2.06 0.00 0.00 59.70 57.20 1abb h MET 618 Cb -0.09 0.31 -0.14 0.00 0.06 0.00 0.00 31.60 31.75 1abb h MET 618 CO -0.06 1.40 -0.26 0.82 1.06 0.00 0.00 176.91 179.88 1abb h ILE 619 N 0.13 0.18 -0.14 -1.22 2.04 -0.96 0.57 117.51 118.11 1abb h ILE 619 Ca -0.24 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 1abb h ILE 619 Cb 2.14 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1abb h ILE 619 CO 0.26 0.00 -0.09 0.40 0.00 0.00 0.00 178.15 178.72 1abb h ILE 620 N -0.05 1.15 0.00 -0.67 2.04 -1.57 -1.53 117.51 116.88 1abb h ILE 620 Ca 0.33 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1abb h ILE 620 Cb 0.57 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1abb h ILE 620 CO -0.80 0.20 -0.27 0.50 0.00 0.00 0.00 178.15 177.79 1abb h LYS 621 N 0.21 0.00 0.36 2.37 1.63 0.10 -0.99 116.57 120.24 1abb h LYS 621 Ca 0.05 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 1abb h LYS 621 Cb 0.30 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 1abb h LYS 621 CO 0.02 0.27 -0.17 1.25 -3.45 0.00 0.00 179.45 177.36 1abb h LEU 622 N 0.00 -0.41 -1.28 5.20 6.46 -0.46 -1.99 115.31 122.84 1abb h LEU 622 Ca -0.00 0.01 0.20 0.00 -0.12 0.00 0.00 57.88 57.97 1abb h LEU 622 Cb 0.53 0.11 -0.09 0.00 -0.73 0.00 0.00 40.66 40.48 1abb h LEU 622 CO 0.03 -0.18 0.62 0.40 -0.62 0.00 0.00 178.44 178.68 1abb h ILE 623 N -0.69 0.68 -0.05 4.05 2.04 -1.20 0.10 117.51 122.45 1abb h ILE 623 Ca -0.05 -0.19 -0.18 0.00 1.00 0.00 0.00 64.86 65.44 1abb h ILE 623 Cb 0.37 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1abb h ILE 623 CO 0.08 0.10 -0.75 0.71 0.00 0.00 0.00 178.15 178.29 1abb h THR 624 N 0.57 1.42 0.12 -0.27 1.35 -1.22 -3.09 112.91 111.78 1abb h THR 624 Ca 0.53 -2.26 -0.28 0.00 -0.55 0.00 0.00 66.41 63.85 1abb h THR 624 Cb 1.08 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.71 1abb h THR 624 CO -0.27 0.67 -1.32 0.00 -0.25 0.00 0.00 175.52 174.34 1abb h ALA 625 N 1.00 0.15 -0.20 6.62 0.00 -0.07 -3.01 119.26 123.76 1abb h ALA 625 Ca -0.03 -0.95 0.05 0.00 0.00 0.00 0.00 54.91 53.98 1abb h ALA 625 Cb 1.33 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 19.13 1abb h ALA 625 CO 0.12 1.03 -0.38 0.82 0.00 0.00 0.00 179.25 180.84 1abb h ILE 626 N 0.07 0.20 -0.43 0.00 2.04 -1.16 0.35 117.51 118.57 1abb h ILE 626 Ca -0.16 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.81 1abb h ILE 626 Cb 1.98 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.24 1abb h ILE 626 CO 0.19 0.00 0.31 1.23 0.00 0.00 0.00 178.15 179.88 1abb h GLY 627 N -0.41 0.05 1.35 5.37 0.00 -1.60 -0.80 103.07 107.02 1abb h GLY 627 Ca 0.10 -0.01 -0.05 0.00 0.00 0.00 0.00 47.33 47.37 1abb h GLY 627 CO -0.42 0.01 0.15 -0.55 0.00 0.00 0.00 176.54 175.73 1abb h ASP 628 N 0.03 0.77 0.03 0.19 3.32 -0.17 -1.94 116.42 118.65 1abb h ASP 628 Ca 0.20 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1abb h ASP 628 Cb 0.77 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1abb h ASP 628 CO -0.01 0.74 -0.01 0.58 -1.72 0.00 0.00 179.24 178.81 1abb h VAL 629 N 0.80 0.00 -0.81 -1.35 2.07 -0.98 -3.23 116.25 112.75 1abb h VAL 629 Ca 0.18 -0.44 0.17 0.00 0.82 0.00 0.00 66.70 67.43 1abb h VAL 629 Cb 0.26 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 1abb h VAL 629 CO -0.01 0.00 0.54 -0.37 0.02 0.00 0.00 177.57 177.75 1abb h VAL 630 N -0.47 0.76 -0.01 2.57 -1.51 -1.20 0.25 116.25 116.63 1abb h VAL 630 Ca -0.00 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.32 1abb h VAL 630 Cb 0.03 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 29.49 1abb h VAL 630 CO 0.01 0.08 -0.17 0.59 -1.23 0.00 0.00 177.57 176.85 1abb n ASN 631 N -4.49 1.43 -0.03 4.19 3.02 -0.73 -3.59 115.26 115.06 1abb n ASN 631 Ca 0.16 -1.25 0.01 0.00 -0.03 0.00 0.00 54.58 53.47 1abb n ASN 631 Cb 0.59 0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.87 1abb n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1abb n HIS 632 N -0.15 0.00 -2.61 3.10 8.25 0.67 -4.99 115.22 119.49 1abb n HIS 632 Ca 0.14 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.17 1abb n HIS 632 Cb 0.38 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.47 1abb n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1abb s ASP 633 N -0.38 6.69 0.42 0.41 2.15 0.05 -4.89 116.67 121.12 1abb s ASP 633 Ca 0.01 0.58 0.29 0.00 0.43 0.00 0.00 52.55 53.86 1abb s ASP 633 Cb 0.01 -2.55 1.36 0.00 -0.30 0.00 0.00 42.92 41.45 1abb s ASP 633 CO 0.02 -1.17 1.88 -0.65 -0.17 0.00 0.00 175.17 175.08 1abb h PRO 634 N 8.99 0.00 0.25 4.34 0.11 -1.91 -0.91 132.00 142.87 1abb h PRO 634 Ca -0.22 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.87 1abb h PRO 634 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1abb h PRO 634 CO 1.11 0.00 -0.12 0.28 -0.21 0.00 0.00 178.00 179.06 1abb h VAL 635 N 0.00 0.81 -1.14 3.15 2.07 -1.95 -2.97 116.25 116.22 1abb h VAL 635 Ca 0.00 -0.55 0.32 0.00 0.82 0.00 0.00 66.70 67.29 1abb h VAL 635 Cb 0.27 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1abb h VAL 635 CO 0.00 0.12 0.80 0.58 0.02 0.00 0.00 177.57 179.09 1abb h VAL 636 N -0.62 0.43 0.00 2.57 2.07 -1.47 -3.45 116.25 115.78 1abb h VAL 636 Ca -0.03 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1abb h VAL 636 Cb 0.45 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1abb h VAL 636 CO 0.06 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.27 1abb n GLY 637 N -1.69 1.19 1.65 2.17 0.00 -1.12 -0.95 105.19 106.44 1abb n GLY 637 Ca 0.25 0.38 -0.01 0.00 0.00 0.00 0.00 46.02 46.65 1abb n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1abb n ASP 638 N 11.13 1.91 0.00 1.61 5.75 -1.26 -4.81 116.55 130.89 1abb n ASP 638 Ca 0.00 -2.76 0.12 0.00 -0.01 0.00 0.00 54.79 52.14 1abb n ASP 638 Cb 0.00 -0.40 0.29 0.00 -1.03 0.00 0.00 41.12 39.97 1abb n ASP 638 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1abb n ARG 639 N -0.34 0.02 -3.85 0.11 1.74 -0.12 -4.78 116.66 109.44 1abb n ARG 639 Ca 0.15 0.01 -0.10 0.00 -0.77 0.00 0.00 57.85 57.14 1abb n ARG 639 Cb 0.93 -1.52 -0.08 0.00 -1.02 0.00 0.00 32.46 30.77 1abb n ARG 639 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1abb s LEU 640 N -3.10 1.39 -0.06 0.55 0.20 -1.26 -2.96 118.68 113.45 1abb s LEU 640 Ca 0.11 -0.44 -0.30 0.00 0.69 0.00 0.00 54.13 54.19 1abb s LEU 640 Cb 0.17 0.96 0.07 0.00 -0.43 0.00 0.00 46.19 46.96 1abb s LEU 640 CO 0.68 -0.60 0.66 -0.13 -0.29 0.00 0.00 176.35 176.67 1abb s ARG 641 N -2.87 1.02 -0.04 1.98 0.52 -1.19 -4.86 118.95 113.52 1abb s ARG 641 Ca -0.03 0.26 0.02 0.00 -0.52 0.00 0.00 55.73 55.46 1abb s ARG 641 Cb 0.00 0.48 0.01 0.00 0.52 0.00 0.00 34.95 35.97 1abb s ARG 641 CO -0.06 -0.31 -0.08 0.08 0.02 0.00 0.00 175.30 174.96 1abb s VAL 642 N -1.13 0.73 -0.01 3.52 1.01 -1.26 -1.18 120.40 122.08 1abb s VAL 642 Ca -0.11 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1abb s VAL 642 Cb -0.01 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.69 1abb s VAL 642 CO 0.09 0.25 -0.02 -0.63 0.00 0.00 0.00 175.10 174.79 1abb s ILE 643 N 0.55 0.22 -0.35 2.22 1.01 0.23 -4.68 121.20 120.39 1abb s ILE 643 Ca -0.09 -0.06 -0.12 0.00 0.00 0.00 0.00 60.65 60.39 1abb s ILE 643 Cb -0.12 -0.23 0.01 0.00 0.01 0.00 0.00 42.46 42.13 1abb s ILE 643 CO 0.01 0.09 0.21 0.12 0.00 0.00 0.00 174.94 175.38 1abb s PHE 644 N 0.29 3.22 -0.10 3.97 5.36 -1.24 -0.27 117.98 129.20 1abb s PHE 644 Ca -0.03 -0.61 -0.29 0.00 -0.96 0.00 0.00 56.93 55.04 1abb s PHE 644 Cb -0.05 -2.45 -0.05 0.00 -0.34 0.00 0.00 43.02 40.13 1abb s PHE 644 CO -0.01 -0.51 1.72 -0.51 -1.46 0.00 0.00 175.22 174.45 1abb s LEU 645 N 1.63 4.16 -0.35 6.12 1.43 0.69 -4.91 118.68 127.45 1abb s LEU 645 Ca 0.04 2.11 -0.28 0.00 -1.03 0.00 0.00 54.13 54.97 1abb s LEU 645 Cb -0.18 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.49 1abb s LEU 645 CO 0.08 -1.10 1.82 -0.70 0.23 0.00 0.00 176.35 176.67 1abb s GLU 646 N 4.42 3.26 -0.31 1.70 2.56 -1.26 -4.31 118.70 124.76 1abb s GLU 646 Ca 0.77 1.37 -0.05 0.00 0.00 0.00 0.00 54.97 57.06 1abb s GLU 646 Cb -0.32 -4.22 0.01 0.00 2.00 0.00 0.00 34.13 31.59 1abb s GLU 646 CO 0.31 -1.95 0.35 -1.71 -0.56 0.00 0.00 175.26 171.70 1abb n ASN 647 N 10.58 -5.19 -4.71 -1.70 5.15 -1.26 -4.90 115.26 113.23 1abb n ASN 647 Ca 0.23 0.14 -0.42 0.00 -0.60 0.00 0.00 54.58 53.93 1abb n ASN 647 Cb 0.47 -3.36 -0.03 0.00 -0.53 0.00 0.00 39.78 36.33 1abb n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1abb s TYR 648 N -2.39 3.24 0.32 1.20 5.04 -1.26 -4.85 117.35 118.64 1abb s TYR 648 Ca 0.07 1.06 -0.10 0.00 -2.44 0.00 0.00 57.07 55.66 1abb s TYR 648 Cb -0.02 -3.58 0.01 0.00 0.35 0.00 0.00 41.96 38.72 1abb s TYR 648 CO 0.41 -1.98 0.55 -0.98 -1.34 0.00 0.00 175.55 172.21 1abb s ARG 649 N 1.34 1.84 0.26 4.97 1.70 -1.26 -4.91 118.95 122.90 1abb s ARG 649 Ca 0.62 -1.48 -0.02 0.00 -0.47 0.00 0.00 55.73 54.38 1abb s ARG 649 Cb -0.33 0.50 0.48 0.00 -0.57 0.00 0.00 34.95 35.02 1abb s ARG 649 CO 0.29 -0.79 1.82 0.28 -1.08 0.00 0.00 175.30 175.82 1abb h VAL 650 N 2.14 0.90 0.00 4.99 2.07 -1.95 0.88 116.25 125.28 1abb h VAL 650 Ca -0.28 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 1abb h VAL 650 Cb 1.25 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1abb h VAL 650 CO 0.37 0.16 -0.14 0.77 0.02 0.00 0.00 177.57 178.75 1abb h SER 651 N 0.87 0.00 0.17 0.57 4.64 -1.96 -0.98 113.55 116.86 1abb h SER 651 Ca 0.45 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.49 1abb h SER 651 Cb 0.44 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1abb h SER 651 CO -0.26 0.14 -1.32 -0.07 -0.87 0.00 0.00 176.83 174.45 1abb h LEU 652 N 0.00 0.57 -0.66 5.97 3.38 -1.26 -3.33 115.31 119.98 1abb h LEU 652 Ca -0.00 -0.91 0.14 0.00 0.09 0.00 0.00 57.88 57.19 1abb h LEU 652 Cb 0.57 -0.18 -0.12 0.00 0.09 0.00 0.00 40.66 41.01 1abb h LEU 652 CO 0.02 1.61 -0.12 0.00 0.09 0.00 0.00 178.44 180.04 1abb h ALA 653 N 0.07 0.49 0.00 1.53 0.00 0.07 0.67 119.26 122.08 1abb h ALA 653 Ca -0.26 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1abb h ALA 653 Cb 1.89 0.47 0.00 0.00 0.00 0.00 0.00 17.79 20.15 1abb h ALA 653 CO 0.16 -0.42 0.00 -0.85 0.00 0.00 0.00 179.25 178.14 1abb n GLU 654 N -5.41 0.47 -0.06 0.00 0.28 -0.48 -1.15 120.64 114.29 1abb n GLU 654 Ca 0.09 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 57.02 1abb n GLU 654 Cb 0.36 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.66 1abb n GLU 654 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1abb n LYS 655 N -1.00 1.21 -0.06 3.44 5.02 0.20 -4.55 118.16 122.41 1abb n LYS 655 Ca 0.11 0.04 -0.03 0.00 -2.02 0.00 0.00 58.31 56.41 1abb n LYS 655 Cb 0.05 -1.25 -0.01 0.00 -0.02 0.00 0.00 35.03 33.80 1abb n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1abb h VAL 656 N 0.00 0.05 -0.99 -0.18 3.04 -0.15 -3.37 116.25 114.66 1abb h VAL 656 Ca -0.27 -1.05 0.29 0.00 -1.01 0.00 0.00 66.70 64.66 1abb h VAL 656 Cb 1.50 0.11 -0.04 0.00 -2.01 0.00 0.00 31.29 30.85 1abb h VAL 656 CO -0.02 0.02 1.15 0.40 -1.01 0.00 0.00 177.57 178.11 1abb h ILE 657 N -1.00 0.04 0.04 3.17 2.04 -1.37 0.42 117.51 120.85 1abb h ILE 657 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 1abb h ILE 657 Cb 0.29 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 1abb h ILE 657 CO -0.00 0.00 -0.02 -0.65 0.00 0.00 0.00 178.15 177.47 1abb h PRO 658 N 0.00 -0.06 0.00 2.37 0.11 -1.76 -3.37 132.00 129.30 1abb h PRO 658 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 1abb h PRO 658 Cb 2.76 0.01 0.00 0.00 0.11 0.00 0.00 31.00 33.89 1abb h PRO 658 CO -0.00 0.58 0.00 0.00 -0.21 0.00 0.00 178.00 178.37 1abb n ALA 659 N -2.53 1.64 -2.50 -0.75 0.00 0.15 -4.86 120.51 111.66 1abb n ALA 659 Ca -0.08 -0.01 -0.24 0.00 0.00 0.00 0.00 53.44 53.11 1abb n ALA 659 Cb 0.33 -1.02 -0.10 0.00 0.00 0.00 0.00 19.45 18.65 1abb n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1abb s ALA 660 N -2.00 2.71 -0.18 0.00 0.00 -1.24 -4.54 121.76 116.52 1abb s ALA 660 Ca 0.02 -2.03 -0.04 0.00 0.00 0.00 0.00 51.96 49.92 1abb s ALA 660 Cb 0.01 0.07 -0.09 0.00 0.00 0.00 0.00 23.12 23.10 1abb s ALA 660 CO 0.02 0.01 -0.19 -0.25 0.00 0.00 0.00 175.76 175.34 1abb n ASP 661 N -0.71 1.96 -4.21 0.00 8.00 -0.32 -4.30 116.55 116.98 1abb n ASP 661 Ca -0.05 0.07 -0.28 0.00 0.71 0.00 0.00 54.79 55.23 1abb n ASP 661 Cb 0.64 -0.41 -0.16 0.00 -0.02 0.00 0.00 41.12 41.17 1abb n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1abb s LEU 662 N -6.50 2.00 -0.25 0.64 0.20 -1.20 0.13 118.68 113.69 1abb s LEU 662 Ca -0.24 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.17 1abb s LEU 662 Cb 0.08 -1.15 0.05 0.00 -0.43 0.00 0.00 46.19 44.73 1abb s LEU 662 CO 0.35 0.21 -0.10 -0.94 -0.29 0.00 0.00 176.35 175.58 1abb s SER 663 N -0.14 4.30 -0.84 3.68 1.04 0.22 -1.73 113.70 120.22 1abb s SER 663 Ca -0.01 -1.21 -0.25 0.00 0.48 0.00 0.00 55.95 54.95 1abb s SER 663 Cb -0.12 -1.57 -0.01 0.00 0.10 0.00 0.00 66.02 64.41 1abb s SER 663 CO 0.02 -0.16 1.76 -1.61 0.98 0.00 0.00 173.24 174.23 1abb s GLU 664 N 1.17 2.84 -0.85 4.02 0.41 0.34 -2.83 118.70 123.81 1abb s GLU 664 Ca -0.05 -0.23 -0.01 0.00 -0.41 0.00 0.00 54.97 54.26 1abb s GLU 664 Cb -0.19 -4.87 0.35 0.00 -1.78 0.00 0.00 34.13 27.65 1abb s GLU 664 CO -0.06 -2.86 1.89 1.04 -0.49 0.00 0.00 175.26 174.78 1abb n GLN 665 N 9.00 3.37 -0.74 1.61 3.00 -0.83 -4.70 117.38 128.09 1abb n GLN 665 Ca 0.30 -3.86 -0.14 0.00 -0.01 0.00 0.00 57.00 53.29 1abb n GLN 665 Cb 0.49 -2.31 0.06 0.00 0.00 0.00 0.00 30.24 28.48 1abb n GLN 665 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 1abb n ILE 666 N -0.43 2.43 -1.44 5.09 -5.35 -1.26 -3.43 119.36 114.97 1abb n ILE 666 Ca 0.51 -1.29 -0.31 0.00 -0.27 0.00 0.00 62.75 61.38 1abb n ILE 666 Cb 0.27 -1.08 0.07 0.00 -1.74 0.00 0.00 39.64 37.16 1abb n ILE 666 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1abb s SER 667 N 0.10 4.94 0.34 7.28 0.01 -1.26 -4.62 113.70 120.48 1abb s SER 667 Ca 0.28 1.74 -0.28 0.00 1.31 0.00 0.00 55.95 59.01 1abb s SER 667 Cb 0.23 -2.51 -0.10 0.00 0.21 0.00 0.00 66.02 63.85 1abb s SER 667 CO 0.02 -1.74 1.27 -0.89 0.41 0.00 0.00 173.24 172.31 1abb s THR 668 N -2.93 2.81 0.23 1.44 2.01 -1.23 -4.68 115.64 113.29 1abb s THR 668 Ca 0.60 0.80 -0.30 0.00 0.31 0.00 0.00 61.69 63.09 1abb s THR 668 Cb -0.16 -3.50 -0.10 0.00 0.01 0.00 0.00 72.50 68.76 1abb s THR 668 CO 0.54 0.17 1.44 0.00 -0.69 0.00 0.00 174.62 176.09 1abb s ALA 669 N -1.18 3.64 0.00 7.40 0.00 -1.26 -1.62 121.76 128.73 1abb s ALA 669 Ca 0.50 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.77 1abb s ALA 669 Cb -0.38 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.18 1abb s ALA 669 CO 0.50 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1abb n GLY 670 N 2.45 0.93 0.11 0.00 0.00 -1.26 -4.73 105.19 102.69 1abb n GLY 670 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 1abb n GLY 670 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1abb h THR 671 N 0.00 1.42 -3.35 2.61 1.35 -1.68 -3.48 112.91 109.79 1abb h THR 671 Ca 0.00 -2.50 -0.56 0.00 -0.55 0.00 0.00 66.41 62.80 1abb h THR 671 Cb 0.00 3.10 -0.05 0.00 -1.73 0.00 0.00 68.15 69.47 1abb h THR 671 CO 0.00 0.70 0.05 -1.61 -0.25 0.00 0.00 175.52 174.41 1abb s GLU 672 N -2.43 4.40 -0.07 4.72 0.41 -1.26 -4.86 118.70 119.62 1abb s GLU 672 Ca -0.15 0.82 -0.19 0.00 -0.41 0.00 0.00 54.97 55.04 1abb s GLU 672 Cb 0.01 -3.41 -0.30 0.00 -1.78 0.00 0.00 34.13 28.66 1abb s GLU 672 CO 0.81 0.18 0.76 0.00 -0.49 0.00 0.00 175.26 176.52 1abb h ALA 673 N 6.33 0.01 -3.00 5.21 0.00 -1.91 -3.16 119.26 122.74 1abb h ALA 673 Ca -0.42 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 53.62 1abb h ALA 673 Cb 1.20 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1abb h ALA 673 CO 0.73 0.57 0.00 0.45 0.00 0.00 0.00 179.25 181.01 1abb n SER 674 N -4.02 2.61 0.00 0.00 2.88 -1.26 -4.27 113.62 109.56 1abb n SER 674 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 1abb n SER 674 Cb 0.87 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.33 1abb n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1abb n GLY 675 N 0.00 -1.77 0.40 0.46 0.00 -1.26 -3.92 105.19 99.09 1abb n GLY 675 Ca 0.00 0.71 0.21 0.00 0.00 0.00 0.00 46.02 46.94 1abb n GLY 675 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1abb h THR 676 N 0.00 0.54 -0.44 2.61 2.02 -1.97 0.43 112.91 116.10 1abb h THR 676 Ca 0.00 -0.15 0.07 0.00 0.77 0.00 0.00 66.41 67.10 1abb h THR 676 Cb 0.00 0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 66.41 1abb h THR 676 CO 0.00 0.08 0.11 1.23 0.37 0.00 0.00 175.52 177.31 1abb h GLY 677 N 0.44 0.54 0.97 2.16 0.00 -1.95 -2.37 103.07 102.86 1abb h GLY 677 Ca 0.60 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 1abb h GLY 677 CO -0.32 -0.03 0.21 3.43 0.00 0.00 0.00 176.54 179.82 1abb h ASN 678 N 0.25 0.47 0.38 0.19 4.21 -1.31 -0.25 115.58 119.51 1abb h ASN 678 Ca 0.21 -0.09 -0.05 0.00 1.21 0.00 0.00 56.30 57.58 1abb h ASN 678 Cb 0.26 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 1abb h ASN 678 CO -0.26 0.42 -0.25 0.24 -1.29 0.00 0.00 177.43 176.28 1abb h MET 679 N 0.48 0.00 -0.06 0.81 2.86 -1.27 -0.77 114.93 116.99 1abb h MET 679 Ca 0.13 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.63 1abb h MET 679 Cb 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1abb h MET 679 CO -0.02 0.25 -0.62 0.87 1.06 0.00 0.00 176.91 178.45 1abb h LYS 680 N 0.00 0.20 -0.14 1.72 1.57 -0.92 -2.92 116.57 116.09 1abb h LYS 680 Ca -0.00 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 1abb h LYS 680 Cb 0.51 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1abb h LYS 680 CO 0.03 0.75 -0.16 0.74 -0.57 0.00 0.00 179.45 180.25 1abb h PHE 681 N 0.15 0.42 0.00 -1.35 0.04 -1.01 -3.09 116.94 112.10 1abb h PHE 681 Ca -0.01 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.63 1abb h PHE 681 Cb 1.12 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 39.19 1abb h PHE 681 CO 0.02 0.76 0.00 -0.12 -0.60 0.00 0.00 178.31 178.37 1abb n MET 682 N -4.55 0.00 -0.32 1.51 1.56 -0.98 -2.05 117.12 112.29 1abb n MET 682 Ca -0.06 0.72 0.33 0.00 -0.27 0.00 0.00 57.70 58.42 1abb n MET 682 Cb 0.37 -1.50 0.50 0.00 2.15 0.00 0.00 33.22 34.74 1abb n MET 682 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1abb n LEU 683 N -2.44 0.00 -1.08 -0.89 4.77 -1.11 -1.37 117.00 114.88 1abb n LEU 683 Ca 0.00 0.78 0.08 0.00 -0.03 0.00 0.00 56.01 56.84 1abb n LEU 683 Cb 0.00 -0.30 0.26 0.00 -2.33 0.00 0.00 43.42 41.05 1abb n LEU 683 CO 0.00 -0.78 0.73 0.59 -1.33 0.00 0.00 177.39 176.59 1abb n ASN 684 N -3.32 3.91 -2.46 -1.43 3.02 -0.87 -4.88 115.26 109.24 1abb n ASN 684 Ca 0.27 -2.46 -0.04 0.00 -0.03 0.00 0.00 54.58 52.33 1abb n ASN 684 Cb 1.59 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 40.31 1abb n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1abb n GLY 685 N 0.47 -1.05 2.89 7.41 0.00 -0.47 -4.89 105.19 109.55 1abb n GLY 685 Ca 0.20 0.63 -0.12 0.00 0.00 0.00 0.00 46.02 46.73 1abb n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb s ALA 686 N -2.39 -0.01 0.34 4.61 0.00 -0.90 -4.72 121.76 118.69 1abb s ALA 686 Ca 0.11 -0.04 -0.21 0.00 0.00 0.00 0.00 51.96 51.82 1abb s ALA 686 Cb -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 23.12 22.99 1abb s ALA 686 CO 0.51 -0.02 0.87 -0.51 0.00 0.00 0.00 175.76 176.61 1abb s LEU 687 N -0.16 4.16 -0.32 0.00 1.43 0.34 -4.20 118.68 119.93 1abb s LEU 687 Ca -0.02 1.61 -0.06 0.00 -1.03 0.00 0.00 54.13 54.63 1abb s LEU 687 Cb -0.01 -4.11 0.03 0.00 0.03 0.00 0.00 46.19 42.13 1abb s LEU 687 CO -0.00 -0.17 0.08 -0.89 0.23 0.00 0.00 176.35 175.60 1abb s THR 688 N -1.85 3.72 -0.19 5.49 2.01 -1.26 0.69 115.64 124.26 1abb s THR 688 Ca 0.53 -1.04 -0.09 0.00 0.31 0.00 0.00 61.69 61.41 1abb s THR 688 Cb -0.14 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 1abb s THR 688 CO 0.19 -0.09 0.10 -0.51 -0.69 0.00 0.00 174.62 173.61 1abb s ILE 689 N 1.41 5.15 0.00 1.82 2.07 -1.13 -2.49 121.20 128.03 1abb s ILE 689 Ca -0.01 0.10 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 1abb s ILE 689 Cb -0.19 -3.33 0.00 0.00 0.13 0.00 0.00 42.46 39.07 1abb s ILE 689 CO 0.02 0.46 0.00 0.61 -1.91 0.00 0.00 174.94 174.12 1abb n GLY 690 N 3.43 3.43 3.28 1.50 0.00 0.20 -1.97 105.19 115.05 1abb n GLY 690 Ca -0.16 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 1abb n GLY 690 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1abb n THR 691 N -1.15 0.00 -3.44 2.61 -2.24 -1.22 -3.33 114.28 105.51 1abb n THR 691 Ca 0.00 -0.18 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 1abb n THR 691 Cb 0.00 -0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 67.24 1abb n THR 691 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1abb n MET 692 N -5.07 2.97 -4.00 -0.78 1.56 -1.26 -4.75 117.12 105.79 1abb n MET 692 Ca 0.09 -4.57 -0.10 0.00 -0.27 0.00 0.00 57.70 52.85 1abb n MET 692 Cb 0.56 -2.37 -0.11 0.00 2.15 0.00 0.00 33.22 33.45 1abb n MET 692 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1abb s ASP 693 N -1.47 0.35 1.97 6.12 2.15 -1.26 -4.71 116.67 119.82 1abb s ASP 693 Ca 0.33 -0.52 0.00 0.00 0.43 0.00 0.00 52.55 52.79 1abb s ASP 693 Cb 0.04 0.09 0.00 0.00 -0.30 0.00 0.00 42.92 42.75 1abb s ASP 693 CO -0.04 -0.29 0.00 0.61 -0.17 0.00 0.00 175.17 175.28 1abb n GLY 694 N 1.54 3.62 0.19 2.66 0.00 -1.19 -1.98 105.19 110.03 1abb n GLY 694 Ca -0.24 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 1abb n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1abb h ALA 695 N -0.97 0.67 -1.10 4.61 0.00 -1.74 -3.14 119.26 117.59 1abb h ALA 695 Ca 0.00 -0.56 0.30 0.00 0.00 0.00 0.00 54.91 54.65 1abb h ALA 695 Cb 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1abb h ALA 695 CO 0.00 0.73 0.75 -0.91 0.00 0.00 0.00 179.25 179.81 1abb h ASN 696 N 0.31 0.24 0.18 0.00 2.35 -1.71 -1.65 115.58 115.30 1abb h ASN 696 Ca -0.01 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 1abb h ASN 696 Cb 1.20 0.01 -0.00 0.00 0.05 0.00 0.00 38.32 39.58 1abb h ASN 696 CO 0.11 0.04 -0.11 0.58 -1.65 0.00 0.00 177.43 176.40 1abb h VAL 697 N 0.20 0.00 0.00 2.81 2.07 -1.62 0.18 116.25 119.89 1abb h VAL 697 Ca 0.58 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 68.04 1abb h VAL 697 Cb 1.85 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1abb h VAL 697 CO -0.17 0.00 -0.26 -0.33 0.02 0.00 0.00 177.57 176.83 1abb h GLU 698 N -0.28 0.00 -0.19 1.57 5.08 -1.62 -0.14 114.58 118.99 1abb h GLU 698 Ca -0.02 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1abb h GLU 698 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1abb h GLU 698 CO 0.02 0.26 -0.46 0.52 -1.00 0.00 0.00 179.01 178.36 1abb h MET 699 N 0.00 0.49 0.38 2.33 2.86 -1.21 -1.28 114.93 118.49 1abb h MET 699 Ca -0.00 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.35 1abb h MET 699 Cb 0.62 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1abb h MET 699 CO 0.03 0.85 -0.18 0.00 1.06 0.00 0.00 176.91 178.67 1abb h ALA 700 N 1.11 -0.51 -0.90 6.32 0.00 0.35 -1.68 119.26 123.95 1abb h ALA 700 Ca 0.02 -0.18 0.15 0.00 0.00 0.00 0.00 54.91 54.91 1abb h ALA 700 Cb 0.96 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1abb h ALA 700 CO 0.08 -0.65 0.50 1.49 0.00 0.00 0.00 179.25 180.67 1abb h GLU 701 N -0.78 0.68 0.00 0.00 4.81 -0.94 1.19 114.58 119.53 1abb h GLU 701 Ca -0.05 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 1abb h GLU 701 Cb 0.53 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1abb h GLU 701 CO 0.09 0.45 -0.24 0.93 -0.73 0.00 0.00 179.01 179.51 1abb h GLU 702 N 0.71 0.00 0.00 1.92 4.39 -1.16 -3.04 114.58 117.39 1abb h GLU 702 Ca 0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.19 1abb h GLU 702 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1abb h GLU 702 CO -0.35 0.22 -1.01 0.00 -1.16 0.00 0.00 179.01 176.72 1abb n ALA 703 N -2.16 2.73 -0.33 3.43 0.00 -0.09 -4.84 120.51 119.24 1abb n ALA 703 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1abb n ALA 703 Cb 0.62 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1abb n ALA 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1abb n GLY 704 N 1.24 -3.40 0.30 0.00 0.00 0.39 -4.45 105.19 99.27 1abb n GLY 704 Ca 0.01 -1.03 0.02 0.00 0.00 0.00 0.00 46.02 45.02 1abb n GLY 704 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1abb h GLU 705 N 0.40 -0.01 -0.23 1.61 4.22 -1.88 -0.29 114.58 118.39 1abb h GLU 705 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 59.36 59.51 1abb h GLU 705 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1abb h GLU 705 CO 0.00 -0.01 0.38 0.93 -2.18 0.00 0.00 179.01 178.14 1abb h GLU 706 N -0.01 0.00 -0.02 1.92 3.07 -1.92 0.25 114.58 117.87 1abb h GLU 706 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1abb h GLU 706 Cb 0.58 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1abb h GLU 706 CO -0.81 0.00 -0.30 0.09 -1.40 0.00 0.00 179.01 176.59 1abb n ASN 707 N -3.39 2.15 -4.60 1.42 3.02 -0.12 -4.95 115.26 108.78 1abb n ASN 707 Ca 0.03 -1.57 -0.29 0.00 -0.03 0.00 0.00 54.58 52.72 1abb n ASN 707 Cb 0.50 0.29 -0.09 0.00 -0.61 0.00 0.00 39.78 39.87 1abb n ASN 707 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1abb s PHE 708 N -2.33 2.76 -1.10 3.10 0.40 0.88 -4.84 117.98 116.85 1abb s PHE 708 Ca 0.23 -0.15 -0.07 0.00 -0.60 0.00 0.00 56.93 56.34 1abb s PHE 708 Cb 0.19 -1.41 0.29 0.00 0.51 0.00 0.00 43.02 42.61 1abb s PHE 708 CO 0.48 0.46 1.27 1.19 0.70 0.00 0.00 175.22 179.33 1abb n PHE 709 N 0.42 4.00 -1.08 0.36 3.72 -1.04 -4.94 117.46 118.90 1abb n PHE 709 Ca -0.12 -3.35 -0.31 0.00 -0.05 0.00 0.00 57.45 53.62 1abb n PHE 709 Cb 0.53 -1.51 0.12 0.00 -0.94 0.00 0.00 39.48 37.68 1abb n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1abb s ILE 710 N -1.94 2.81 0.07 4.37 -1.09 -1.26 -0.63 121.20 123.53 1abb s ILE 710 Ca 0.31 0.27 -0.03 0.00 -2.23 0.00 0.00 60.65 58.97 1abb s ILE 710 Cb -0.04 -2.59 0.01 0.00 -1.58 0.00 0.00 42.46 38.27 1abb s ILE 710 CO -0.00 -0.33 0.18 2.22 -1.23 0.00 0.00 174.94 175.77 1abb n PHE 711 N -3.71 -1.13 -3.57 3.97 -1.74 -1.21 -4.73 117.46 105.34 1abb n PHE 711 Ca 0.10 -0.35 0.01 0.00 -0.56 0.00 0.00 57.45 56.65 1abb n PHE 711 Cb 0.52 0.17 -0.00 0.00 1.52 0.00 0.00 39.48 41.70 1abb n PHE 711 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1abb n GLY 712 N -0.12 -0.76 3.70 4.97 0.00 -1.26 -4.25 105.19 107.46 1abb n GLY 712 Ca -0.01 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 1abb n GLY 712 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1abb n MET 713 N -1.67 2.79 -2.07 1.61 2.81 -1.26 -4.92 117.12 114.41 1abb n MET 713 Ca 0.00 1.01 -0.27 0.00 -1.81 0.00 0.00 57.70 56.63 1abb n MET 713 Cb 0.04 -2.90 0.10 0.00 -0.71 0.00 0.00 33.22 29.75 1abb n MET 713 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1abb s ARG 714 N 2.32 1.86 0.07 0.03 6.06 -1.26 -4.43 118.95 123.61 1abb s ARG 714 Ca 0.80 -0.19 -0.28 0.00 -2.50 0.00 0.00 55.73 53.57 1abb s ARG 714 Cb -0.49 -2.05 -0.17 0.00 0.06 0.00 0.00 34.95 32.30 1abb s ARG 714 CO 0.36 -1.55 1.64 0.28 -2.50 0.00 0.00 175.30 173.53 1abb h VAL 715 N -0.91 0.69 -1.16 7.11 2.07 -1.85 -2.78 116.25 119.42 1abb h VAL 715 Ca -0.45 -0.07 0.33 0.00 0.82 0.00 0.00 66.70 67.33 1abb h VAL 715 Cb 1.31 0.73 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 1abb h VAL 715 CO 0.58 0.02 0.81 -0.08 0.02 0.00 0.00 177.57 178.91 1abb h GLU 716 N -0.48 0.12 -0.25 1.57 4.22 -1.96 0.70 114.58 118.50 1abb h GLU 716 Ca -0.05 -0.01 -0.15 0.00 0.08 0.00 0.00 59.36 59.24 1abb h GLU 716 Cb 0.36 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1abb h GLU 716 CO 0.07 0.08 -0.41 -0.44 -2.18 0.00 0.00 179.01 176.14 1abb h ASP 717 N 0.13 0.80 -0.67 1.04 3.32 -1.89 -2.25 116.42 116.89 1abb h ASP 717 Ca 0.60 -0.52 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 1abb h ASP 717 Cb 2.08 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 41.37 1abb h ASP 717 CO -0.12 1.17 0.13 0.58 -1.72 0.00 0.00 179.24 179.27 1abb h VAL 718 N 0.46 1.26 -0.52 -1.35 2.07 0.66 -0.05 116.25 118.78 1abb h VAL 718 Ca 0.02 -1.02 0.02 0.00 0.82 0.00 0.00 66.70 66.54 1abb h VAL 718 Cb 1.01 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1abb h VAL 718 CO 0.09 0.38 0.34 0.44 0.02 0.00 0.00 177.57 178.85 1abb h ASP 719 N 1.03 0.55 0.07 0.57 3.32 -1.48 -0.98 116.42 119.50 1abb h ASP 719 Ca 0.21 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1abb h ASP 719 Cb 0.42 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1abb h ASP 719 CO 0.01 0.39 -0.03 0.03 -1.72 0.00 0.00 179.24 177.92 1abb h ARG 720 N 0.64 -0.09 0.00 3.56 2.47 -0.75 -2.18 114.38 118.03 1abb h ARG 720 Ca 0.20 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.92 1abb h ARG 720 Cb 0.01 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.35 1abb h ARG 720 CO -0.05 0.39 -0.03 1.25 0.56 0.00 0.00 179.97 182.09 1abb h LEU 721 N -0.61 0.00 0.05 3.04 5.85 -0.58 0.23 115.31 123.28 1abb h LEU 721 Ca -0.01 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.44 1abb h LEU 721 Cb 0.52 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.58 1abb h LEU 721 CO 0.02 0.03 -1.10 0.44 -0.34 0.00 0.00 178.44 177.49 1abb h ASP 722 N 0.00 0.88 -0.73 1.25 3.32 -1.28 0.34 116.42 120.21 1abb h ASP 722 Ca -0.00 -0.77 0.08 0.00 0.02 0.00 0.00 57.03 56.35 1abb h ASP 722 Cb 0.10 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.33 1abb h ASP 722 CO 0.00 1.55 0.48 -0.61 -1.72 0.00 0.00 179.24 178.95 1abb h GLN 723 N 0.32 0.69 0.00 3.56 4.15 0.04 -2.50 115.11 121.38 1abb h GLN 723 Ca -0.15 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1abb h GLN 723 Cb 1.76 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 29.30 1abb h GLN 723 CO 0.21 0.46 -1.69 2.89 -1.93 0.00 0.00 178.83 178.78 1abb n ARG 724 N -4.49 0.50 -0.15 1.69 -4.01 -0.16 -5.06 116.66 104.99 1abb n ARG 724 Ca 0.11 -0.13 0.00 0.00 -1.04 0.00 0.00 57.85 56.79 1abb n ARG 724 Cb 0.27 -1.54 0.00 0.00 -3.04 0.00 0.00 32.46 28.15 1abb n ARG 724 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1abb n GLY 725 N 1.31 0.20 3.59 2.89 0.00 0.11 -4.95 105.19 108.35 1abb n GLY 725 Ca -0.02 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 1abb n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1abb s TYR 726 N 0.00 2.09 -1.06 1.61 5.04 -0.89 -4.91 117.35 119.23 1abb s TYR 726 Ca 0.00 0.63 -0.10 0.00 -2.44 0.00 0.00 57.07 55.16 1abb s TYR 726 Cb 0.00 -4.25 0.27 0.00 0.35 0.00 0.00 41.96 38.33 1abb s TYR 726 CO 0.00 -2.32 1.05 1.21 -1.34 0.00 0.00 175.55 174.15 1abb s ASN 727 N 5.26 7.21 0.14 4.32 3.04 -1.26 -4.92 114.94 128.73 1abb s ASN 727 Ca 0.66 -3.44 -0.07 0.00 0.04 0.00 0.00 52.86 50.04 1abb s ASN 727 Cb -0.15 -2.21 0.19 0.00 -1.54 0.00 0.00 41.25 37.54 1abb s ASN 727 CO 0.30 -0.34 0.84 0.00 -3.04 0.00 0.00 177.10 174.87 1abb n ALA 728 N 2.92 0.02 -0.33 1.71 0.00 -1.26 -1.69 120.51 121.89 1abb n ALA 728 Ca 0.22 0.57 0.23 0.00 0.00 0.00 0.00 53.44 54.46 1abb n ALA 728 Cb 0.41 -0.30 0.44 0.00 0.00 0.00 0.00 19.45 20.00 1abb n ALA 728 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1abb h GLN 729 N 0.00 0.05 -0.55 0.00 5.75 -1.91 -0.26 115.11 118.19 1abb h GLN 729 Ca 0.22 -0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.80 1abb h GLN 729 Cb 0.36 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.83 1abb h GLN 729 CO -0.55 0.04 0.21 1.05 -2.65 0.00 0.00 178.83 176.93 1abb h GLU 730 N 0.06 0.39 -0.46 1.69 4.11 -1.75 0.27 114.58 118.88 1abb h GLU 730 Ca 0.72 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 60.08 1abb h GLU 730 Cb 1.72 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.86 1abb h GLU 730 CO -0.80 0.25 0.10 1.88 0.07 0.00 0.00 179.01 180.51 1abb h TYR 731 N 0.40 0.80 0.00 2.06 0.05 -1.24 0.33 116.97 119.36 1abb h TYR 731 Ca 0.27 -0.10 -0.03 0.00 0.05 0.00 0.00 58.73 58.92 1abb h TYR 731 Cb 0.30 -0.22 -0.00 0.00 1.01 0.00 0.00 36.73 37.81 1abb h TYR 731 CO -0.16 0.73 -0.14 -0.92 -1.05 0.00 0.00 178.16 176.63 1abb h TYR 732 N 0.63 0.00 0.00 4.88 5.03 -0.73 -0.98 116.97 125.79 1abb h TYR 732 Ca 0.14 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.45 1abb h TYR 732 Cb 0.35 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.63 1abb h TYR 732 CO 0.02 0.14 -1.09 -0.25 -1.32 0.00 0.00 178.16 175.66 1abb n ASP 733 N -3.48 0.62 0.00 -2.11 8.00 0.72 -4.21 116.55 116.09 1abb n ASP 733 Ca -0.01 -0.33 -0.01 0.00 0.71 0.00 0.00 54.79 55.15 1abb n ASP 733 Cb 0.30 0.92 -0.00 0.00 -0.02 0.00 0.00 41.12 42.31 1abb n ASP 733 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1abb h ARG 734 N 0.00 -0.05 -6.29 -1.24 3.08 0.39 -3.46 114.38 106.81 1abb h ARG 734 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1abb h ARG 734 Cb 0.70 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 1abb h ARG 734 CO 0.00 -0.03 0.98 0.42 -1.07 0.00 0.00 179.97 180.27 1abb s ILE 735 N -1.50 3.68 0.02 2.04 1.01 -0.45 -4.91 121.20 121.09 1abb s ILE 735 Ca -0.01 0.93 -0.15 0.00 0.00 0.00 0.00 60.65 61.42 1abb s ILE 735 Cb 0.00 -3.60 -0.35 0.00 0.01 0.00 0.00 42.46 38.52 1abb s ILE 735 CO 0.02 -0.05 0.94 -0.65 0.00 0.00 0.00 174.94 175.20 1abb h PRO 736 N 8.75 0.52 -0.31 2.79 0.11 -1.89 -2.92 132.00 139.05 1abb h PRO 736 Ca -0.37 -0.89 -0.12 0.00 0.11 0.00 0.00 66.00 64.73 1abb h PRO 736 Cb 1.17 0.33 -0.01 0.00 0.11 0.00 0.00 31.00 32.60 1abb h PRO 736 CO 0.94 1.43 -0.30 0.93 -0.21 0.00 0.00 178.00 180.79 1abb h GLU 737 N 0.14 0.65 0.30 1.05 3.07 -1.96 -0.56 114.58 117.27 1abb h GLU 737 Ca -0.28 -0.28 -0.00 0.00 -0.50 0.00 0.00 59.36 58.30 1abb h GLU 737 Cb 2.17 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 30.03 1abb h GLU 737 CO 0.26 0.87 -0.48 1.25 -1.40 0.00 0.00 179.01 179.51 1abb h LEU 738 N 0.56 -1.37 -0.92 1.33 5.85 -1.93 -1.63 115.31 117.20 1abb h LEU 738 Ca 0.07 0.13 0.17 0.00 0.84 0.00 0.00 57.88 59.08 1abb h LEU 738 Cb 0.79 0.48 -0.16 0.00 0.37 0.00 0.00 40.66 42.13 1abb h LEU 738 CO 0.06 -0.57 -0.27 0.54 -0.34 0.00 0.00 178.44 177.86 1abb n ARG 739 N -5.24 -0.13 -0.13 1.25 1.74 -1.10 -0.54 116.66 112.52 1abb n ARG 739 Ca -0.10 1.42 -0.06 0.00 -0.77 0.00 0.00 57.85 58.35 1abb n ARG 739 Cb 0.40 -2.12 0.03 0.00 -1.02 0.00 0.00 32.46 29.76 1abb n ARG 739 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1abb h GLN 740 N 0.00 0.34 -0.15 5.56 4.15 -0.29 0.69 115.11 125.41 1abb h GLN 740 Ca 0.40 -0.02 -0.22 0.00 0.77 0.00 0.00 58.65 59.57 1abb h GLN 740 Cb 0.62 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 28.25 1abb h GLN 740 CO -0.93 0.22 -0.77 -0.84 -1.93 0.00 0.00 178.83 174.58 1abb h ILE 741 N 0.35 1.28 -0.41 2.39 3.07 0.08 0.43 117.51 124.70 1abb h ILE 741 Ca 0.18 -1.98 0.07 0.00 1.55 0.00 0.00 64.86 64.68 1abb h ILE 741 Cb 0.14 1.98 -0.06 0.00 -0.27 0.00 0.00 36.82 38.61 1abb h ILE 741 CO -0.17 0.63 0.04 0.40 -1.05 0.00 0.00 178.15 178.00 1abb h ILE 742 N 0.52 0.73 0.00 0.16 1.08 -0.54 0.45 117.51 119.92 1abb h ILE 742 Ca -0.05 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1abb h ILE 742 Cb 1.40 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.71 1abb h ILE 742 CO 0.16 0.03 0.00 -0.33 -0.69 0.00 0.00 178.15 177.32 1abb h GLU 743 N 0.15 0.00 0.04 2.37 4.39 -0.51 0.07 114.58 121.10 1abb h GLU 743 Ca 0.20 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.68 1abb h GLU 743 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1abb h GLU 743 CO -0.30 0.00 -1.02 1.96 -1.16 0.00 0.00 179.01 178.49 1abb h GLN 744 N 0.00 0.13 0.04 2.33 4.20 0.20 -2.96 115.11 119.05 1abb h GLN 744 Ca 0.00 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 1abb h GLN 744 Cb 0.37 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1abb h GLN 744 CO 0.00 1.03 -0.02 -0.07 -0.67 0.00 0.00 178.83 179.10 1abb h LEU 745 N 0.05 -0.04 -1.23 1.46 3.38 0.92 -2.07 115.31 117.78 1abb h LEU 745 Ca -0.05 -0.50 -0.08 0.00 0.09 0.00 0.00 57.88 57.34 1abb h LEU 745 Cb 1.72 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.47 1abb h LEU 745 CO 0.15 0.50 -0.36 0.28 0.09 0.00 0.00 178.44 179.09 1abb h SER 746 N -0.60 0.00 1.27 -0.43 0.02 -1.36 -3.05 113.55 109.41 1abb h SER 746 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1abb h SER 746 Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1abb h SER 746 CO 0.01 0.36 0.00 0.77 -1.14 0.00 0.00 176.83 176.83 1abb h SER 747 N 0.00 0.00 -0.03 3.07 4.64 -1.56 -3.42 113.55 116.25 1abb h SER 747 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1abb h SER 747 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1abb h SER 747 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1abb n GLY 748 N 0.40 1.57 0.17 -0.77 0.00 -1.15 -4.91 105.19 100.50 1abb n GLY 748 Ca 0.02 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1abb n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1abb h PHE 749 N 0.00 0.50 0.00 1.61 3.57 -1.58 -1.56 116.94 119.48 1abb h PHE 749 Ca 0.00 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 1abb h PHE 749 Cb 0.21 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1abb h PHE 749 CO 0.00 0.43 -0.72 0.74 -2.23 0.00 0.00 178.31 176.53 1abb h PHE 750 N 0.43 0.00 -0.63 0.41 0.04 -1.88 -3.40 116.94 111.90 1abb h PHE 750 Ca 0.12 0.00 -0.42 0.00 2.80 0.00 0.00 57.97 60.47 1abb h PHE 750 Cb 0.11 0.00 -0.27 0.00 2.20 0.00 0.00 35.95 38.00 1abb h PHE 750 CO -0.02 0.33 -0.18 -1.13 -0.60 0.00 0.00 178.31 176.71 1abb n SER 751 N -3.02 4.43 -0.30 2.17 3.41 -0.64 -4.92 113.62 114.74 1abb n SER 751 Ca -0.01 -3.78 0.29 0.00 -0.26 0.00 0.00 58.87 55.11 1abb n SER 751 Cb 0.69 -0.59 0.64 0.00 -0.26 0.00 0.00 64.21 64.68 1abb n SER 751 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1abb h PRO 752 N 1.65 0.17 0.03 4.33 0.13 -1.64 0.21 132.00 136.88 1abb h PRO 752 Ca 0.35 -0.01 -0.23 0.00 -0.87 0.00 0.00 66.00 65.24 1abb h PRO 752 Cb 1.44 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1abb h PRO 752 CO 0.77 0.11 -0.99 0.87 -0.23 0.00 0.00 178.00 178.53 1abb h LYS 753 N 0.18 0.34 -2.91 0.86 6.56 -1.91 -3.38 116.57 116.31 1abb h LYS 753 Ca 0.56 -0.40 -0.57 0.00 -1.06 0.00 0.00 60.65 59.17 1abb h LYS 753 Cb 1.84 0.12 -0.40 0.00 -0.57 0.00 0.00 32.23 33.23 1abb h LYS 753 CO -0.14 1.10 -0.79 -0.65 -2.06 0.00 0.00 179.45 176.91 1abb s GLN 754 N -3.13 0.64 0.14 3.15 1.11 0.73 -4.99 119.66 117.31 1abb s GLN 754 Ca -0.05 -1.22 -0.14 0.00 0.01 0.00 0.00 55.36 53.97 1abb s GLN 754 Cb 0.09 -1.61 0.02 0.00 -1.01 0.00 0.00 33.01 30.49 1abb s GLN 754 CO 0.86 -1.11 1.65 -1.35 0.01 0.00 0.00 175.29 175.36 1abb h PRO 755 N 7.52 0.75 0.00 2.91 0.11 -1.72 -1.07 132.00 140.50 1abb h PRO 755 Ca -0.06 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1abb h PRO 755 Cb 0.98 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1abb h PRO 755 CO 0.39 0.73 0.00 -0.40 -0.21 0.00 0.00 178.00 178.51 1abb n ASP 756 N -4.50 0.39 -0.15 -2.05 5.68 -1.26 -3.63 116.55 111.02 1abb n ASP 756 Ca 0.01 0.67 -0.03 0.00 -0.50 0.00 0.00 54.79 54.94 1abb n ASP 756 Cb 0.21 -0.73 0.03 0.00 -1.14 0.00 0.00 41.12 39.50 1abb n ASP 756 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1abb h LEU 757 N 0.00 -0.47 -3.41 -2.12 5.85 -1.53 -1.53 115.31 112.10 1abb h LEU 757 Ca 0.00 0.15 -0.37 0.00 0.84 0.00 0.00 57.88 58.50 1abb h LEU 757 Cb 0.03 0.31 -0.19 0.00 0.37 0.00 0.00 40.66 41.18 1abb h LEU 757 CO 0.00 -0.17 0.47 0.49 -0.34 0.00 0.00 178.44 178.89 1abb n PHE 758 N -5.35 1.95 0.14 1.25 3.72 -1.24 -4.40 117.46 113.54 1abb n PHE 758 Ca 0.04 -1.76 0.00 0.00 -0.05 0.00 0.00 57.45 55.68 1abb n PHE 758 Cb 0.26 -0.87 0.19 0.00 -0.94 0.00 0.00 39.48 38.12 1abb n PHE 758 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1abb h LYS 759 N 1.07 0.00 0.00 -1.08 1.79 -1.56 -0.20 116.57 116.60 1abb h LYS 759 Ca 0.39 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.82 1abb h LYS 759 Cb 1.58 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.23 1abb h LYS 759 CO 0.83 0.58 -0.17 0.38 -1.08 0.00 0.00 179.45 179.99 1abb h ASP 760 N 0.00 0.00 0.28 0.86 3.04 -1.83 -0.94 116.42 117.83 1abb h ASP 760 Ca -0.01 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.77 1abb h ASP 760 Cb 1.10 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.39 1abb h ASP 760 CO 0.08 0.17 -0.13 0.40 -2.04 0.00 0.00 179.24 177.71 1abb h ILE 761 N 0.00 0.63 -0.30 4.15 2.04 -1.73 -1.92 117.51 120.38 1abb h ILE 761 Ca -0.00 -0.80 0.07 0.00 1.00 0.00 0.00 64.86 65.12 1abb h ILE 761 Cb 1.13 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 38.12 1abb h ILE 761 CO 0.02 0.14 -0.21 0.58 0.00 0.00 0.00 178.15 178.68 1abb h VAL 762 N -0.88 0.43 -0.47 1.67 2.07 -1.05 -1.59 116.25 116.42 1abb h VAL 762 Ca -0.04 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1abb h VAL 762 Cb 0.51 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1abb h VAL 762 CO 0.06 0.00 0.12 0.78 0.02 0.00 0.00 177.57 178.55 1abb h ASN 763 N -0.19 0.66 -0.33 0.57 4.21 -1.21 -1.35 115.58 117.93 1abb h ASN 763 Ca 0.16 -0.10 0.07 0.00 1.21 0.00 0.00 56.30 57.63 1abb h ASN 763 Cb 0.43 -0.17 -0.08 0.00 -1.12 0.00 0.00 38.32 37.37 1abb h ASN 763 CO -0.41 0.65 -0.34 -0.03 -1.29 0.00 0.00 177.43 176.01 1abb h MET 764 N 0.69 -0.29 -0.50 0.81 4.05 -0.48 0.19 114.93 119.41 1abb h MET 764 Ca 0.16 0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.58 1abb h MET 764 Cb 0.25 0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.09 1abb h MET 764 CO -0.00 -0.19 0.24 1.25 0.23 0.00 0.00 176.91 178.44 1abb h LEU 765 N -0.30 0.65 -0.38 3.39 5.85 -1.03 0.52 115.31 124.01 1abb h LEU 765 Ca 0.15 -0.13 -0.14 0.00 0.84 0.00 0.00 57.88 58.60 1abb h LEU 765 Cb 0.55 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1abb h LEU 765 CO -0.49 0.59 -0.31 0.24 -0.34 0.00 0.00 178.44 178.13 1abb h MET 766 N 0.66 0.87 0.00 1.25 2.86 -0.85 -3.42 114.93 116.30 1abb h MET 766 Ca 0.17 -0.44 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1abb h MET 766 Cb 0.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1abb h MET 766 CO -0.02 1.08 0.00 0.72 1.06 0.00 0.00 176.91 179.75 1abb n HIS 767 N -4.15 0.00 -2.70 -0.22 8.25 0.62 -4.47 115.22 112.56 1abb n HIS 767 Ca -0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 1abb n HIS 767 Cb 0.50 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.71 1abb n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1abb n HIS 768 N -0.63 -1.63 -2.98 4.41 -0.00 0.18 -5.05 115.22 109.51 1abb n HIS 768 Ca 0.00 -1.37 -0.42 0.00 -0.00 0.00 0.00 57.72 55.93 1abb n HIS 768 Cb 0.01 1.39 -0.05 0.00 -0.00 0.00 0.00 29.99 31.33 1abb n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1abb s ASP 769 N -0.74 6.49 0.00 4.39 -1.08 -0.87 -4.79 116.67 120.08 1abb s ASP 769 Ca 0.22 0.19 0.22 0.00 -0.52 0.00 0.00 52.55 52.67 1abb s ASP 769 Cb 0.28 -2.38 0.96 0.00 -1.46 0.00 0.00 42.92 40.32 1abb s ASP 769 CO -0.14 -0.76 1.71 -1.14 0.52 0.00 0.00 175.17 175.36 1abb n ARG 770 N 6.44 0.03 -0.05 4.34 0.63 -1.26 -3.98 116.66 122.81 1abb n ARG 770 Ca 0.02 0.12 0.06 0.00 -0.92 0.00 0.00 57.85 57.13 1abb n ARG 770 Cb 0.48 -1.50 0.09 0.00 0.45 0.00 0.00 32.46 31.98 1abb n ARG 770 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1abb n PHE 771 N -1.48 0.00 -3.36 -0.14 3.72 -1.26 -5.04 117.46 109.90 1abb n PHE 771 Ca 0.06 -0.80 -0.13 0.00 -0.05 0.00 0.00 57.45 56.53 1abb n PHE 771 Cb 0.25 -0.11 0.02 0.00 -0.94 0.00 0.00 39.48 38.70 1abb n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1abb n LYS 772 N -1.06 -1.47 0.00 -1.08 5.02 -1.26 -4.71 118.16 113.60 1abb n LYS 772 Ca 0.10 1.06 0.00 0.00 -2.02 0.00 0.00 58.31 57.45 1abb n LYS 772 Cb 0.49 -4.74 0.00 0.00 -0.02 0.00 0.00 35.03 30.77 1abb n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1abb n VAL 773 N -2.60 0.00 -0.24 -0.18 0.31 -1.26 -3.04 118.33 111.31 1abb n VAL 773 Ca -0.09 0.82 0.14 0.00 -0.01 0.00 0.00 64.34 65.20 1abb n VAL 773 Cb 0.57 -1.68 0.27 0.00 -0.91 0.00 0.00 33.84 32.10 1abb n VAL 773 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1abb n PHE 774 N -1.61 0.57 0.08 3.52 3.72 -1.26 0.11 117.46 122.59 1abb n PHE 774 Ca 0.00 0.86 -0.14 0.00 -0.05 0.00 0.00 57.45 58.12 1abb n PHE 774 Cb 0.00 -1.11 -0.09 0.00 -0.94 0.00 0.00 39.48 37.34 1abb n PHE 774 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1abb h ALA 775 N 1.44 -0.92 0.00 4.37 0.00 -1.95 -1.56 119.26 120.64 1abb h ALA 775 Ca 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1abb h ALA 775 Cb 1.11 0.86 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1abb h ALA 775 CO -0.64 -1.05 0.00 -0.25 0.00 0.00 0.00 179.25 177.31 1abb n ASP 776 N -5.05 0.00 -0.15 0.00 8.00 0.30 -4.22 116.55 115.44 1abb n ASP 776 Ca -0.07 -0.73 -0.08 0.00 0.71 0.00 0.00 54.79 54.62 1abb n ASP 776 Cb 0.35 -0.03 0.01 0.00 -0.02 0.00 0.00 41.12 41.42 1abb n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1abb h TYR 777 N 0.00 0.64 0.62 1.24 3.20 -1.07 0.93 116.97 122.53 1abb h TYR 777 Ca 0.00 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1abb h TYR 777 Cb 0.03 -0.20 0.01 0.00 1.54 0.00 0.00 36.73 38.10 1abb h TYR 777 CO 0.00 0.49 -0.30 1.49 -1.64 0.00 0.00 178.16 178.20 1abb h GLU 778 N 0.59 -0.80 -0.35 1.82 4.57 -1.73 -1.91 114.58 116.76 1abb h GLU 778 Ca 0.16 0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.43 1abb h GLU 778 Cb 0.08 0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.81 1abb h GLU 778 CO -0.02 -0.53 0.13 1.49 -1.18 0.00 0.00 179.01 178.89 1abb h GLU 779 N -1.11 0.27 -0.30 1.92 4.81 -1.81 -2.83 114.58 115.53 1abb h GLU 779 Ca -0.08 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1abb h GLU 779 Cb 0.64 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.90 1abb h GLU 779 CO 0.14 0.18 -0.39 -0.92 -0.73 0.00 0.00 179.01 177.29 1abb h TYR 780 N 0.28 -1.20 0.00 0.92 3.20 -0.87 -1.85 116.97 117.46 1abb h TYR 780 Ca 0.16 0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1abb h TYR 780 Cb 0.13 0.56 0.00 0.00 1.54 0.00 0.00 36.73 38.96 1abb h TYR 780 CO -0.14 -0.34 0.00 -0.39 -1.64 0.00 0.00 178.16 175.65 1abb h VAL 781 N -0.27 0.00 0.05 1.81 -1.51 -1.10 0.13 116.25 115.37 1abb h VAL 781 Ca 0.05 -0.22 -0.00 0.00 -1.23 0.00 0.00 66.70 65.30 1abb h VAL 781 Cb 0.41 1.13 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1abb h VAL 781 CO -0.42 0.00 -0.03 0.11 -1.23 0.00 0.00 177.57 176.00 1abb h LYS 782 N 0.00 -0.07 -0.71 5.19 1.79 -1.26 -2.49 116.57 119.02 1abb h LYS 782 Ca 0.00 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.57 1abb h LYS 782 Cb 0.23 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.85 1abb h LYS 782 CO 0.00 0.25 0.47 0.00 -1.08 0.00 0.00 179.45 179.08 1abb h GLN 784 N 0.61 0.00 0.19 0.00 1.08 -1.06 0.60 115.11 116.53 1abb h GLN 784 Ca 0.32 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.24 1abb h GLN 784 Cb 0.46 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.92 1abb h GLN 784 CO -0.11 0.11 -1.23 0.93 -0.95 0.00 0.00 178.83 177.58 1abb h GLU 785 N 0.00 0.49 -0.53 1.46 3.07 -0.71 -1.34 114.58 117.02 1abb h GLU 785 Ca -0.00 -0.79 -0.01 0.00 -0.50 0.00 0.00 59.36 58.06 1abb h GLU 785 Cb 0.31 0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.48 1abb h GLU 785 CO 0.01 1.37 0.28 0.00 -1.40 0.00 0.00 179.01 179.27 1abb h ARG 786 N 0.02 0.75 0.00 2.33 3.08 -0.94 -2.81 114.38 116.81 1abb h ARG 786 Ca -0.21 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1abb h ARG 786 Cb 1.95 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.86 1abb h ARG 786 CO 0.23 0.60 0.00 0.28 -1.07 0.00 0.00 179.97 180.01 1abb n VAL 787 N -4.61 0.00 -0.35 2.04 0.31 0.17 -1.80 118.33 114.10 1abb n VAL 787 Ca 0.03 1.28 0.25 0.00 -0.01 0.00 0.00 64.34 65.88 1abb n VAL 787 Cb 0.10 -2.01 0.49 0.00 -0.91 0.00 0.00 33.84 31.51 1abb n VAL 787 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1abb h SER 788 N 0.00 0.49 0.03 4.52 0.02 -1.25 0.15 113.55 117.52 1abb h SER 788 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1abb h SER 788 Cb 0.00 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1abb h SER 788 CO 0.00 -0.11 -0.08 0.00 -1.14 0.00 0.00 176.83 175.50 1abb h ALA 789 N 1.80 -0.66 -0.78 3.77 0.00 -1.46 -1.64 119.26 120.29 1abb h ALA 789 Ca 0.73 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.64 1abb h ALA 789 Cb 1.73 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 19.96 1abb h ALA 789 CO -0.55 -0.68 0.50 1.25 0.00 0.00 0.00 179.25 179.77 1abb h LEU 790 N -0.12 0.83 -0.79 0.00 5.85 0.08 -2.75 115.31 118.42 1abb h LEU 790 Ca -0.00 -0.01 0.16 0.00 0.84 0.00 0.00 57.88 58.87 1abb h LEU 790 Cb 0.12 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 40.86 1abb h LEU 790 CO -0.04 0.58 0.32 0.22 -0.34 0.00 0.00 178.44 179.18 1abb h TYR 791 N 0.98 0.54 0.00 1.25 3.20 -0.86 -2.18 116.97 119.90 1abb h TYR 791 Ca 0.31 0.04 -0.34 0.00 3.14 0.00 0.00 58.73 61.87 1abb h TYR 791 Cb -0.02 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.14 1abb h TYR 791 CO -0.03 0.04 2.16 1.17 -1.64 0.00 0.00 178.16 179.87 1abb n LYS 792 N -5.01 2.02 0.00 1.82 4.81 -0.66 -3.34 118.16 117.80 1abb n LYS 792 Ca 0.16 -1.33 0.00 0.00 -0.87 0.00 0.00 58.31 56.27 1abb n LYS 792 Cb 0.46 -2.34 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1abb n LYS 792 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1abb n ASN 793 N 3.86 0.00 0.05 3.14 2.85 -0.82 -4.96 115.26 119.38 1abb n ASN 793 Ca 0.43 0.00 0.22 0.00 -0.11 0.00 0.00 54.58 55.11 1abb n ASN 793 Cb 0.22 0.00 0.71 0.00 1.24 0.00 0.00 39.78 41.95 1abb n ASN 793 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1abb h PRO 794 N 0.00 0.00 0.55 1.20 0.11 -1.79 -2.02 132.00 130.05 1abb h PRO 794 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1abb h PRO 794 Cb 0.00 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.12 1abb h PRO 794 CO 0.00 0.00 -0.26 -0.09 -0.21 0.00 0.00 178.00 177.44 1abb h ARG 795 N 0.00 -0.71 0.00 1.05 2.43 -1.94 -1.59 114.38 113.61 1abb h ARG 795 Ca 0.24 0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 1abb h ARG 795 Cb 1.34 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 31.05 1abb h ARG 795 CO -0.00 -0.48 -0.24 0.93 -1.51 0.00 0.00 179.97 178.67 1abb h GLU 796 N -1.13 0.00 0.25 0.20 4.39 -1.76 -0.01 114.58 116.52 1abb h GLU 796 Ca -0.08 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 1abb h GLU 796 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1abb h GLU 796 CO 0.12 0.24 -0.12 2.35 -1.16 0.00 0.00 179.01 180.45 1abb h TRP 797 N 0.00 -0.31 -0.62 4.33 7.01 -1.46 -1.13 115.95 123.77 1abb h TRP 797 Ca -0.00 -0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.17 1abb h TRP 797 Cb 0.49 0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.63 1abb h TRP 797 CO 0.00 0.06 0.71 1.15 -2.79 0.00 0.00 178.44 177.58 1abb h THR 798 N -0.85 0.23 0.01 2.65 2.02 -0.80 0.02 112.91 116.18 1abb h THR 798 Ca -0.03 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.89 1abb h THR 798 Cb 0.51 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 1abb h THR 798 CO 0.06 0.00 -1.38 0.03 0.37 0.00 0.00 175.52 174.59 1abb h ARG 799 N 0.00 0.03 -0.27 6.66 3.08 0.15 -2.24 114.38 121.80 1abb h ARG 799 Ca 0.30 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 60.11 1abb h ARG 799 Cb 1.71 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.78 1abb h ARG 799 CO -0.00 0.78 -0.58 1.98 -1.07 0.00 0.00 179.97 181.07 1abb h MET 800 N 0.01 0.87 -0.80 0.04 4.05 0.01 -2.47 114.93 116.63 1abb h MET 800 Ca -0.16 -0.57 0.19 0.00 -0.28 0.00 0.00 59.70 58.87 1abb h MET 800 Cb 1.91 0.08 -0.12 0.00 -0.80 0.00 0.00 31.60 32.67 1abb h MET 800 CO 0.11 1.21 0.24 0.28 0.23 0.00 0.00 176.91 178.98 1abb h VAL 801 N 0.65 0.48 0.00 -5.77 2.07 -1.24 -1.41 116.25 111.01 1abb h VAL 801 Ca 0.00 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 1abb h VAL 801 Cb 1.20 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1abb h VAL 801 CO 0.13 0.05 -0.26 0.40 0.02 0.00 0.00 177.57 177.92 1abb h ILE 802 N 0.30 0.61 0.00 4.57 2.04 -1.11 -2.19 117.51 121.73 1abb h ILE 802 Ca 0.47 -1.22 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1abb h ILE 802 Cb 0.85 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1abb h ILE 802 CO -0.54 0.25 -0.46 0.54 0.00 0.00 0.00 178.15 177.95 1abb n ARG 803 N -3.41 0.01 -0.05 2.37 1.74 -0.58 -1.90 116.66 114.84 1abb n ARG 803 Ca 0.00 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 1abb n ARG 803 Cb 0.45 -1.51 -0.03 0.00 -1.02 0.00 0.00 32.46 30.36 1abb n ARG 803 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1abb h ASN 804 N 0.00 -0.01 -0.52 0.55 2.35 -1.16 -3.28 115.58 113.52 1abb h ASN 804 Ca 0.00 -0.23 0.10 0.00 -0.55 0.00 0.00 56.30 55.62 1abb h ASN 804 Cb 0.51 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.78 1abb h ASN 804 CO 0.00 0.60 -0.13 0.40 -1.65 0.00 0.00 177.43 176.66 1abb h ILE 805 N -1.00 0.48 0.00 2.81 2.04 -1.47 -0.61 117.51 119.75 1abb h ILE 805 Ca -0.00 -0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1abb h ILE 805 Cb 0.24 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1abb h ILE 805 CO 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 178.15 178.15 1abb h ALA 806 N 1.52 1.28 -0.01 1.87 0.00 -1.55 -2.48 119.26 119.89 1abb h ALA 806 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1abb h ALA 806 Cb 0.38 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1abb h ALA 806 CO -0.53 0.01 -0.40 2.41 0.00 0.00 0.00 179.25 180.74 1abb n THR 807 N -3.50 0.00 -0.32 0.00 -1.04 -0.26 -2.10 114.28 107.06 1abb n THR 807 Ca -0.03 -0.25 0.30 0.00 -2.04 0.00 0.00 64.05 62.03 1abb n THR 807 Cb 0.09 1.09 0.56 0.00 -1.82 0.00 0.00 70.33 70.24 1abb n THR 807 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1abb h SER 808 N 2.35 0.37 -0.67 8.00 0.02 -1.19 -3.34 113.55 119.09 1abb h SER 808 Ca 0.00 0.24 0.08 0.00 -0.84 0.00 0.00 61.79 61.27 1abb h SER 808 Cb 0.72 0.23 -0.09 0.00 0.14 0.00 0.00 62.40 63.40 1abb h SER 808 CO 0.00 -0.35 -0.35 0.61 -1.14 0.00 0.00 176.83 175.60 1abb n GLY 809 N -1.27 -1.61 0.33 -3.77 0.00 -1.24 -0.94 105.19 96.69 1abb n GLY 809 Ca 0.36 0.78 0.14 0.00 0.00 0.00 0.00 46.02 47.31 1abb n GLY 809 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1abb h LYS 810 N 0.00 0.00 -1.13 1.61 3.11 -1.90 -2.65 116.57 115.61 1abb h LYS 810 Ca 0.15 0.00 -0.58 0.00 -2.81 0.00 0.00 60.65 57.42 1abb h LYS 810 Cb 0.32 0.00 -0.25 0.00 -1.00 0.00 0.00 32.23 31.30 1abb h LYS 810 CO -0.64 0.00 0.75 1.19 -2.81 0.00 0.00 179.45 177.93 1abb n PHE 811 N -2.85 2.79 -4.23 1.91 3.72 -0.11 -4.81 117.46 113.87 1abb n PHE 811 Ca -0.02 -2.69 -0.34 0.00 -0.05 0.00 0.00 57.45 54.35 1abb n PHE 811 Cb 0.41 -1.30 -0.12 0.00 -0.94 0.00 0.00 39.48 37.54 1abb n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1abb s SER 812 N -1.28 4.95 0.00 4.37 0.15 -1.00 -2.84 113.70 118.04 1abb s SER 812 Ca 0.56 -0.12 0.16 0.00 0.70 0.00 0.00 55.95 57.25 1abb s SER 812 Cb 0.44 -1.83 0.73 0.00 -1.71 0.00 0.00 66.02 63.66 1abb s SER 812 CO -0.00 0.14 1.47 -1.54 1.20 0.00 0.00 173.24 174.50 1abb n SER 813 N 3.76 0.00 0.18 5.45 3.41 0.15 0.26 113.62 126.84 1abb n SER 813 Ca -0.17 0.26 0.05 0.00 -0.26 0.00 0.00 58.87 58.75 1abb n SER 813 Cb 0.52 -0.38 0.28 0.00 -0.26 0.00 0.00 64.21 64.37 1abb n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1abb h ASP 814 N 0.00 0.00 0.10 4.04 3.32 -1.91 -0.93 116.42 121.03 1abb h ASP 814 Ca 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1abb h ASP 814 Cb 0.20 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.77 1abb h ASP 814 CO 0.00 0.39 -0.63 -0.09 -1.72 0.00 0.00 179.24 177.19 1abb h ARG 815 N 0.00 0.26 -0.76 3.56 1.12 -0.54 -1.96 114.38 116.06 1abb h ARG 815 Ca -0.00 -0.41 -0.03 0.00 -1.11 0.00 0.00 59.98 58.43 1abb h ARG 815 Cb 1.00 0.15 -0.03 0.00 -0.01 0.00 0.00 29.97 31.07 1abb h ARG 815 CO 0.05 1.17 0.34 1.15 -3.11 0.00 0.00 179.97 179.57 1abb h THR 816 N -0.45 1.24 -0.59 0.20 2.02 -1.41 -2.34 112.91 111.60 1abb h THR 816 Ca -0.11 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 1abb h THR 816 Cb 1.47 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1abb h THR 816 CO 0.12 0.30 0.17 0.40 0.37 0.00 0.00 175.52 176.87 1abb h ILE 817 N 1.09 1.24 0.00 3.11 1.08 -1.17 -2.85 117.51 120.02 1abb h ILE 817 Ca 0.26 -0.85 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 1abb h ILE 817 Cb 0.14 0.68 -0.00 0.00 -3.07 0.00 0.00 36.82 34.58 1abb h ILE 817 CO -0.03 0.32 -0.04 0.00 -0.69 0.00 0.00 178.15 177.71 1abb h ALA 818 N 1.04 1.81 0.03 1.87 0.00 -0.80 -0.26 119.26 122.95 1abb h ALA 818 Ca 0.19 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.83 1abb h ALA 818 Cb 0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1abb h ALA 818 CO -0.00 0.05 -1.10 1.96 0.00 0.00 0.00 179.25 180.16 1abb h GLN 819 N 0.00 0.07 -0.12 0.00 4.20 -1.35 -1.60 115.11 116.31 1abb h GLN 819 Ca -0.00 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 1abb h GLN 819 Cb 0.08 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 1abb h GLN 819 CO 0.01 1.03 -0.04 1.88 -0.67 0.00 0.00 178.83 181.03 1abb h TYR 820 N 0.02 0.28 0.38 2.96 0.05 -0.91 0.29 116.97 120.02 1abb h TYR 820 Ca -0.06 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.65 1abb h TYR 820 Cb 1.83 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 39.49 1abb h TYR 820 CO 0.02 0.56 -0.30 0.00 -1.05 0.00 0.00 178.16 177.39 1abb h ALA 821 N 0.67 -0.68 -0.04 3.88 0.00 -1.15 0.16 119.26 122.11 1abb h ALA 821 Ca 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1abb h ALA 821 Cb 0.48 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1abb h ALA 821 CO 0.01 -0.90 -0.07 0.00 0.00 0.00 0.00 179.25 178.29 1abb h ARG 822 N -0.67 0.12 0.00 0.00 3.08 -1.16 0.78 114.38 116.53 1abb h ARG 822 Ca -0.03 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1abb h ARG 822 Cb 0.58 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1abb h ARG 822 CO -0.01 0.64 -0.52 0.93 -1.07 0.00 0.00 179.97 179.94 1abb h GLU 823 N -0.39 0.00 0.00 0.04 5.08 -0.41 -3.39 114.58 115.52 1abb h GLU 823 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1abb h GLU 823 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1abb h GLU 823 CO 0.02 0.00 -0.17 -0.89 -1.00 0.00 0.00 179.01 176.97 1abb n ILE 824 N -2.45 0.55 0.11 3.13 5.41 -0.09 -4.91 119.36 121.10 1abb n ILE 824 Ca 0.03 0.18 -0.02 0.00 1.00 0.00 0.00 62.75 63.94 1abb n ILE 824 Cb 0.48 -1.15 0.05 0.00 -0.71 0.00 0.00 39.64 38.31 1abb n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1abb h TRP 825 N 0.00 0.00 -3.04 1.39 6.55 -0.68 -3.49 115.95 116.68 1abb h TRP 825 Ca 0.00 0.00 -0.04 0.00 0.95 0.00 0.00 58.89 59.80 1abb h TRP 825 Cb 0.17 0.00 0.02 0.00 -0.86 0.00 0.00 29.16 28.49 1abb h TRP 825 CO 0.00 0.74 -0.11 0.41 -1.05 0.00 0.00 178.44 178.43 1abb n GLY 826 N 0.84 0.54 3.43 1.49 0.00 0.26 -4.94 105.19 106.80 1abb n GLY 826 Ca -0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1abb n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1abb s VAL 827 N -3.05 0.00 -0.13 1.61 -7.23 -0.31 -4.98 120.40 106.32 1abb s VAL 827 Ca 0.04 -1.67 0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1abb s VAL 827 Cb -0.01 -2.41 0.01 0.00 0.56 0.00 0.00 36.38 34.53 1abb s VAL 827 CO 0.10 0.00 -0.22 -1.61 -0.31 0.00 0.00 175.10 173.06 1abb s GLU 828 N -3.84 3.06 0.50 4.82 0.41 -1.26 -2.93 118.70 119.45 1abb s GLU 828 Ca 0.30 -0.85 -0.23 0.00 -0.41 0.00 0.00 54.97 53.78 1abb s GLU 828 Cb 0.02 -2.43 -0.07 0.00 -1.78 0.00 0.00 34.13 29.88 1abb s GLU 828 CO 0.13 0.04 1.39 -2.30 -0.49 0.00 0.00 175.26 174.03 1abb n PRO 829 N 3.92 1.96 -3.85 0.39 -0.02 -1.26 -4.93 135.00 131.21 1abb n PRO 829 Ca -0.20 0.71 -0.18 0.00 -2.02 0.00 0.00 63.50 61.81 1abb n PRO 829 Cb 0.52 -2.60 -0.17 0.00 -0.02 0.00 0.00 33.50 31.24 1abb n PRO 829 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1abb s SER 830 N -0.70 0.65 -0.22 2.55 0.15 -1.13 -5.02 113.70 109.99 1abb s SER 830 Ca 0.67 -0.01 0.09 0.00 0.70 0.00 0.00 55.95 57.40 1abb s SER 830 Cb -0.43 -0.22 0.63 0.00 -1.71 0.00 0.00 66.02 64.29 1abb s SER 830 CO 0.53 -0.14 1.55 0.54 1.20 0.00 0.00 173.24 176.92 1abb n ARG 831 N 4.46 3.69 -2.01 5.44 1.74 -1.26 -2.50 116.66 126.23 1abb n ARG 831 Ca -0.20 -2.49 -0.40 0.00 -0.77 0.00 0.00 57.85 53.99 1abb n ARG 831 Cb 0.50 -2.08 -0.00 0.00 -1.02 0.00 0.00 32.46 29.86 1abb n ARG 831 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1abb s GLN 832 N -2.45 3.96 -0.01 5.56 0.74 -1.26 -4.96 119.66 121.24 1abb s GLN 832 Ca 0.44 2.22 -0.26 0.00 0.05 0.00 0.00 55.36 57.81 1abb s GLN 832 Cb 0.34 -2.77 -0.04 0.00 1.10 0.00 0.00 33.01 31.64 1abb s GLN 832 CO 0.12 -0.53 0.83 1.03 -0.55 0.00 0.00 175.29 176.19 1abb s ARG 833 N -2.24 4.51 0.04 1.67 3.00 -1.26 -4.85 118.95 119.82 1abb s ARG 833 Ca 0.57 1.15 -0.30 0.00 0.00 0.00 0.00 55.73 57.14 1abb s ARG 833 Cb -0.39 -3.43 -0.04 0.00 0.00 0.00 0.00 34.95 31.09 1abb s ARG 833 CO 0.51 0.08 1.05 -1.17 0.00 0.00 0.00 175.30 175.78 1abb s LEU 834 N 0.62 4.38 0.10 2.53 2.96 0.69 -4.97 118.68 125.01 1abb s LEU 834 Ca 0.43 1.80 -0.34 0.00 -0.22 0.00 0.00 54.13 55.81 1abb s LEU 834 Cb -0.20 -3.58 -0.14 0.00 0.50 0.00 0.00 46.19 42.77 1abb s LEU 834 CO 0.23 -0.31 1.55 1.55 -1.32 0.00 0.00 176.35 178.05 1abb h PRO 835 N 6.64 -0.70 0.00 0.98 0.13 -1.95 -3.41 132.00 133.69 1abb h PRO 835 Ca -0.41 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1abb h PRO 835 Cb 1.22 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1abb h PRO 835 CO 0.77 -0.46 0.00 0.00 -0.23 0.00 0.00 178.00 178.07 1abb n ALA 836 N -2.93 0.00 0.00 -0.56 0.00 -1.26 -5.03 120.51 110.72 1abb n ALA 836 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1abb n ALA 836 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1abb n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15