#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2skd n SER 14 N 0.00 0.00 -3.42 4.38 2.88 -1.26 -4.97 113.62 111.23 2skd n SER 14 Ca 0.00 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.14 2skd n SER 14 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2skd n SER 14 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2skd n VAL 15 N -1.17 5.36 -0.57 2.46 0.31 -1.26 -4.43 118.33 119.04 2skd n VAL 15 Ca 0.00 -5.21 -0.04 0.00 -0.01 0.00 0.00 64.34 59.09 2skd n VAL 15 Cb 0.00 -1.60 0.25 0.00 -0.91 0.00 0.00 33.84 31.58 2skd n VAL 15 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2skd n ARG 16 N 0.25 3.25 0.00 5.55 1.74 -1.26 -5.01 116.66 121.17 2skd n ARG 16 Ca 0.51 -2.40 0.00 0.00 -0.77 0.00 0.00 57.85 55.19 2skd n ARG 16 Cb 0.27 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.68 2skd n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2skd n GLY 17 N 0.01 -3.20 3.84 -0.13 0.00 -1.26 -1.37 105.19 103.06 2skd n GLY 17 Ca 0.31 -1.98 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 2skd n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2skd s LEU 18 N 0.00 4.44 -0.98 0.99 2.01 -1.26 -4.68 118.68 119.19 2skd s LEU 18 Ca 0.00 1.05 -0.01 0.00 0.01 0.00 0.00 54.13 55.18 2skd s LEU 18 Cb 0.00 -2.90 0.31 0.00 0.01 0.00 0.00 46.19 43.61 2skd s LEU 18 CO 0.00 0.23 1.51 0.00 1.01 0.00 0.00 176.35 179.11 2skd n ALA 19 N 1.39 5.41 -1.54 4.21 0.00 -1.26 -3.83 120.51 124.89 2skd n ALA 19 Ca -0.10 -4.72 -0.37 0.00 0.00 0.00 0.00 53.44 48.25 2skd n ALA 19 Cb 0.52 -2.03 0.07 0.00 0.00 0.00 0.00 19.45 18.01 2skd n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2skd n GLY 20 N 0.60 -0.21 0.15 0.00 0.00 -1.26 -4.87 105.19 99.61 2skd n GLY 20 Ca 0.35 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 2skd n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2skd h VAL 21 N 0.19 0.85 -0.64 1.61 2.07 -2.00 -2.07 116.25 116.27 2skd h VAL 21 Ca -0.49 -0.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.60 2skd h VAL 21 Cb 1.35 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 2skd h VAL 21 CO 0.50 0.08 0.16 -0.33 0.02 0.00 0.00 177.57 178.00 2skd h GLU 22 N -0.48 1.00 0.00 1.57 3.07 -2.00 -3.08 114.58 114.66 2skd h GLU 22 Ca -0.03 -0.22 -0.19 0.00 -0.50 0.00 0.00 59.36 58.42 2skd h GLU 22 Cb 0.36 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 2skd h GLU 22 CO 0.05 0.89 -0.88 -0.91 -1.40 0.00 0.00 179.01 176.75 2skd h ASN 23 N 0.96 0.00 0.22 1.42 4.21 -1.94 -1.86 115.58 118.59 2skd h ASN 23 Ca 0.20 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.59 2skd h ASN 23 Cb 0.34 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.52 2skd h ASN 23 CO 0.00 0.88 -0.48 0.58 -1.29 0.00 0.00 177.43 177.12 2skd h VAL 24 N 0.00 1.33 -0.22 2.81 2.07 -1.38 -0.25 116.25 120.61 2skd h VAL 24 Ca -0.01 -1.70 -0.18 0.00 0.82 0.00 0.00 66.70 65.63 2skd h VAL 24 Cb 1.57 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 2skd h VAL 24 CO 0.11 0.51 -0.58 0.74 0.02 0.00 0.00 177.57 178.38 2skd h THR 25 N 0.25 1.29 -0.47 2.57 2.02 -1.52 -2.28 112.91 114.76 2skd h THR 25 Ca 0.01 -1.78 -0.06 0.00 0.77 0.00 0.00 66.41 65.35 2skd h THR 25 Cb 0.94 1.83 -0.02 0.00 -1.74 0.00 0.00 68.15 69.16 2skd h THR 25 CO 0.08 0.57 0.06 -0.08 0.37 0.00 0.00 175.52 176.51 2skd h GLU 26 N 0.51 0.79 -0.11 6.66 4.57 -1.16 -2.77 114.58 123.07 2skd h GLU 26 Ca -0.01 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 57.96 2skd h GLU 26 Cb 1.19 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 2skd h GLU 26 CO 0.12 0.81 0.04 -0.07 -1.18 0.00 0.00 179.01 178.73 2skd h LEU 27 N 0.65 0.04 -0.66 1.64 4.07 -1.02 -2.67 115.31 117.37 2skd h LEU 27 Ca 0.14 0.01 0.07 0.00 0.08 0.00 0.00 57.88 58.18 2skd h LEU 27 Cb 0.42 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 42.11 2skd h LEU 27 CO 0.01 0.04 0.34 0.11 -1.08 0.00 0.00 178.44 177.87 2skd h LYS 28 N 0.09 0.61 -0.02 1.13 1.57 -1.31 0.72 116.57 119.36 2skd h LYS 28 Ca 0.05 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.67 2skd h LYS 28 Cb 0.02 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2skd h LYS 28 CO -0.05 0.40 -0.56 1.57 -0.57 0.00 0.00 179.45 180.25 2skd h LYS 29 N 0.63 0.06 -0.04 3.15 2.10 -1.41 -2.33 116.57 118.72 2skd h LYS 29 Ca 0.30 -0.04 -0.17 0.00 -2.00 0.00 0.00 60.65 58.75 2skd h LYS 29 Cb 0.24 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.56 2skd h LYS 29 CO -0.21 0.60 -0.72 -0.91 -2.00 0.00 0.00 179.45 176.22 2skd h ASN 30 N 0.05 0.28 -0.57 7.07 2.35 -1.06 -0.11 115.58 123.58 2skd h ASN 30 Ca -0.00 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 2skd h ASN 30 Cb 1.00 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 39.25 2skd h ASN 30 CO 0.08 0.90 0.32 0.15 -1.65 0.00 0.00 177.43 177.23 2skd h PHE 31 N 0.16 0.78 -0.09 1.19 3.04 -0.59 -1.91 116.94 119.52 2skd h PHE 31 Ca -0.02 -0.02 -0.12 0.00 3.98 0.00 0.00 57.97 61.79 2skd h PHE 31 Cb 1.27 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 39.52 2skd h PHE 31 CO 0.03 0.56 -0.48 -0.91 -2.02 0.00 0.00 178.31 175.48 2skd h ASN 32 N 0.78 0.25 0.11 0.41 2.35 -1.19 -1.72 115.58 116.57 2skd h ASN 32 Ca 0.20 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2skd h ASN 32 Cb 0.03 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.33 2skd h ASN 32 CO -0.03 0.70 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.30 2skd h ARG 33 N 0.19 -0.14 -0.67 0.81 2.43 -0.48 -2.50 114.38 114.01 2skd h ARG 33 Ca 0.01 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 2skd h ARG 33 Cb 0.93 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 2skd h ARG 33 CO 0.07 -0.05 0.19 0.45 -1.51 0.00 0.00 179.97 179.13 2skd h HIS 34 N -0.19 1.10 -0.02 2.20 3.86 -1.28 0.46 115.15 121.28 2skd h HIS 34 Ca -0.01 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 2skd h HIS 34 Cb 0.16 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.31 2skd h HIS 34 CO -0.06 0.89 -0.02 1.25 0.86 0.00 0.00 177.93 180.86 2skd h LEU 35 N 0.99 0.03 0.00 2.43 5.85 -1.22 0.27 115.31 123.66 2skd h LEU 35 Ca 0.21 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2skd h LEU 35 Cb 0.32 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2skd h LEU 35 CO -0.00 0.05 -0.43 1.57 -0.34 0.00 0.00 178.44 179.29 2skd n HIS 36 N -4.50 0.60 0.08 1.25 -0.00 -0.95 -1.60 115.22 110.09 2skd n HIS 36 Ca -0.03 0.26 -0.10 0.00 0.46 0.00 0.00 57.72 58.32 2skd n HIS 36 Cb 0.12 -0.60 -0.01 0.00 -0.12 0.00 0.00 29.99 29.38 2skd n HIS 36 CO 0.00 0.00 0.00 0.74 0.46 0.00 0.00 176.34 177.54 2skd h PHE 37 N -0.74 0.38 0.04 1.57 0.04 -0.17 -2.02 116.94 116.04 2skd h PHE 37 Ca 0.00 -0.20 -0.30 0.00 2.80 0.00 0.00 57.97 60.27 2skd h PHE 37 Cb 0.43 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 2skd h PHE 37 CO -0.19 1.01 -1.65 2.41 -0.60 0.00 0.00 178.31 179.30 2skd n THR 38 N -3.70 1.60 0.31 -1.55 -1.04 -0.25 -4.41 114.28 105.23 2skd n THR 38 Ca -0.04 -0.26 0.12 0.00 -2.04 0.00 0.00 64.05 61.83 2skd n THR 38 Cb 0.80 -1.92 0.08 0.00 -1.82 0.00 0.00 70.33 67.47 2skd n THR 38 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2skd h LEU 39 N -0.67 0.00 -2.75 -4.42 4.07 -0.68 -3.49 115.31 107.38 2skd h LEU 39 Ca -0.42 -0.09 -0.39 0.00 0.08 0.00 0.00 57.88 57.07 2skd h LEU 39 Cb 1.56 0.00 0.10 0.00 1.08 0.00 0.00 40.66 43.41 2skd h LEU 39 CO -0.15 0.04 -0.90 0.52 -1.08 0.00 0.00 178.44 176.88 2skd n VAL 40 N -2.48 -6.35 -4.33 1.22 0.31 -0.76 -4.98 118.33 100.96 2skd n VAL 40 Ca 0.02 -0.97 -0.17 0.00 -0.01 0.00 0.00 64.34 63.21 2skd n VAL 40 Cb 0.50 -4.73 -0.10 0.00 -0.91 0.00 0.00 33.84 28.60 2skd n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2skd s LYS 41 N -5.62 1.43 -0.00 5.55 -0.14 -0.63 -5.02 119.74 115.31 2skd s LYS 41 Ca 0.38 -1.77 0.03 0.00 -1.36 0.00 0.00 55.97 53.25 2skd s LYS 41 Cb -0.11 -0.31 -0.01 0.00 -1.68 0.00 0.00 37.83 35.72 2skd s LYS 41 CO 0.82 -0.29 -0.11 0.16 -0.76 0.00 0.00 175.35 175.18 2skd s ASP 42 N -3.32 1.28 0.39 2.83 -4.77 -1.26 -4.17 116.67 107.64 2skd s ASP 42 Ca 0.38 -0.22 0.36 0.00 -3.30 0.00 0.00 52.55 49.77 2skd s ASP 42 Cb 0.08 -0.13 1.24 0.00 -1.09 0.00 0.00 42.92 43.01 2skd s ASP 42 CO 0.14 0.12 1.12 0.54 0.70 0.00 0.00 175.17 177.79 2skd n ARG 43 N 2.74 -0.00 0.07 2.11 5.12 -1.26 -0.31 116.66 125.12 2skd n ARG 43 Ca -0.14 0.78 0.12 0.00 -1.93 0.00 0.00 57.85 56.68 2skd n ARG 43 Cb 0.56 -1.79 0.46 0.00 -1.16 0.00 0.00 32.46 30.53 2skd n ARG 43 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2skd n ASN 44 N -3.42 0.42 0.00 0.55 3.02 -1.26 -3.55 115.26 111.03 2skd n ASN 44 Ca 0.32 0.57 0.00 0.00 -0.03 0.00 0.00 54.58 55.44 2skd n ASN 44 Cb 1.43 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 39.93 2skd n ASN 44 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2skd n VAL 45 N -1.93 0.24 -2.38 2.41 0.24 0.57 -5.06 118.33 112.42 2skd n VAL 45 Ca 0.05 -0.41 -0.42 0.00 -2.04 0.00 0.00 64.34 61.52 2skd n VAL 45 Cb 0.30 1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 33.77 2skd n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2skd s ALA 46 N -0.24 3.43 0.37 2.33 0.00 -1.13 -4.95 121.76 121.57 2skd s ALA 46 Ca 0.00 0.91 0.08 0.00 0.00 0.00 0.00 51.96 52.95 2skd s ALA 46 Cb 0.00 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 2skd s ALA 46 CO 0.00 -0.43 0.31 0.95 0.00 0.00 0.00 175.76 176.60 2skd s THR 47 N 0.68 3.10 0.51 0.00 -4.23 -1.26 -4.97 115.64 109.46 2skd s THR 47 Ca 0.57 -1.39 0.27 0.00 -1.18 0.00 0.00 61.69 59.96 2skd s THR 47 Cb -0.31 -3.09 0.44 0.00 1.34 0.00 0.00 72.50 70.88 2skd s THR 47 CO 0.32 -0.10 1.91 -0.65 -0.54 0.00 0.00 174.62 175.56 2skd h PRO 48 N 1.18 0.10 -0.38 3.99 0.11 -1.99 0.13 132.00 135.14 2skd h PRO 48 Ca -0.43 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.56 2skd h PRO 48 Cb 1.26 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2skd h PRO 48 CO 0.59 0.06 -0.22 -0.09 -0.21 0.00 0.00 178.00 178.13 2skd h ARG 49 N 0.10 0.75 -0.59 1.05 2.43 -1.96 -0.67 114.38 115.49 2skd h ARG 49 Ca 0.39 -0.30 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 2skd h ARG 49 Cb 1.40 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 2skd h ARG 49 CO -0.04 0.90 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.87 2skd h ASP 50 N 0.65 1.02 -0.29 -3.80 3.32 -1.16 -2.27 116.42 113.89 2skd h ASP 50 Ca 0.09 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 2skd h ASP 50 Cb 0.72 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 2skd h ASP 50 CO 0.06 1.08 -0.06 1.88 -1.72 0.00 0.00 179.24 180.47 2skd h TYR 51 N 0.95 0.72 -0.53 4.55 0.05 -1.01 -1.37 116.97 120.33 2skd h TYR 51 Ca 0.17 -0.11 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 2skd h TYR 51 Cb 0.56 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 2skd h TYR 51 CO 0.04 0.72 -0.00 -0.92 -1.05 0.00 0.00 178.16 176.94 2skd h TYR 52 N 0.62 0.98 -0.15 4.88 3.20 -0.81 -2.62 116.97 123.07 2skd h TYR 52 Ca 0.12 -0.15 -0.17 0.00 3.14 0.00 0.00 58.73 61.67 2skd h TYR 52 Cb 0.49 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 2skd h TYR 52 CO 0.02 0.89 -0.61 0.74 -1.64 0.00 0.00 178.16 177.56 2skd h PHE 53 N 0.84 0.65 -0.57 -3.82 0.04 -0.84 -0.58 116.94 112.66 2skd h PHE 53 Ca 0.16 -0.25 -0.03 0.00 2.80 0.00 0.00 57.97 60.65 2skd h PHE 53 Cb 0.50 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.51 2skd h PHE 53 CO 0.03 0.98 0.23 0.00 -0.60 0.00 0.00 178.31 178.95 2skd h ALA 54 N 0.96 0.74 -0.06 2.45 0.00 -1.19 0.19 119.26 122.34 2skd h ALA 54 Ca -0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2skd h ALA 54 Cb 1.16 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2skd h ALA 54 CO 0.11 0.35 0.01 1.25 0.00 0.00 0.00 179.25 180.97 2skd h LEU 55 N 0.78 0.10 -0.49 0.00 5.85 -1.38 -0.93 115.31 119.25 2skd h LEU 55 Ca 0.19 -0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.72 2skd h LEU 55 Cb 0.19 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 2skd h LEU 55 CO -0.02 0.33 0.17 0.00 -0.34 0.00 0.00 178.44 178.59 2skd h ALA 56 N 0.77 0.59 -0.39 1.25 0.00 -0.94 0.22 119.26 120.76 2skd h ALA 56 Ca 0.02 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2skd h ALA 56 Cb 0.28 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2skd h ALA 56 CO 0.00 -0.22 -0.02 0.45 0.00 0.00 0.00 179.25 179.46 2skd h HIS 57 N 0.34 0.67 -0.45 0.00 3.86 -0.87 0.16 115.15 118.86 2skd h HIS 57 Ca 0.23 -0.08 -0.14 0.00 -1.16 0.00 0.00 60.37 59.22 2skd h HIS 57 Cb 0.25 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 2skd h HIS 57 CO -0.16 0.65 -0.25 1.15 0.86 0.00 0.00 177.93 180.18 2skd h THR 58 N 0.60 1.27 -0.35 2.45 2.02 0.14 -2.47 112.91 116.57 2skd h THR 58 Ca 0.12 -1.41 -0.16 0.00 0.77 0.00 0.00 66.41 65.72 2skd h THR 58 Cb 0.41 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2skd h THR 58 CO 0.02 0.48 -0.41 0.58 0.37 0.00 0.00 175.52 176.56 2skd h VAL 59 N 0.81 1.27 0.00 3.16 2.07 -0.33 -2.97 116.25 120.27 2skd h VAL 59 Ca 0.10 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 2skd h VAL 59 Cb 0.83 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2skd h VAL 59 CO 0.07 0.53 -0.07 -0.09 0.02 0.00 0.00 177.57 178.03 2skd h ARG 60 N 0.71 0.00 -0.48 1.57 2.43 -0.90 -1.80 114.38 115.91 2skd h ARG 60 Ca 0.05 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2skd h ARG 60 Cb 1.01 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 2skd h ARG 60 CO 0.10 0.07 0.27 -0.44 -1.51 0.00 0.00 179.97 178.46 2skd h ASP 61 N 0.00 0.57 1.00 -3.80 3.32 -1.27 -2.56 116.42 113.68 2skd h ASP 61 Ca -0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2skd h ASP 61 Cb 0.13 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2skd h ASP 61 CO 0.01 0.45 0.00 0.45 -1.72 0.00 0.00 179.24 178.43 2skd h HIS 62 N 0.66 0.00 -0.10 4.55 3.86 -1.39 -3.24 115.15 119.49 2skd h HIS 62 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2skd h HIS 62 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2skd h HIS 62 CO 0.00 0.00 0.00 1.47 0.86 0.00 0.00 177.93 180.26 2skd n LEU 63 N -2.85 2.20 0.05 2.43 -0.00 -0.97 -4.46 117.00 113.40 2skd n LEU 63 Ca 0.01 -1.24 -0.13 0.00 -0.00 0.00 0.00 56.01 54.65 2skd n LEU 63 Cb 0.30 -0.06 -0.03 0.00 -0.00 0.00 0.00 43.42 43.63 2skd n LEU 63 CO 0.26 0.46 0.25 -0.37 -0.00 0.00 0.00 177.39 177.98 2skd h VAL 64 N 2.24 1.37 -0.62 1.47 -1.51 -1.57 0.14 116.25 117.76 2skd h VAL 64 Ca 0.00 -2.26 -0.02 0.00 -1.23 0.00 0.00 66.70 63.19 2skd h VAL 64 Cb 0.54 2.25 -0.03 0.00 -2.13 0.00 0.00 31.29 31.93 2skd h VAL 64 CO 0.00 0.68 0.30 1.23 -1.23 0.00 0.00 177.57 178.56 2skd h GLY 65 N 1.10 0.95 1.73 5.19 0.00 -1.78 -0.37 103.07 109.88 2skd h GLY 65 Ca -0.06 -0.46 -0.17 0.00 0.00 0.00 0.00 47.33 46.64 2skd h GLY 65 CO 0.15 0.44 -0.69 3.21 0.00 0.00 0.00 176.54 179.65 2skd h ARG 66 N 0.85 0.27 -0.43 4.80 3.08 -1.76 -2.89 114.38 118.30 2skd h ARG 66 Ca 0.21 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2skd h ARG 66 Cb 0.10 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2skd h ARG 66 CO -0.03 0.86 0.16 2.35 -1.07 0.00 0.00 179.97 182.24 2skd h TRP 67 N 0.19 0.67 -0.53 3.04 7.01 -0.29 -0.88 115.95 125.16 2skd h TRP 67 Ca -0.02 -0.06 -0.12 0.00 2.11 0.00 0.00 58.89 60.80 2skd h TRP 67 Cb 1.24 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 28.09 2skd h TRP 67 CO 0.03 0.59 -0.14 0.82 -2.79 0.00 0.00 178.44 176.95 2skd h ILE 68 N 0.55 1.27 0.00 2.65 2.04 -1.07 -2.65 117.51 120.31 2skd h ILE 68 Ca 0.14 -1.30 -0.19 0.00 1.00 0.00 0.00 64.86 64.51 2skd h ILE 68 Cb 0.22 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 2skd h ILE 68 CO -0.01 0.46 -0.87 0.08 0.00 0.00 0.00 178.15 177.81 2skd h ARG 69 N 0.90 0.16 -0.17 2.37 0.11 -1.44 -1.66 114.38 114.65 2skd h ARG 69 Ca 0.13 -0.18 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 2skd h ARG 69 Cb 0.71 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.83 2skd h ARG 69 CO 0.05 0.93 0.09 1.15 0.10 0.00 0.00 179.97 182.29 2skd h THR 70 N 0.09 1.11 -0.37 0.08 2.02 -1.11 0.24 112.91 114.96 2skd h THR 70 Ca -0.04 -0.30 -0.12 0.00 0.77 0.00 0.00 66.41 66.73 2skd h THR 70 Cb 1.50 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 2skd h THR 70 CO 0.13 0.10 -0.24 1.56 0.37 0.00 0.00 175.52 177.44 2skd h GLN 71 N 0.16 0.75 -0.54 6.66 1.08 -1.50 -1.97 115.11 119.75 2skd h GLN 71 Ca 0.06 -0.31 -0.11 0.00 -1.45 0.00 0.00 58.65 56.84 2skd h GLN 71 Cb 0.08 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 2skd h GLN 71 CO -0.01 0.92 -0.09 0.37 -0.95 0.00 0.00 178.83 179.07 2skd h GLN 72 N 0.65 1.00 0.24 1.46 5.75 -1.12 -2.75 115.11 120.34 2skd h GLN 72 Ca 0.09 -0.35 0.00 0.00 -0.15 0.00 0.00 58.65 58.24 2skd h GLN 72 Cb 0.75 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.21 2skd h GLN 72 CO 0.06 1.03 -0.24 1.25 -2.65 0.00 0.00 178.83 178.28 2skd h HIS 73 N 0.89 -0.64 -0.24 3.99 2.76 -0.15 -1.42 115.15 120.34 2skd h HIS 73 Ca 0.14 0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.39 2skd h HIS 73 Cb 0.64 0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.84 2skd h HIS 73 CO 0.04 -0.35 0.22 1.88 -1.30 0.00 0.00 177.93 178.42 2skd h TYR 74 N -0.51 0.00 -0.05 5.26 0.05 -1.32 0.72 116.97 121.13 2skd h TYR 74 Ca -0.00 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.54 2skd h TYR 74 Cb 0.48 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.23 2skd h TYR 74 CO -0.17 0.00 -0.92 -0.92 -1.05 0.00 0.00 178.16 175.11 2skd h TYR 75 N 0.00 0.90 0.25 4.88 3.20 -1.01 -0.23 116.97 124.96 2skd h TYR 75 Ca 0.12 -0.45 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 2skd h TYR 75 Cb 0.56 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.72 2skd h TYR 75 CO 0.00 1.28 -0.12 0.93 -1.64 0.00 0.00 178.16 178.61 2skd h GLU 76 N 0.38 -0.33 -0.06 1.82 4.39 -0.02 -3.33 114.58 117.42 2skd h GLU 76 Ca -0.09 0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.54 2skd h GLU 76 Cb 1.55 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.27 2skd h GLU 76 CO 0.18 -0.07 -0.38 0.87 -1.16 0.00 0.00 179.01 178.45 2skd h LYS 77 N -1.02 0.13 -5.77 2.33 1.79 -1.09 -3.48 116.57 109.45 2skd h LYS 77 Ca -0.03 -0.06 -0.28 0.00 -2.18 0.00 0.00 60.65 58.10 2skd h LYS 77 Cb 0.41 -0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.17 2skd h LYS 77 CO 0.06 0.49 -0.76 -3.47 -1.08 0.00 0.00 179.45 174.69 2skd n ASP 78 N -4.07 -6.31 -4.19 0.86 2.03 -0.10 -5.02 116.55 99.76 2skd n ASP 78 Ca -0.02 -0.73 -0.28 0.00 0.52 0.00 0.00 54.79 54.29 2skd n ASP 78 Cb 0.44 -4.42 0.18 0.00 -0.72 0.00 0.00 41.12 36.59 2skd n ASP 78 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2skd n PRO 79 N -3.29 -0.88 -2.19 -0.67 -0.04 -1.26 -5.00 135.00 121.67 2skd n PRO 79 Ca -0.08 -2.36 -0.42 0.00 -0.04 0.00 0.00 63.50 60.61 2skd n PRO 79 Cb 0.59 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.90 2skd n PRO 79 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2skd s LYS 80 N -5.67 4.35 -0.12 0.54 2.20 -1.26 -4.95 119.74 114.83 2skd s LYS 80 Ca 0.73 2.06 -0.13 0.00 -0.36 0.00 0.00 55.97 58.28 2skd s LYS 80 Cb -0.03 -3.23 -0.05 0.00 -1.51 0.00 0.00 37.83 33.02 2skd s LYS 80 CO 0.51 -0.36 0.29 1.03 -0.36 0.00 0.00 175.35 176.45 2skd s ARG 81 N 0.62 4.04 -0.25 4.03 3.00 0.10 -4.52 118.95 125.97 2skd s ARG 81 Ca 0.61 0.11 -0.09 0.00 0.00 0.00 0.00 55.73 56.37 2skd s ARG 81 Cb -0.37 -3.34 -0.04 0.00 0.00 0.00 0.00 34.95 31.21 2skd s ARG 81 CO 0.33 0.43 0.11 0.42 0.00 0.00 0.00 175.30 176.59 2skd s ILE 82 N -0.11 4.70 -0.29 1.52 -1.09 -0.17 -1.67 121.20 124.08 2skd s ILE 82 Ca 0.17 -0.04 -0.05 0.00 -2.23 0.00 0.00 60.65 58.50 2skd s ILE 82 Cb -0.13 -3.20 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 2skd s ILE 82 CO 0.06 0.32 0.04 -0.31 -1.23 0.00 0.00 174.94 173.82 2skd s TYR 83 N 1.51 3.15 -0.54 3.97 2.02 0.11 0.35 117.35 127.92 2skd s TYR 83 Ca 0.06 -1.24 -0.17 0.00 -0.37 0.00 0.00 57.07 55.35 2skd s TYR 83 Cb -0.15 -2.19 0.12 0.00 -0.40 0.00 0.00 41.96 39.33 2skd s TYR 83 CO 0.06 -0.65 0.52 -0.47 -1.57 0.00 0.00 175.55 173.44 2skd s TYR 84 N 1.42 3.20 -0.16 2.71 5.04 -0.06 -0.63 117.35 128.88 2skd s TYR 84 Ca 0.01 -1.16 -0.22 0.00 -2.44 0.00 0.00 57.07 53.26 2skd s TYR 84 Cb -0.17 -3.74 -0.03 0.00 0.35 0.00 0.00 41.96 38.36 2skd s TYR 84 CO 0.00 -1.04 0.66 -0.51 -1.34 0.00 0.00 175.55 173.33 2skd s LEU 85 N 1.82 4.20 -0.12 6.97 1.02 -0.76 -1.84 118.68 129.96 2skd s LEU 85 Ca 0.05 0.95 -0.19 0.00 0.02 0.00 0.00 54.13 54.96 2skd s LEU 85 Cb -0.28 -2.96 0.04 0.00 0.02 0.00 0.00 46.19 43.02 2skd s LEU 85 CO 0.04 -0.23 0.47 -0.55 0.02 0.00 0.00 176.35 176.10 2skd s SER 86 N 1.06 -0.45 0.00 2.29 0.15 -0.97 -2.15 113.70 113.63 2skd s SER 86 Ca 0.32 0.72 0.28 0.00 0.70 0.00 0.00 55.95 57.97 2skd s SER 86 Cb -0.16 0.76 1.12 0.00 -1.71 0.00 0.00 66.02 66.03 2skd s SER 86 CO 0.12 -0.31 1.79 0.18 1.20 0.00 0.00 173.24 176.22 2skd n LEU 87 N 2.14 1.11 -3.92 3.45 4.32 -1.26 -4.16 117.00 118.67 2skd n LEU 87 Ca -0.16 -0.34 -0.17 0.00 -0.02 0.00 0.00 56.01 55.32 2skd n LEU 87 Cb 0.57 -0.04 -0.15 0.00 -1.62 0.00 0.00 43.42 42.17 2skd n LEU 87 CO 0.15 0.19 -0.40 -1.61 -1.22 0.00 0.00 177.39 174.50 2skd s GLU 88 N -2.15 0.52 -0.33 3.23 2.02 -1.26 -4.69 118.70 116.04 2skd s GLU 88 Ca 0.36 -0.13 -0.00 0.00 0.02 0.00 0.00 54.97 55.21 2skd s GLU 88 Cb 0.21 -0.54 0.13 0.00 0.10 0.00 0.00 34.13 34.03 2skd s GLU 88 CO 0.39 0.03 0.24 -0.06 0.02 0.00 0.00 175.26 175.88 2skd s PHE 89 N 0.30 0.17 -1.30 1.61 0.08 0.01 -4.62 117.98 114.23 2skd s PHE 89 Ca -0.03 -0.99 -0.16 0.00 0.12 0.00 0.00 56.93 55.87 2skd s PHE 89 Cb -0.07 -0.71 0.10 0.00 -0.57 0.00 0.00 43.02 41.77 2skd s PHE 89 CO -0.00 -0.88 1.74 0.98 -0.10 0.00 0.00 175.22 176.96 2skd n TYR 90 N 4.63 4.46 -0.04 0.36 4.19 0.57 -3.64 117.16 127.69 2skd n TYR 90 Ca 0.05 -2.99 -0.15 0.00 3.31 0.00 0.00 57.90 58.11 2skd n TYR 90 Cb 0.42 -2.46 -0.08 0.00 0.49 0.00 0.00 39.34 37.72 2skd n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 2skd h MET 91 N 7.09 0.56 0.00 2.98 2.86 -1.78 -3.42 114.93 123.21 2skd h MET 91 Ca 0.43 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2skd h MET 91 Cb 0.82 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.55 2skd h MET 91 CO 1.48 1.03 0.00 0.41 1.06 0.00 0.00 176.91 180.89 2skd n GLY 92 N 0.58 -1.65 3.79 8.32 0.00 -1.03 -4.83 105.19 110.37 2skd n GLY 92 Ca -0.07 -1.37 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 2skd n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2skd s ARG 93 N 0.00 3.68 0.00 1.61 0.52 -1.26 -2.13 118.95 121.37 2skd s ARG 93 Ca 0.00 1.42 0.02 0.00 -0.52 0.00 0.00 55.73 56.65 2skd s ARG 93 Cb 0.00 -2.07 0.03 0.00 0.52 0.00 0.00 34.95 33.43 2skd s ARG 93 CO 0.00 -0.54 0.74 0.25 0.02 0.00 0.00 175.30 175.76 2skd n THR 94 N -1.06 0.37 0.07 0.02 -2.24 -1.26 -4.71 114.28 105.47 2skd n THR 94 Ca 0.10 -0.68 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 2skd n THR 94 Cb 0.52 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 69.51 2skd n THR 94 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2skd h LEU 95 N 0.35 -0.21 -0.51 3.22 5.85 -1.96 -2.94 115.31 119.10 2skd h LEU 95 Ca 0.00 -0.32 -0.08 0.00 0.84 0.00 0.00 57.88 58.32 2skd h LEU 95 Cb 0.25 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2skd h LEU 95 CO 0.00 0.30 0.01 -0.61 -0.34 0.00 0.00 178.44 177.80 2skd h GLN 96 N -0.82 0.89 -0.20 1.25 4.15 -1.97 -2.44 115.11 115.98 2skd h GLN 96 Ca -0.03 -0.28 0.01 0.00 0.77 0.00 0.00 58.65 59.12 2skd h GLN 96 Cb 0.52 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 2skd h GLN 96 CO 0.04 0.92 0.13 -0.97 -1.93 0.00 0.00 178.83 177.02 2skd h ASN 97 N 0.76 0.20 0.20 -0.69 -0.73 -1.84 0.53 115.58 114.00 2skd h ASN 97 Ca 0.15 -0.00 -0.23 0.00 1.87 0.00 0.00 56.30 58.08 2skd h ASN 97 Cb 0.51 -0.05 0.01 0.00 0.27 0.00 0.00 38.32 39.06 2skd h ASN 97 CO 0.02 0.14 -0.93 0.74 -0.37 0.00 0.00 177.43 177.04 2skd h THR 98 N 0.24 1.36 -0.36 -3.57 2.02 -1.31 -2.18 112.91 109.10 2skd h THR 98 Ca 0.08 -2.32 -0.05 0.00 0.77 0.00 0.00 66.41 64.89 2skd h THR 98 Cb 0.02 2.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 2skd h THR 98 CO -0.02 0.70 0.04 0.24 0.37 0.00 0.00 175.52 176.85 2skd h MET 99 N 0.31 0.61 -0.45 6.66 2.86 -0.86 -1.95 114.93 122.11 2skd h MET 99 Ca -0.08 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.37 2skd h MET 99 Cb 1.56 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 33.14 2skd h MET 99 CO 0.17 0.70 0.25 0.28 1.06 0.00 0.00 176.91 179.37 2skd h VAL 100 N 0.44 1.16 0.00 -2.22 2.07 -0.92 0.35 116.25 117.12 2skd h VAL 100 Ca 0.11 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2skd h VAL 100 Cb 0.40 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2skd h VAL 100 CO 0.01 0.16 0.00 0.78 0.02 0.00 0.00 177.57 178.54 2skd h ASN 101 N 0.59 0.00 -0.27 0.57 4.21 -1.32 -2.91 115.58 116.46 2skd h ASN 101 Ca 0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.67 2skd h ASN 101 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 2skd h ASN 101 CO -0.03 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.29 2skd n LEU 102 N -2.61 2.86 -3.70 1.61 4.32 -0.74 -0.51 117.00 118.24 2skd n LEU 102 Ca 0.03 -1.50 -0.22 0.00 -0.02 0.00 0.00 56.01 54.29 2skd n LEU 102 Cb 0.35 -0.17 0.04 0.00 -1.62 0.00 0.00 43.42 42.02 2skd n LEU 102 CO 0.27 0.63 0.00 0.00 -1.22 0.00 0.00 177.39 177.07 2skd n ALA 103 N 0.95 -1.85 0.28 -1.18 0.00 -0.24 -4.91 120.51 113.55 2skd n ALA 103 Ca 0.13 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.55 2skd n ALA 103 Cb 0.46 -2.64 -0.04 0.00 0.00 0.00 0.00 19.45 17.23 2skd n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2skd n LEU 104 N -4.37 0.28 -0.17 0.00 4.32 0.11 -4.59 117.00 112.57 2skd n LEU 104 Ca -0.22 -0.42 -0.02 0.00 -0.02 0.00 0.00 56.01 55.32 2skd n LEU 104 Cb 0.64 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 42.49 2skd n LEU 104 CO 0.68 0.07 0.78 -0.08 -1.22 0.00 0.00 177.39 177.62 2skd h GLU 105 N 0.00 0.02 -0.24 3.23 4.81 -1.56 -0.63 114.58 120.20 2skd h GLU 105 Ca 0.00 -0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 2skd h GLU 105 Cb 0.19 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 2skd h GLU 105 CO 0.00 0.01 -0.35 -0.91 -0.73 0.00 0.00 179.01 177.03 2skd h ASN 106 N 0.02 0.73 -0.78 1.04 2.35 -1.50 -0.45 115.58 116.99 2skd h ASN 106 Ca 0.26 -0.51 0.02 0.00 -0.55 0.00 0.00 56.30 55.52 2skd h ASN 106 Cb 0.40 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.52 2skd h ASN 106 CO -0.53 1.10 0.51 0.00 -1.65 0.00 0.00 177.43 176.85 2skd h ALA 107 N 0.65 1.01 -0.11 -0.83 0.00 -1.62 0.27 119.26 118.63 2skd h ALA 107 Ca 0.02 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2skd h ALA 107 Cb 0.94 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2skd h ALA 107 CO 0.08 0.36 -0.56 0.00 0.00 0.00 0.00 179.25 179.12 2skd h ASP 109 N 0.27 0.58 0.56 0.00 1.82 -0.38 -1.74 116.42 117.54 2skd h ASP 109 Ca 0.00 -0.29 -0.03 0.00 -0.39 0.00 0.00 57.03 56.32 2skd h ASP 109 Cb 1.07 -0.16 0.01 0.00 0.68 0.00 0.00 39.33 40.93 2skd h ASP 109 CO 0.09 0.73 -0.27 -0.08 -1.61 0.00 0.00 179.24 178.11 2skd h GLU 110 N 0.42 -0.73 -0.54 0.28 4.57 -0.36 -2.02 114.58 116.20 2skd h GLU 110 Ca 0.10 0.05 0.10 0.00 -1.18 0.00 0.00 59.36 58.43 2skd h GLU 110 Cb 0.42 0.17 -0.08 0.00 -0.16 0.00 0.00 28.75 29.10 2skd h GLU 110 CO 0.01 -0.43 0.09 0.00 -1.18 0.00 0.00 179.01 177.51 2skd h ALA 111 N -0.60 0.60 -0.18 2.92 0.00 -1.09 0.15 119.26 121.06 2skd h ALA 111 Ca -0.08 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2skd h ALA 111 Cb 0.64 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2skd h ALA 111 CO 0.13 -0.32 -0.32 1.79 0.00 0.00 0.00 179.25 180.53 2skd h THR 112 N 0.22 1.28 -0.10 0.00 1.35 -1.36 -1.12 112.91 113.19 2skd h THR 112 Ca 0.28 -1.35 -0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2skd h THR 112 Cb 0.40 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 68.31 2skd h THR 112 CO -0.37 0.42 0.05 0.22 -0.25 0.00 0.00 175.52 175.59 2skd h TYR 113 N 0.31 0.14 0.00 4.73 3.20 -0.48 0.33 116.97 125.20 2skd h TYR 113 Ca 0.04 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2skd h TYR 113 Cb 0.72 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 2skd h TYR 113 CO 0.02 0.17 -0.12 1.96 -1.64 0.00 0.00 178.16 178.55 2skd h GLN 114 N 0.06 0.00 0.00 1.82 4.20 -0.70 0.42 115.11 120.92 2skd h GLN 114 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2skd h GLN 114 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2skd h GLN 114 CO -0.01 0.12 0.00 1.28 -0.67 0.00 0.00 178.83 179.55 2skd n LEU 115 N -4.35 0.00 -0.06 1.46 4.32 -0.45 -4.88 117.00 113.04 2skd n LEU 115 Ca -0.03 0.09 -0.01 0.00 -0.02 0.00 0.00 56.01 56.05 2skd n LEU 115 Cb 0.19 -0.09 -0.00 0.00 -1.62 0.00 0.00 43.42 41.90 2skd n LEU 115 CO 0.35 -0.00 -0.01 0.61 -1.22 0.00 0.00 177.39 177.12 2skd n GLY 116 N 1.01 0.35 3.33 -0.72 0.00 0.15 -5.05 105.19 104.25 2skd n GLY 116 Ca 0.20 -0.88 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 2skd n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2skd s LEU 117 N -0.15 2.41 -0.36 0.99 1.43 0.11 -4.99 118.68 118.12 2skd s LEU 117 Ca 0.00 -0.83 -0.16 0.00 -1.03 0.00 0.00 54.13 52.12 2skd s LEU 117 Cb 0.00 -0.85 -0.00 0.00 0.03 0.00 0.00 46.19 45.37 2skd s LEU 117 CO 0.00 -0.01 0.38 -0.62 0.23 0.00 0.00 176.35 176.33 2skd s ASP 118 N -2.51 6.18 0.27 2.29 -1.08 -1.26 -3.39 116.67 117.17 2skd s ASP 118 Ca 0.14 -0.35 -0.04 0.00 -0.52 0.00 0.00 52.55 51.78 2skd s ASP 118 Cb -0.07 -2.20 0.34 0.00 -1.46 0.00 0.00 42.92 39.53 2skd s ASP 118 CO 0.06 -0.40 1.95 -0.03 0.52 0.00 0.00 175.17 177.27 2skd h MET 119 N 8.53 1.23 -0.48 4.34 1.85 -1.91 -2.44 114.93 126.04 2skd h MET 119 Ca -0.29 -0.07 -0.02 0.00 -0.61 0.00 0.00 59.70 58.70 2skd h MET 119 Cb 1.14 -0.28 -0.02 0.00 0.43 0.00 0.00 31.60 32.87 2skd h MET 119 CO 0.72 0.81 0.20 0.93 -0.40 0.00 0.00 176.91 179.16 2skd h GLU 120 N 1.26 0.68 -0.24 0.39 5.08 -2.00 -1.33 114.58 118.42 2skd h GLU 120 Ca 0.34 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.50 2skd h GLU 120 Cb -0.15 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 2skd h GLU 120 CO -0.07 0.56 -0.31 1.49 -1.00 0.00 0.00 179.01 179.67 2skd h GLU 121 N 0.67 0.50 -0.03 2.33 4.81 -1.87 -2.99 114.58 118.00 2skd h GLU 121 Ca 0.16 -0.21 -0.20 0.00 -0.13 0.00 0.00 59.36 58.98 2skd h GLU 121 Cb 0.13 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2skd h GLU 121 CO -0.02 0.75 -0.84 -0.07 -0.73 0.00 0.00 179.01 178.11 2skd h LEU 122 N 0.43 0.44 -1.15 1.64 4.07 -1.20 -3.22 115.31 116.32 2skd h LEU 122 Ca 0.05 -0.33 -0.04 0.00 0.08 0.00 0.00 57.88 57.65 2skd h LEU 122 Cb 0.75 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.34 2skd h LEU 122 CO 0.06 1.10 0.19 -0.33 -1.08 0.00 0.00 178.44 178.38 2skd h GLU 123 N 0.22 0.78 0.00 1.13 5.08 -1.15 -2.22 114.58 118.42 2skd h GLU 123 Ca -0.05 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2skd h GLU 123 Cb 1.45 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2skd h GLU 123 CO 0.14 0.67 0.00 0.93 -1.00 0.00 0.00 179.01 179.75 2skd h GLU 124 N 0.77 0.00 0.00 2.33 4.39 -1.53 -2.72 114.58 117.82 2skd h GLU 124 Ca 0.18 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 2skd h GLU 124 Cb 0.20 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2skd h GLU 124 CO -0.01 0.00 -0.09 0.82 -1.16 0.00 0.00 179.01 178.57 2skd h ILE 125 N 0.00 0.02 -3.05 3.13 2.04 -1.52 -3.45 117.51 114.68 2skd h ILE 125 Ca 0.00 -1.03 -0.53 0.00 1.00 0.00 0.00 64.86 64.29 2skd h ILE 125 Cb 0.22 1.97 0.01 0.00 -0.74 0.00 0.00 36.82 38.28 2skd h ILE 125 CO 0.00 0.01 0.69 -0.70 0.00 0.00 0.00 178.15 178.15 2skd s GLU 126 N -3.21 4.35 0.34 2.37 2.12 -1.03 -5.00 118.70 118.64 2skd s GLU 126 Ca 0.06 1.93 -0.26 0.00 0.36 0.00 0.00 54.97 57.06 2skd s GLU 126 Cb 0.05 -3.35 -0.09 0.00 0.26 0.00 0.00 34.13 31.00 2skd s GLU 126 CO 0.68 -0.40 1.02 -2.00 -0.54 0.00 0.00 175.26 174.02 2skd s GLU 127 N 1.37 4.44 0.49 4.30 2.56 -1.26 -4.89 118.70 125.70 2skd s GLU 127 Ca 0.62 1.51 -0.21 0.00 0.00 0.00 0.00 54.97 56.89 2skd s GLU 127 Cb -0.33 -2.80 -0.07 0.00 2.00 0.00 0.00 34.13 32.93 2skd s GLU 127 CO 0.29 0.11 1.12 -0.51 -0.56 0.00 0.00 175.26 175.70 2skd s ASP 128 N -1.42 6.09 -1.01 -1.70 1.11 -1.26 -4.53 116.67 113.95 2skd s ASP 128 Ca 0.52 2.17 -0.14 0.00 0.18 0.00 0.00 52.55 55.27 2skd s ASP 128 Cb -0.23 -2.59 0.19 0.00 1.07 0.00 0.00 42.92 41.36 2skd s ASP 128 CO 0.29 -0.96 1.12 0.00 1.18 0.00 0.00 175.17 176.80 2skd s ALA 129 N -1.71 3.98 -0.80 5.23 0.00 -0.91 -4.87 121.76 122.68 2skd s ALA 129 Ca 0.67 -3.27 -0.06 0.00 0.00 0.00 0.00 51.96 49.30 2skd s ALA 129 Cb -0.24 -3.85 -0.00 0.00 0.00 0.00 0.00 23.12 19.03 2skd s ALA 129 CO 0.29 -2.61 2.83 0.41 0.00 0.00 0.00 175.76 176.68 2skd n GLY 130 N 4.21 4.37 1.87 0.00 0.00 -1.26 -2.47 105.19 111.90 2skd n GLY 130 Ca 0.25 -1.77 -0.15 0.00 0.00 0.00 0.00 46.02 44.36 2skd n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2skd n LEU 131 N 1.79 6.29 -3.73 0.99 4.77 -1.24 -0.78 117.00 125.10 2skd n LEU 131 Ca 0.56 -3.21 -0.10 0.00 -0.03 0.00 0.00 56.01 53.24 2skd n LEU 131 Cb 0.48 -1.08 -0.04 0.00 -2.33 0.00 0.00 43.42 40.45 2skd n LEU 131 CO 0.47 1.23 0.24 -0.83 -1.33 0.00 0.00 177.39 177.18 2skd s GLY 132 N 0.48 -0.09 -0.26 -0.72 0.00 -1.26 -0.81 107.32 104.66 2skd s GLY 132 Ca 0.28 -0.22 -0.07 0.00 0.00 0.00 0.00 44.72 44.71 2skd s GLY 132 CO -0.01 -0.29 -0.24 0.70 0.00 0.00 0.00 173.10 173.25 2skd n ASN 133 N -0.32 1.97 0.00 1.64 3.02 -1.26 -4.47 115.26 115.84 2skd n ASN 133 Ca -0.11 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2skd n ASN 133 Cb 0.63 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 2skd n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2skd n GLY 134 N 1.73 1.34 0.27 7.41 0.00 -1.26 -4.94 105.19 109.73 2skd n GLY 134 Ca -0.49 0.30 -0.00 0.00 0.00 0.00 0.00 46.02 45.82 2skd n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2skd h GLY 135 N 0.00 0.42 0.93 -0.02 0.00 -1.99 -1.74 103.07 100.67 2skd h GLY 135 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 2skd h GLY 135 CO 0.00 -0.25 0.15 -2.00 0.00 0.00 0.00 176.54 174.43 2skd h LEU 136 N -0.02 0.50 -0.77 3.11 6.46 -1.99 -1.81 115.31 120.79 2skd h LEU 136 Ca 0.32 -0.17 -0.13 0.00 -0.12 0.00 0.00 57.88 57.78 2skd h LEU 136 Cb 0.51 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 2skd h LEU 136 CO -0.70 0.53 -0.55 1.23 -0.62 0.00 0.00 178.44 178.33 2skd h GLY 137 N 0.44 0.21 1.67 3.75 0.00 -1.74 -2.99 103.07 104.41 2skd h GLY 137 Ca 0.12 -0.24 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 2skd h GLY 137 CO -0.01 0.21 -0.81 -0.09 0.00 0.00 0.00 176.54 175.84 2skd h ARG 138 N 0.14 0.31 -0.44 4.80 1.12 -1.27 0.16 114.38 119.21 2skd h ARG 138 Ca -0.00 -0.29 0.02 0.00 -1.11 0.00 0.00 59.98 58.60 2skd h ARG 138 Cb 1.02 0.07 -0.03 0.00 -0.01 0.00 0.00 29.97 31.02 2skd h ARG 138 CO 0.08 0.97 0.25 1.25 -3.11 0.00 0.00 179.97 179.41 2skd h LEU 139 N 0.19 0.41 -0.87 3.80 5.85 -1.23 -0.67 115.31 122.79 2skd h LEU 139 Ca -0.04 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.75 2skd h LEU 139 Cb 1.41 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.29 2skd h LEU 139 CO 0.13 0.29 0.53 0.00 -0.34 0.00 0.00 178.44 179.06 2skd h ALA 140 N 1.20 1.21 -0.45 1.25 0.00 -1.52 0.28 119.26 121.23 2skd h ALA 140 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 2skd h ALA 140 Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2skd h ALA 140 CO -0.08 0.25 -0.14 0.00 0.00 0.00 0.00 179.25 179.27 2skd h ALA 141 N 1.43 0.89 -0.09 0.00 0.00 -1.20 -1.51 119.26 118.77 2skd h ALA 141 Ca 0.39 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 2skd h ALA 141 Cb 0.23 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2skd h ALA 141 CO -0.19 0.63 -0.71 0.00 0.00 0.00 0.00 179.25 178.98 2skd h PHE 143 N 0.31 0.72 -0.50 0.00 -1.00 -0.25 -2.08 116.94 114.14 2skd h PHE 143 Ca -0.03 -0.08 0.05 0.00 2.81 0.00 0.00 57.97 60.73 2skd h PHE 143 Cb 1.29 -0.20 -0.05 0.00 3.61 0.00 0.00 35.95 40.59 2skd h PHE 143 CO 0.05 0.66 0.22 -0.07 -1.61 0.00 0.00 178.31 177.56 2skd h LEU 144 N 0.57 0.29 -0.44 1.54 4.07 -1.24 0.15 115.31 120.24 2skd h LEU 144 Ca 0.14 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 2skd h LEU 144 Cb 0.29 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 2skd h LEU 144 CO -0.00 0.20 0.24 -0.78 -1.08 0.00 0.00 178.44 177.02 2skd h ASP 145 N 0.44 0.56 -0.11 -0.43 1.82 -1.42 -2.35 116.42 114.92 2skd h ASP 145 Ca 0.23 -0.09 -0.12 0.00 -0.39 0.00 0.00 57.03 56.66 2skd h ASP 145 Cb 0.18 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.03 2skd h ASP 145 CO -0.19 0.49 -0.32 0.28 -1.61 0.00 0.00 179.24 177.89 2skd h SER 146 N 0.58 0.62 0.08 2.28 0.02 -0.81 -1.18 113.55 115.15 2skd h SER 146 Ca 0.16 -0.24 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 2skd h SER 146 Cb 0.06 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2skd h SER 146 CO -0.02 0.89 -0.30 0.24 -1.14 0.00 0.00 176.83 176.50 2skd h MET 147 N 0.51 0.33 -0.03 3.45 2.86 -0.59 -0.34 114.93 121.12 2skd h MET 147 Ca 0.06 -0.13 -0.18 0.00 -2.06 0.00 0.00 59.70 57.39 2skd h MET 147 Cb 0.80 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.45 2skd h MET 147 CO 0.07 0.60 -0.71 0.00 1.06 0.00 0.00 176.91 177.93 2skd h ALA 148 N 1.40 0.12 -0.05 6.32 0.00 -1.26 -0.67 119.26 125.12 2skd h ALA 148 Ca 0.04 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 2skd h ALA 148 Cb 0.68 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2skd h ALA 148 CO 0.05 0.46 -0.09 1.15 0.00 0.00 0.00 179.25 180.82 2skd h THR 149 N 0.09 1.10 -0.50 0.00 2.02 -1.00 -2.05 112.91 112.58 2skd h THR 149 Ca -0.08 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2skd h THR 149 Cb 1.39 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 2skd h THR 149 CO 0.14 0.13 0.00 0.18 0.37 0.00 0.00 175.52 176.34 2skd n LEU 150 N -4.39 4.81 -3.91 2.58 4.77 -0.16 -4.73 117.00 115.97 2skd n LEU 150 Ca -0.02 -2.44 -0.30 0.00 -0.03 0.00 0.00 56.01 53.22 2skd n LEU 150 Cb 0.19 -0.63 0.03 0.00 -2.33 0.00 0.00 43.42 40.68 2skd n LEU 150 CO 0.36 0.59 0.11 0.61 -1.33 0.00 0.00 177.39 177.73 2skd n GLY 151 N 0.63 -0.50 3.88 -0.72 0.00 -0.77 -1.23 105.19 106.48 2skd n GLY 151 Ca 0.23 0.20 -0.33 0.00 0.00 0.00 0.00 46.02 46.11 2skd n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2skd s LEU 152 N -7.29 4.31 -1.33 0.99 1.43 -0.27 -4.71 118.68 111.82 2skd s LEU 152 Ca 0.67 0.70 -0.13 0.00 -1.03 0.00 0.00 54.13 54.34 2skd s LEU 152 Cb -0.34 -3.11 0.11 0.00 0.03 0.00 0.00 46.19 42.88 2skd s LEU 152 CO 0.83 0.12 1.89 0.00 0.23 0.00 0.00 176.35 179.42 2skd n ALA 153 N 0.56 4.87 -2.65 4.21 0.00 -1.26 -4.69 120.51 121.55 2skd n ALA 153 Ca -0.06 -4.09 -0.32 0.00 0.00 0.00 0.00 53.44 48.97 2skd n ALA 153 Cb 0.52 -3.28 -0.09 0.00 0.00 0.00 0.00 19.45 16.60 2skd n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2skd s ALA 154 N 2.12 3.17 -0.06 0.00 0.00 -1.26 -1.00 121.76 124.72 2skd s ALA 154 Ca 0.45 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.45 2skd s ALA 154 Cb 0.08 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.97 2skd s ALA 154 CO -0.01 0.64 -0.16 0.71 0.00 0.00 0.00 175.76 176.94 2skd s TYR 155 N -1.06 1.70 -0.16 0.00 1.51 0.15 -4.14 117.35 115.35 2skd s TYR 155 Ca 0.19 -0.60 -0.15 0.00 -1.01 0.00 0.00 57.07 55.49 2skd s TYR 155 Cb -0.11 -1.19 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 2skd s TYR 155 CO 0.10 -0.26 0.36 0.20 -1.11 0.00 0.00 175.55 174.84 2skd s GLY 156 N 0.42 2.22 -0.06 0.71 0.00 -0.71 -0.88 107.32 109.02 2skd s GLY 156 Ca -0.12 -0.41 0.04 0.00 0.00 0.00 0.00 44.72 44.23 2skd s GLY 156 CO 0.04 0.62 -0.17 -0.19 0.00 0.00 0.00 173.10 173.40 2skd s TYR 157 N 0.73 1.77 0.00 1.90 2.02 -0.77 0.42 117.35 123.42 2skd s TYR 157 Ca 0.19 -0.58 0.00 0.00 -0.37 0.00 0.00 57.07 56.32 2skd s TYR 157 Cb -0.14 -1.21 0.00 0.00 -0.40 0.00 0.00 41.96 40.21 2skd s TYR 157 CO 0.06 -0.23 0.00 0.41 -1.57 0.00 0.00 175.55 174.23 2skd n GLY 158 N 3.36 2.46 3.53 0.71 0.00 -0.82 -2.30 105.19 112.13 2skd n GLY 158 Ca -0.19 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 2skd n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2skd s ILE 159 N -2.39 3.60 -0.88 -0.61 1.01 -1.26 -1.17 121.20 119.49 2skd s ILE 159 Ca 0.00 -0.50 -0.17 0.00 0.00 0.00 0.00 60.65 59.98 2skd s ILE 159 Cb 0.00 -2.49 0.16 0.00 0.01 0.00 0.00 42.46 40.15 2skd s ILE 159 CO 0.00 0.57 0.98 -0.60 0.00 0.00 0.00 174.94 175.89 2skd s ARG 160 N -0.49 3.58 0.22 2.79 3.52 0.15 -4.76 118.95 123.96 2skd s ARG 160 Ca 0.07 -2.00 -0.30 0.00 -0.13 0.00 0.00 55.73 53.38 2skd s ARG 160 Cb -0.12 -4.71 -0.09 0.00 -1.56 0.00 0.00 34.95 28.48 2skd s ARG 160 CO 0.02 -1.59 1.13 0.71 -0.81 0.00 0.00 175.30 174.76 2skd s TYR 161 N 1.76 3.54 -0.98 5.12 2.02 -1.26 -4.74 117.35 122.81 2skd s TYR 161 Ca 0.26 1.59 0.27 0.00 -0.37 0.00 0.00 57.07 58.83 2skd s TYR 161 Cb -0.08 -3.32 0.96 0.00 -0.40 0.00 0.00 41.96 39.12 2skd s TYR 161 CO -0.09 -0.75 1.74 -0.85 -1.57 0.00 0.00 175.55 174.03 2skd n GLU 162 N 1.93 0.01 -3.80 -0.62 0.28 -1.05 -4.57 120.64 112.82 2skd n GLU 162 Ca 0.02 0.01 -0.26 0.00 -0.16 0.00 0.00 57.16 56.76 2skd n GLU 162 Cb 0.45 -1.51 -0.17 0.00 1.43 0.00 0.00 31.44 31.64 2skd n GLU 162 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2skd s PHE 163 N -3.01 1.13 0.00 -1.84 0.08 -0.73 -4.34 117.98 109.28 2skd s PHE 163 Ca 0.13 -0.71 0.00 0.00 0.12 0.00 0.00 56.93 56.47 2skd s PHE 163 Cb 0.18 -1.05 0.00 0.00 -0.57 0.00 0.00 43.02 41.58 2skd s PHE 163 CO 0.59 -0.52 0.00 0.41 -0.10 0.00 0.00 175.22 175.60 2skd n GLY 164 N 5.02 1.05 3.75 4.36 0.00 -1.22 -2.37 105.19 115.79 2skd n GLY 164 Ca -0.09 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2skd n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2skd s ILE 165 N 0.99 2.34 0.66 -0.61 1.10 0.04 -4.59 121.20 121.14 2skd s ILE 165 Ca 0.00 0.30 -0.17 0.00 -0.51 0.00 0.00 60.65 60.26 2skd s ILE 165 Cb 0.00 -3.19 -0.02 0.00 0.15 0.00 0.00 42.46 39.40 2skd s ILE 165 CO 0.00 0.05 1.05 2.22 -2.11 0.00 0.00 174.94 176.15 2skd n PHE 166 N 2.05 1.06 -2.87 3.50 1.16 -1.26 -4.61 117.46 116.49 2skd n PHE 166 Ca 0.07 0.42 -0.41 0.00 -1.87 0.00 0.00 57.45 55.65 2skd n PHE 166 Cb 0.39 -2.15 -0.04 0.00 -1.61 0.00 0.00 39.48 36.07 2skd n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 2skd s ASN 167 N -1.43 7.10 -0.10 5.98 0.01 -0.62 -4.90 114.94 120.98 2skd s ASN 167 Ca 0.77 1.34 -0.19 0.00 -0.71 0.00 0.00 52.86 54.07 2skd s ASN 167 Cb -0.38 -2.48 -0.04 0.00 0.41 0.00 0.00 41.25 38.76 2skd s ASN 167 CO 0.46 -0.29 0.53 -1.58 -1.51 0.00 0.00 177.10 174.71 2skd s GLN 168 N 1.46 4.35 -0.04 -0.60 0.74 -1.26 -2.35 119.66 121.97 2skd s GLN 168 Ca 0.43 0.56 0.06 0.00 0.05 0.00 0.00 55.36 56.46 2skd s GLN 168 Cb -0.18 -3.43 -0.01 0.00 1.10 0.00 0.00 33.01 30.49 2skd s GLN 168 CO 0.18 0.16 -0.22 0.15 -0.55 0.00 0.00 175.29 175.01 2skd s LYS 169 N 0.59 2.07 -0.36 1.67 -0.14 0.06 -3.87 119.74 119.76 2skd s LYS 169 Ca 0.29 -0.79 -0.12 0.00 -1.36 0.00 0.00 55.97 53.99 2skd s LYS 169 Cb -0.16 -1.85 0.00 0.00 -1.68 0.00 0.00 37.83 34.14 2skd s LYS 169 CO 0.12 0.39 0.23 0.42 -0.76 0.00 0.00 175.35 175.75 2skd s ILE 170 N -0.26 4.97 -0.21 2.17 -1.09 -1.26 0.19 121.20 125.72 2skd s ILE 170 Ca 0.01 -0.49 -0.00 0.00 -2.23 0.00 0.00 60.65 57.94 2skd s ILE 170 Cb -0.11 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.15 2skd s ILE 170 CO 0.01 -0.10 -0.13 0.00 -1.23 0.00 0.00 174.94 173.49 2skd n GLY 172 N 4.65 -0.50 2.59 0.00 0.00 -1.26 -0.58 105.19 110.09 2skd n GLY 172 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2skd n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2skd n GLY 173 N -1.02 0.86 3.74 -0.02 0.00 -1.26 -5.03 105.19 102.45 2skd n GLY 173 Ca -0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 2skd n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2skd s TRP 174 N -3.40 3.17 0.31 1.61 0.52 0.25 -3.86 118.94 117.54 2skd s TRP 174 Ca 0.00 0.12 -0.29 0.00 0.02 0.00 0.00 56.10 55.95 2skd s TRP 174 Cb 0.00 -1.68 -0.10 0.00 -1.15 0.00 0.00 33.47 30.55 2skd s TRP 174 CO 0.00 0.51 1.14 -1.14 0.02 0.00 0.00 176.95 177.48 2skd s GLN 175 N -1.81 4.51 -0.03 4.98 0.74 -1.26 0.44 119.66 127.23 2skd s GLN 175 Ca 0.23 1.87 0.05 0.00 0.05 0.00 0.00 55.36 57.56 2skd s GLN 175 Cb -0.12 -3.09 -0.01 0.00 1.10 0.00 0.00 33.01 30.89 2skd s GLN 175 CO 0.14 0.07 -0.17 -1.64 -0.55 0.00 0.00 175.29 173.14 2skd s MET 176 N -1.64 1.62 -0.07 1.67 -1.94 0.51 -4.84 119.30 114.61 2skd s MET 176 Ca 0.47 -0.60 -0.01 0.00 -1.71 0.00 0.00 55.69 53.83 2skd s MET 176 Cb -0.33 -1.46 -0.03 0.00 2.01 0.00 0.00 34.83 35.02 2skd s MET 176 CO 0.43 0.28 -0.00 -1.21 -0.01 0.00 0.00 175.02 174.51 2skd s GLU 177 N -0.11 2.95 -0.03 2.03 8.01 -1.26 -0.76 118.70 129.53 2skd s GLU 177 Ca -0.00 -0.44 -0.03 0.00 0.01 0.00 0.00 54.97 54.51 2skd s GLU 177 Cb -0.10 -2.77 0.01 0.00 -4.31 0.00 0.00 34.13 26.96 2skd s GLU 177 CO 0.01 0.69 0.08 -1.83 0.01 0.00 0.00 175.26 174.22 2skd s GLU 178 N -0.97 0.15 0.16 1.61 -1.05 -0.99 -5.00 118.70 112.61 2skd s GLU 178 Ca 0.14 0.01 -0.34 0.00 -0.15 0.00 0.00 54.97 54.64 2skd s GLU 178 Cb -0.11 0.07 -0.16 0.00 -0.44 0.00 0.00 34.13 33.49 2skd s GLU 178 CO 0.03 -0.02 1.20 0.00 0.95 0.00 0.00 175.26 177.42 2skd n ALA 179 N 2.77 -0.82 -3.20 -0.84 0.00 -1.26 -1.59 120.51 115.57 2skd n ALA 179 Ca -0.14 0.47 -0.46 0.00 0.00 0.00 0.00 53.44 53.32 2skd n ALA 179 Cb 0.59 -2.04 -0.02 0.00 0.00 0.00 0.00 19.45 17.98 2skd n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2skd s ASP 180 N 0.09 6.84 -1.49 0.00 2.15 -1.26 -4.71 116.67 118.29 2skd s ASP 180 Ca 0.75 -2.69 -0.09 0.00 0.43 0.00 0.00 52.55 50.96 2skd s ASP 180 Cb -0.87 -2.27 0.01 0.00 -0.30 0.00 0.00 42.92 39.48 2skd s ASP 180 CO 0.51 -0.67 2.62 -0.67 -0.17 0.00 0.00 175.17 176.79 2skd n ASP 181 N 4.58 7.75 0.17 -0.34 -0.08 -1.26 -3.44 116.55 123.93 2skd n ASP 181 Ca 0.20 -2.82 0.12 0.00 -1.51 0.00 0.00 54.79 50.77 2skd n ASP 181 Cb 0.46 -1.50 0.61 0.00 2.34 0.00 0.00 41.12 43.03 2skd n ASP 181 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 2skd h TRP 182 N 5.03 0.00 -0.01 -0.67 5.08 -1.91 -1.55 115.95 121.92 2skd h TRP 182 Ca 0.75 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.72 2skd h TRP 182 Cb 0.35 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.51 2skd h TRP 182 CO 1.71 0.00 -0.60 1.28 -1.28 0.00 0.00 178.44 179.54 2skd n LEU 183 N -2.29 1.47 -0.26 0.11 4.77 -1.26 -4.58 117.00 114.95 2skd n LEU 183 Ca -0.01 -0.55 0.03 0.00 -0.03 0.00 0.00 56.01 55.44 2skd n LEU 183 Cb 0.04 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2skd n LEU 183 CO 0.10 0.29 0.45 -1.14 -1.33 0.00 0.00 177.39 175.77 2skd n ARG 184 N -0.66 -0.10 0.00 3.23 0.63 -0.59 0.03 116.66 119.21 2skd n ARG 184 Ca 0.08 1.11 0.12 0.00 -0.92 0.00 0.00 57.85 58.24 2skd n ARG 184 Cb 0.40 -1.66 0.18 0.00 0.45 0.00 0.00 32.46 31.84 2skd n ARG 184 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2skd n TYR 185 N -5.13 0.00 0.00 -0.14 4.02 -1.26 -5.07 117.16 109.58 2skd n TYR 185 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.99 2skd n TYR 185 Cb 0.33 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.64 2skd n TYR 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2skd n GLY 186 N 1.33 2.49 2.93 2.72 0.00 0.11 -4.99 105.19 109.78 2skd n GLY 186 Ca 0.14 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 2skd n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2skd s ASN 187 N 0.00 4.18 0.00 1.61 3.84 -1.26 -4.85 114.94 118.46 2skd s ASN 187 Ca 0.00 -1.56 0.19 0.00 0.21 0.00 0.00 52.86 51.70 2skd s ASN 187 Cb 0.00 -1.27 0.82 0.00 -0.55 0.00 0.00 41.25 40.26 2skd s ASN 187 CO 0.00 -0.31 1.60 -0.81 -2.79 0.00 0.00 177.10 174.79 2skd n PRO 188 N 4.57 0.04 0.01 0.43 -0.04 -1.26 -3.66 135.00 135.09 2skd n PRO 188 Ca -0.06 0.17 -0.15 0.00 -0.04 0.00 0.00 63.50 63.42 2skd n PRO 188 Cb 0.43 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.25 2skd n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2skd h TRP 189 N 0.00 0.28 -4.30 0.54 4.06 -1.95 -3.48 115.95 111.09 2skd h TRP 189 Ca 0.00 -0.20 -0.50 0.00 2.06 0.00 0.00 58.89 60.25 2skd h TRP 189 Cb 0.30 -0.01 0.06 0.00 -1.00 0.00 0.00 29.16 28.50 2skd h TRP 189 CO 0.00 1.38 0.40 -1.83 -3.56 0.00 0.00 178.44 174.83 2skd s GLU 190 N -2.59 3.54 -0.19 0.49 -1.05 -1.24 -4.39 118.70 113.28 2skd s GLU 190 Ca -0.12 0.87 -0.02 0.00 -0.15 0.00 0.00 54.97 55.55 2skd s GLU 190 Cb 0.07 -2.07 0.06 0.00 -0.44 0.00 0.00 34.13 31.75 2skd s GLU 190 CO 0.81 -0.61 0.01 0.21 0.95 0.00 0.00 175.26 176.63 2skd s LYS 191 N -4.80 0.87 0.22 -4.83 2.47 0.03 -4.95 119.74 108.75 2skd s LYS 191 Ca 0.57 -0.49 -0.30 0.00 -1.56 0.00 0.00 55.97 54.19 2skd s LYS 191 Cb -0.12 -2.11 -0.10 0.00 -1.46 0.00 0.00 37.83 34.05 2skd s LYS 191 CO 0.47 -0.60 1.41 0.00 0.16 0.00 0.00 175.35 176.80 2skd s ALA 192 N 1.77 3.61 -0.56 3.13 0.00 -1.26 -1.46 121.76 126.98 2skd s ALA 192 Ca -0.01 1.26 0.06 0.00 0.00 0.00 0.00 51.96 53.27 2skd s ALA 192 Cb -0.17 -3.54 0.29 0.00 0.00 0.00 0.00 23.12 19.71 2skd s ALA 192 CO -0.07 -0.68 0.80 0.54 0.00 0.00 0.00 175.76 176.34 2skd n ARG 193 N 2.61 2.45 0.27 0.00 5.12 -0.26 -4.92 116.66 121.93 2skd n ARG 193 Ca 0.07 -4.46 0.18 0.00 -1.93 0.00 0.00 57.85 51.71 2skd n ARG 193 Cb 0.41 -2.08 0.92 0.00 -1.16 0.00 0.00 32.46 30.55 2skd n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2skd h PRO 194 N 3.59 0.00 0.00 5.56 0.13 -1.93 -1.24 132.00 138.11 2skd h PRO 194 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2skd h PRO 194 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2skd h PRO 194 CO 0.76 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.68 2skd n GLU 195 N -3.32 0.05 -0.79 0.86 0.00 -1.26 -2.72 120.64 113.47 2skd n GLU 195 Ca -0.00 0.23 -0.04 0.00 0.00 0.00 0.00 57.16 57.35 2skd n GLU 195 Cb 0.30 -1.59 0.20 0.00 0.00 0.00 0.00 31.44 30.35 2skd n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2skd n PHE 196 N -1.69 1.10 -2.13 -1.84 3.72 -0.47 -5.03 117.46 111.13 2skd n PHE 196 Ca 0.04 -1.56 -0.41 0.00 -0.05 0.00 0.00 57.45 55.47 2skd n PHE 196 Cb 0.23 -0.49 -0.03 0.00 -0.94 0.00 0.00 39.48 38.26 2skd n PHE 196 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2skd s THR 197 N -3.22 2.90 0.07 4.37 2.01 -1.10 -4.59 115.64 116.08 2skd s THR 197 Ca 0.45 0.79 0.08 0.00 0.31 0.00 0.00 61.69 63.32 2skd s THR 197 Cb 0.40 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 2skd s THR 197 CO 0.00 0.14 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.10 2skd s LEU 198 N -0.74 2.23 0.19 4.42 1.02 -0.38 -4.94 118.68 120.47 2skd s LEU 198 Ca 0.55 -0.61 -0.18 0.00 0.02 0.00 0.00 54.13 53.91 2skd s LEU 198 Cb -0.39 -1.01 -0.08 0.00 0.02 0.00 0.00 46.19 44.73 2skd s LEU 198 CO 0.44 0.14 0.66 -2.16 0.02 0.00 0.00 176.35 175.45 2skd s PRO 199 N -1.54 4.16 -0.03 1.29 0.04 -1.26 0.43 135.00 138.08 2skd s PRO 199 Ca 0.08 0.73 0.04 0.00 0.04 0.00 0.00 61.00 61.90 2skd s PRO 199 Cb -0.09 -2.92 -0.00 0.00 0.04 0.00 0.00 34.50 31.52 2skd s PRO 199 CO 0.03 0.44 -0.14 0.08 0.04 0.00 0.00 177.00 177.45 2skd s VAL 200 N -1.47 1.19 0.10 -0.36 1.01 0.13 -4.85 120.40 116.14 2skd s VAL 200 Ca 0.40 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.82 2skd s VAL 200 Cb -0.16 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2skd s VAL 200 CO 0.20 0.35 0.12 -1.00 0.00 0.00 0.00 175.10 174.77 2skd s HIS 201 N 0.05 3.24 0.04 5.22 3.76 -1.26 -0.99 115.29 125.35 2skd s HIS 201 Ca -0.02 0.08 -0.02 0.00 -0.15 0.00 0.00 55.06 54.95 2skd s HIS 201 Cb -0.10 -1.62 -0.03 0.00 1.11 0.00 0.00 32.58 31.95 2skd s HIS 201 CO 0.01 0.53 -0.00 -0.06 -0.85 0.00 0.00 174.74 174.37 2skd s PHE 202 N -1.51 0.36 0.00 1.40 0.08 -0.32 -4.95 117.98 113.05 2skd s PHE 202 Ca 0.31 -0.77 0.00 0.00 0.12 0.00 0.00 56.93 56.59 2skd s PHE 202 Cb -0.12 -0.27 0.00 0.00 -0.57 0.00 0.00 43.02 42.06 2skd s PHE 202 CO 0.23 -0.31 0.00 0.66 -0.10 0.00 0.00 175.22 175.70 2skd n TYR 203 N 0.75 0.00 -4.36 0.36 4.01 0.11 -0.43 117.16 117.60 2skd n TYR 203 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2skd n TYR 203 Cb 0.58 0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 2skd n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2skd n GLY 204 N 0.00 -0.47 3.61 2.72 0.00 -1.21 -4.54 105.19 105.31 2skd n GLY 204 Ca 0.00 -1.09 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 2skd n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2skd s ARG 205 N 0.00 1.76 -0.19 1.61 1.70 0.49 -4.88 118.95 119.44 2skd s ARG 205 Ca 0.00 -1.41 -0.02 0.00 -0.47 0.00 0.00 55.73 53.83 2skd s ARG 205 Cb 0.00 0.49 -0.00 0.00 -0.57 0.00 0.00 34.95 34.87 2skd s ARG 205 CO 0.00 -0.75 -0.09 0.08 -1.08 0.00 0.00 175.30 173.46 2skd s VAL 206 N -3.49 3.05 -0.19 4.99 1.01 -1.26 -0.57 120.40 123.94 2skd s VAL 206 Ca 0.23 -0.62 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 2skd s VAL 206 Cb -0.01 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2skd s VAL 206 CO 0.12 0.47 0.10 -1.61 0.00 0.00 0.00 175.10 174.18 2skd s GLU 207 N 1.22 4.08 -0.44 2.72 2.02 -0.17 -4.91 118.70 123.22 2skd s GLU 207 Ca 0.02 -0.26 -0.11 0.00 0.02 0.00 0.00 54.97 54.64 2skd s GLU 207 Cb -0.14 -3.33 0.09 0.00 0.10 0.00 0.00 34.13 30.84 2skd s GLU 207 CO -0.03 0.31 0.31 -1.01 0.02 0.00 0.00 175.26 174.86 2skd s HIS 208 N 0.31 3.33 -0.05 1.61 3.76 -1.26 0.60 115.29 123.58 2skd s HIS 208 Ca 0.06 -1.46 0.04 0.00 -0.15 0.00 0.00 55.06 53.55 2skd s HIS 208 Cb -0.12 -3.14 0.00 0.00 1.11 0.00 0.00 32.58 30.44 2skd s HIS 208 CO -0.01 -0.87 -0.17 0.95 -0.85 0.00 0.00 174.74 173.79 2skd s THR 209 N 1.46 1.42 0.00 1.30 -4.23 -0.82 -5.00 115.64 109.77 2skd s THR 209 Ca 0.04 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 2skd s THR 209 Cb -0.24 -1.24 0.00 0.00 1.34 0.00 0.00 72.50 72.36 2skd s THR 209 CO 0.02 0.41 0.00 -1.20 -0.54 0.00 0.00 174.62 173.32 2skd n SER 210 N 3.36 0.00 -3.38 3.99 7.64 -1.26 -2.00 113.62 121.97 2skd n SER 210 Ca -0.19 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.34 2skd n SER 210 Cb 0.53 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2skd n SER 210 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2skd n GLN 211 N 0.00 4.15 0.00 1.43 -0.06 -1.26 -5.04 117.38 116.60 2skd n GLN 211 Ca 0.00 -4.74 0.00 0.00 -2.00 0.00 0.00 57.00 50.26 2skd n GLN 211 Cb 0.00 -2.36 0.00 0.00 -4.06 0.00 0.00 30.24 23.82 2skd n GLN 211 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2skd n GLY 212 N 0.12 2.99 3.87 1.69 0.00 -0.85 -5.07 105.19 107.94 2skd n GLY 212 Ca 0.36 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.06 2skd n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2skd s ALA 213 N -2.76 3.33 -0.05 4.61 0.00 -1.26 -1.95 121.76 123.68 2skd s ALA 213 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2skd s ALA 213 Cb 0.00 -2.74 0.02 0.00 0.00 0.00 0.00 23.12 20.40 2skd s ALA 213 CO 0.00 0.06 -0.07 0.15 0.00 0.00 0.00 175.76 175.90 2skd s LYS 214 N -3.66 1.09 -0.33 0.00 1.02 0.20 -4.91 119.74 113.15 2skd s LYS 214 Ca 0.52 -0.19 -0.24 0.00 0.02 0.00 0.00 55.97 56.08 2skd s LYS 214 Cb -0.10 -1.03 0.01 0.00 -0.52 0.00 0.00 37.83 36.19 2skd s LYS 214 CO 0.28 -0.06 0.84 -0.46 -0.92 0.00 0.00 175.35 175.03 2skd s TRP 215 N 0.90 3.15 0.25 3.18 -0.00 -1.26 -1.00 118.94 124.16 2skd s TRP 215 Ca -0.11 0.77 0.07 0.00 -0.00 0.00 0.00 56.10 56.84 2skd s TRP 215 Cb -0.15 -3.39 -0.05 0.00 -0.00 0.00 0.00 33.47 29.88 2skd s TRP 215 CO 0.01 -0.68 -0.10 0.54 -0.00 0.00 0.00 176.95 176.73 2skd s VAL 216 N 3.15 1.71 -1.43 5.86 0.11 0.27 -4.83 120.40 125.23 2skd s VAL 216 Ca 0.34 -2.17 -0.06 0.00 -2.93 0.00 0.00 61.98 57.17 2skd s VAL 216 Cb -0.13 -2.29 0.04 0.00 -1.53 0.00 0.00 36.38 32.46 2skd s VAL 216 CO 0.15 -0.41 0.74 0.47 -3.33 0.00 0.00 175.10 172.72 2skd n ASP 217 N -0.51 -2.31 -4.94 3.54 8.00 -1.26 -0.38 116.55 118.69 2skd n ASP 217 Ca -0.06 -0.86 -0.25 0.00 0.71 0.00 0.00 54.79 54.33 2skd n ASP 217 Cb 0.62 -3.69 0.02 0.00 -0.02 0.00 0.00 41.12 38.05 2skd n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2skd s THR 218 N -3.58 3.83 -0.18 -3.53 -4.23 -1.26 -3.28 115.64 103.40 2skd s THR 218 Ca 0.27 -0.25 -0.10 0.00 -1.18 0.00 0.00 61.69 60.43 2skd s THR 218 Cb -0.14 -3.47 -0.05 0.00 1.34 0.00 0.00 72.50 70.19 2skd s THR 218 CO 0.84 -0.40 0.16 -1.58 -0.54 0.00 0.00 174.62 173.09 2skd s GLN 219 N -4.77 4.11 -0.19 3.99 0.74 0.42 -4.89 119.66 119.07 2skd s GLN 219 Ca 0.51 -0.16 -0.08 0.00 0.05 0.00 0.00 55.36 55.67 2skd s GLN 219 Cb -0.10 -3.39 -0.04 0.00 1.10 0.00 0.00 33.01 30.57 2skd s GLN 219 CO 0.41 0.35 0.09 0.08 -0.55 0.00 0.00 175.29 175.67 2skd s VAL 220 N 0.21 5.00 -0.03 1.34 1.01 -1.26 -1.17 120.40 125.49 2skd s VAL 220 Ca 0.10 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.19 2skd s VAL 220 Cb -0.11 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 2skd s VAL 220 CO -0.00 0.44 -0.23 -0.69 0.00 0.00 0.00 175.10 174.62 2skd s VAL 221 N 0.47 1.81 0.06 2.92 1.01 -0.16 -4.38 120.40 122.13 2skd s VAL 221 Ca 0.05 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 2skd s VAL 221 Cb -0.12 -1.52 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 2skd s VAL 221 CO 0.00 0.51 0.40 -0.76 0.00 0.00 0.00 175.10 175.25 2skd s LEU 222 N -0.33 4.38 -0.30 3.92 1.43 0.76 0.22 118.68 128.75 2skd s LEU 222 Ca 0.03 0.83 -0.03 0.00 -1.03 0.00 0.00 54.13 53.93 2skd s LEU 222 Cb -0.11 -2.89 0.04 0.00 0.03 0.00 0.00 46.19 43.27 2skd s LEU 222 CO 0.01 0.21 0.02 0.00 0.23 0.00 0.00 176.35 176.82 2skd s ALA 223 N -1.32 2.88 -0.24 4.21 0.00 0.17 -0.36 121.76 127.09 2skd s ALA 223 Ca 0.31 -1.69 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 2skd s ALA 223 Cb -0.15 -2.00 -0.05 0.00 0.00 0.00 0.00 23.12 20.92 2skd s ALA 223 CO 0.17 -1.19 0.18 1.41 0.00 0.00 0.00 175.76 176.32 2skd s MET 224 N 1.32 4.06 0.37 0.00 1.75 0.47 -1.25 119.30 126.02 2skd s MET 224 Ca -0.03 -0.25 -0.13 0.00 -1.25 0.00 0.00 55.69 54.03 2skd s MET 224 Cb -0.19 -3.56 -0.08 0.00 2.84 0.00 0.00 34.83 33.85 2skd s MET 224 CO -0.00 0.02 0.77 -1.25 -0.65 0.00 0.00 175.02 173.90 2skd s PRO 225 N 1.17 3.90 -0.07 4.11 0.04 -1.26 -0.39 135.00 142.50 2skd s PRO 225 Ca 0.08 0.60 -0.01 0.00 0.04 0.00 0.00 61.00 61.71 2skd s PRO 225 Cb -0.14 -2.39 0.03 0.00 0.04 0.00 0.00 34.50 32.03 2skd s PRO 225 CO 0.06 0.05 -0.01 0.71 0.04 0.00 0.00 177.00 177.84 2skd s TYR 226 N -2.19 0.78 -0.15 0.56 1.51 -0.19 -1.10 117.35 116.57 2skd s TYR 226 Ca 0.53 -0.24 -0.08 0.00 -1.01 0.00 0.00 57.07 56.26 2skd s TYR 226 Cb -0.10 -0.84 -0.04 0.00 -0.11 0.00 0.00 41.96 40.86 2skd s TYR 226 CO 0.24 -0.34 0.13 -0.51 -1.11 0.00 0.00 175.55 173.97 2skd s ASP 227 N 1.82 6.31 -0.08 2.29 1.01 -0.54 -0.83 116.67 126.65 2skd s ASP 227 Ca 0.03 0.36 0.04 0.00 0.71 0.00 0.00 52.55 53.70 2skd s ASP 227 Cb -0.12 -2.08 0.00 0.00 1.01 0.00 0.00 42.92 41.73 2skd s ASP 227 CO -0.05 0.31 -0.21 -0.89 0.21 0.00 0.00 175.17 174.54 2skd s THR 228 N -0.43 1.78 0.31 -1.27 2.01 -0.04 -0.79 115.64 117.21 2skd s THR 228 Ca 0.12 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 2skd s THR 228 Cb -0.12 -1.55 -0.10 0.00 0.01 0.00 0.00 72.50 70.75 2skd s THR 228 CO 0.01 0.50 1.17 -2.16 -0.69 0.00 0.00 174.62 173.46 2skd s PRO 229 N 0.28 4.47 -0.41 4.92 0.04 -1.26 -1.19 135.00 141.85 2skd s PRO 229 Ca -0.13 1.94 0.02 0.00 0.04 0.00 0.00 61.00 62.87 2skd s PRO 229 Cb -0.16 -3.08 0.12 0.00 0.04 0.00 0.00 34.50 31.42 2skd s PRO 229 CO 0.06 0.02 0.17 0.08 0.04 0.00 0.00 177.00 177.37 2skd s VAL 230 N -1.19 1.79 0.16 -0.36 1.01 -0.10 -4.91 120.40 116.81 2skd s VAL 230 Ca 0.48 -2.46 -0.30 0.00 0.00 0.00 0.00 61.98 59.70 2skd s VAL 230 Cb -0.34 -2.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.68 2skd s VAL 230 CO 0.44 -0.76 1.00 -2.16 0.00 0.00 0.00 175.10 173.63 2skd s PRO 231 N 0.58 4.70 0.82 2.72 0.04 -1.26 -0.41 135.00 142.19 2skd s PRO 231 Ca 0.14 1.55 -0.12 0.00 0.04 0.00 0.00 61.00 62.62 2skd s PRO 231 Cb -0.22 -3.32 0.08 0.00 0.04 0.00 0.00 34.50 31.08 2skd s PRO 231 CO -0.07 0.24 1.15 0.20 0.04 0.00 0.00 177.00 178.56 2skd s GLY 232 N -0.32 1.59 -0.58 0.56 0.00 0.20 -4.77 107.32 104.00 2skd s GLY 232 Ca 0.46 -0.54 -0.28 0.00 0.00 0.00 0.00 44.72 44.36 2skd s GLY 232 CO 0.32 -0.06 1.27 -0.47 0.00 0.00 0.00 173.10 174.17 2skd s TYR 233 N -3.44 2.48 -1.54 1.90 5.04 -1.26 -4.20 117.35 116.33 2skd s TYR 233 Ca 0.62 0.42 -0.15 0.00 -2.44 0.00 0.00 57.07 55.52 2skd s TYR 233 Cb -0.12 -4.48 0.12 0.00 0.35 0.00 0.00 41.96 37.83 2skd s TYR 233 CO 0.51 -1.75 0.75 0.54 -1.34 0.00 0.00 175.55 174.26 2skd n ARG 234 N 8.55 -3.79 0.00 4.97 3.00 0.34 -4.84 116.66 124.90 2skd n ARG 234 Ca 0.10 0.45 0.00 0.00 -0.01 0.00 0.00 57.85 58.39 2skd n ARG 234 Cb 0.49 -5.22 0.00 0.00 0.00 0.00 0.00 32.46 27.73 2skd n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2skd n ASN 235 N -2.58 1.02 -0.72 0.55 2.04 -1.26 -4.95 115.26 109.36 2skd n ASN 235 Ca 0.05 -1.38 -0.09 0.00 -0.44 0.00 0.00 54.58 52.71 2skd n ASN 235 Cb 0.51 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.72 2skd n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2skd n ASN 236 N -0.19 -4.62 -4.69 0.53 3.02 -1.26 0.00 115.26 108.05 2skd n ASN 236 Ca 0.00 0.23 -0.36 0.00 -0.03 0.00 0.00 54.58 54.42 2skd n ASN 236 Cb 0.24 -2.95 -0.09 0.00 -0.61 0.00 0.00 39.78 36.37 2skd n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2skd s VAL 237 N -2.19 5.37 -0.29 2.41 1.01 -1.26 -4.71 120.40 120.74 2skd s VAL 237 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2skd s VAL 237 Cb 0.00 -3.50 0.09 0.00 0.00 0.00 0.00 36.38 32.97 2skd s VAL 237 CO 0.00 0.38 0.06 -0.69 0.00 0.00 0.00 175.10 174.85 2skd s VAL 238 N 0.74 1.23 0.70 2.92 1.01 -1.26 0.58 120.40 126.31 2skd s VAL 238 Ca 0.09 -1.48 -0.08 0.00 0.00 0.00 0.00 61.98 60.50 2skd s VAL 238 Cb -0.12 -1.83 0.15 0.00 0.00 0.00 0.00 36.38 34.58 2skd s VAL 238 CO 0.02 -0.52 0.95 0.59 0.00 0.00 0.00 175.10 176.13 2skd n ASN 239 N 4.72 0.43 -4.20 3.32 3.02 0.45 -4.66 115.26 118.34 2skd n ASN 239 Ca -0.03 -1.56 -0.26 0.00 -0.03 0.00 0.00 54.58 52.70 2skd n ASN 239 Cb 0.43 -0.69 -0.15 0.00 -0.61 0.00 0.00 39.78 38.75 2skd n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2skd s THR 240 N -2.95 1.52 -0.29 3.41 2.01 -1.26 -0.92 115.64 117.16 2skd s THR 240 Ca 0.56 -0.82 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2skd s THR 240 Cb -0.02 -1.26 0.04 0.00 0.01 0.00 0.00 72.50 71.27 2skd s THR 240 CO 0.39 0.43 -0.01 -0.32 -0.69 0.00 0.00 174.62 174.42 2skd s MET 241 N -0.44 2.51 -0.27 4.92 1.75 -0.33 -1.74 119.30 125.70 2skd s MET 241 Ca 0.07 -1.21 -0.10 0.00 -1.25 0.00 0.00 55.69 53.20 2skd s MET 241 Cb -0.08 -3.15 -0.05 0.00 2.84 0.00 0.00 34.83 34.40 2skd s MET 241 CO -0.01 -0.58 0.17 0.50 -0.65 0.00 0.00 175.02 174.46 2skd s ARG 242 N 1.27 3.95 -0.16 4.11 3.52 0.17 -0.87 118.95 130.94 2skd s ARG 242 Ca -0.04 -0.32 -0.01 0.00 -0.13 0.00 0.00 55.73 55.22 2skd s ARG 242 Cb -0.19 -3.60 -0.01 0.00 -1.56 0.00 0.00 34.95 29.59 2skd s ARG 242 CO -0.02 -0.12 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.73 2skd s LEU 243 N 1.57 2.72 0.18 -0.88 1.02 -0.01 -1.94 118.68 121.33 2skd s LEU 243 Ca 0.07 -0.37 -0.18 0.00 0.02 0.00 0.00 54.13 53.67 2skd s LEU 243 Cb -0.15 -1.63 -0.08 0.00 0.02 0.00 0.00 46.19 44.35 2skd s LEU 243 CO 0.09 0.10 0.66 0.26 0.02 0.00 0.00 176.35 177.48 2skd s TRP 244 N 0.72 3.66 -0.01 0.29 0.52 -0.32 -1.02 118.94 122.79 2skd s TRP 244 Ca -0.05 1.28 0.07 0.00 0.02 0.00 0.00 56.10 57.42 2skd s TRP 244 Cb -0.15 -2.53 -0.02 0.00 -1.15 0.00 0.00 33.47 29.62 2skd s TRP 244 CO 0.02 0.40 -0.22 0.45 0.02 0.00 0.00 176.95 177.62 2skd s SER 245 N -1.60 2.53 0.08 2.95 0.15 0.48 -0.67 113.70 117.61 2skd s SER 245 Ca 0.40 -0.40 -0.26 0.00 0.70 0.00 0.00 55.95 56.39 2skd s SER 245 Cb -0.17 -0.28 -0.06 0.00 -1.71 0.00 0.00 66.02 63.81 2skd s SER 245 CO 0.20 0.26 0.80 0.00 1.20 0.00 0.00 173.24 175.70 2skd s ALA 246 N -0.53 3.37 0.01 5.45 0.00 -1.26 -0.39 121.76 128.41 2skd s ALA 246 Ca 0.08 0.34 0.01 0.00 0.00 0.00 0.00 51.96 52.39 2skd s ALA 246 Cb -0.08 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 2skd s ALA 246 CO -0.01 0.09 -0.03 0.15 0.00 0.00 0.00 175.76 175.97 2skd s LYS 247 N -0.25 0.27 0.12 0.00 -0.14 0.51 -4.67 119.74 115.59 2skd s LYS 247 Ca 0.39 -0.39 -0.16 0.00 -1.36 0.00 0.00 55.97 54.46 2skd s LYS 247 Cb -0.21 -0.07 -0.07 0.00 -1.68 0.00 0.00 37.83 35.80 2skd s LYS 247 CO 0.25 0.01 0.55 0.00 -0.76 0.00 0.00 175.35 175.40 2skd s ALA 248 N -0.80 3.58 0.63 5.17 0.00 -1.26 -0.17 121.76 128.90 2skd s ALA 248 Ca -0.07 -0.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.65 2skd s ALA 248 Cb -0.06 -2.55 -0.02 0.00 0.00 0.00 0.00 23.12 20.49 2skd s ALA 248 CO -0.00 0.44 1.10 -1.25 0.00 0.00 0.00 175.76 176.04 2skd s PRO 249 N -1.69 3.00 0.00 0.00 0.04 -1.26 -4.87 135.00 130.22 2skd s PRO 249 Ca 0.35 1.37 0.27 0.00 0.04 0.00 0.00 61.00 63.03 2skd s PRO 249 Cb -0.16 -1.98 0.92 0.00 0.04 0.00 0.00 34.50 33.32 2skd s PRO 249 CO 0.19 -1.09 1.67 0.27 0.04 0.00 0.00 177.00 178.08 2skd n ASN 250 N -2.18 0.95 0.00 6.66 6.94 -1.26 -4.00 115.26 122.37 2skd n ASN 250 Ca 0.10 -0.90 0.00 0.00 -0.02 0.00 0.00 54.58 53.76 2skd n ASN 250 Cb 0.52 0.07 0.00 0.00 -2.36 0.00 0.00 39.78 38.01 2skd n ASN 250 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2skd n ASP 251 N -0.61 0.00 -0.47 0.53 5.75 -1.26 -4.55 116.55 115.94 2skd n ASP 251 Ca 0.14 0.00 0.39 0.00 -0.01 0.00 0.00 54.79 55.31 2skd n ASP 251 Cb 0.33 0.00 0.67 0.00 -1.03 0.00 0.00 41.12 41.09 2skd n ASP 251 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 2skd h PHE 252 N 0.00 0.50 0.00 2.11 0.04 -1.90 1.67 116.94 119.35 2skd h PHE 252 Ca 0.00 0.02 -0.29 0.00 2.80 0.00 0.00 57.97 60.50 2skd h PHE 252 Cb 0.00 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 37.99 2skd h PHE 252 CO 0.00 -0.24 0.63 -1.71 -0.60 0.00 0.00 178.31 176.39 2skd n ASN 253 N -4.69 5.78 0.00 2.17 5.15 -1.26 -2.81 115.26 119.61 2skd n ASN 253 Ca 0.39 -2.46 0.00 0.00 -0.60 0.00 0.00 54.58 51.91 2skd n ASN 253 Cb 1.52 -1.39 0.00 0.00 -0.53 0.00 0.00 39.78 39.39 2skd n ASN 253 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2skd n LEU 254 N 2.80 0.00 0.23 1.20 -0.00 0.44 -4.71 117.00 116.95 2skd n LEU 254 Ca 0.49 0.00 0.14 0.00 -0.00 0.00 0.00 56.01 56.64 2skd n LEU 254 Cb 0.72 0.00 0.34 0.00 -0.00 0.00 0.00 43.42 44.48 2skd n LEU 254 CO 0.30 0.00 0.87 0.50 -0.00 0.00 0.00 177.39 179.06 2skd h LYS 255 N 0.00 0.00 -5.84 1.96 3.64 0.24 -3.41 116.57 113.16 2skd h LYS 255 Ca 0.00 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.00 2skd h LYS 255 Cb 0.00 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 2skd h LYS 255 CO 0.00 0.00 0.96 0.34 -2.27 0.00 0.00 179.45 178.48 2skd s ASP 256 N -5.93 5.35 0.99 4.20 -1.08 -1.12 -4.90 116.67 114.18 2skd s ASP 256 Ca 0.05 -0.52 -0.17 0.00 -0.52 0.00 0.00 52.55 51.40 2skd s ASP 256 Cb 0.07 -2.55 0.22 0.00 -1.46 0.00 0.00 42.92 39.19 2skd s ASP 256 CO 0.62 -2.50 1.35 0.72 0.52 0.00 0.00 175.17 175.88 2skd s PHE 257 N 9.18 1.37 0.00 -5.34 -0.71 -1.26 -4.92 117.98 116.30 2skd s PHE 257 Ca 0.66 0.24 0.00 0.00 -1.04 0.00 0.00 56.93 56.79 2skd s PHE 257 Cb -0.07 -4.22 0.00 0.00 -1.21 0.00 0.00 43.02 37.52 2skd s PHE 257 CO 0.04 -2.79 0.00 0.09 -1.34 0.00 0.00 175.22 171.22 2skd n ASN 258 N -3.84 -0.39 -1.13 1.98 4.13 -1.26 -5.06 115.26 109.69 2skd n ASN 258 Ca 0.16 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.42 2skd n ASN 258 Cb 0.59 -0.13 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 2skd n ASN 258 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2skd n VAL 259 N -0.26 -3.21 0.00 2.41 0.31 -1.26 -5.04 118.33 111.28 2skd n VAL 259 Ca 0.00 1.43 0.00 0.00 -0.01 0.00 0.00 64.34 65.76 2skd n VAL 259 Cb 0.10 -2.10 0.00 0.00 -0.91 0.00 0.00 33.84 30.93 2skd n VAL 259 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2skd n GLY 260 N -1.53 1.77 0.00 2.92 0.00 -1.26 -5.10 105.19 101.99 2skd n GLY 260 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2skd n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2skd n GLY 261 N 0.00 3.74 0.15 -0.02 0.00 -1.26 -4.77 105.19 103.03 2skd n GLY 261 Ca 0.00 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 2skd n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2skd h TYR 262 N 0.00 0.48 -0.11 1.61 3.20 -1.99 -1.63 116.97 118.54 2skd h TYR 262 Ca 0.00 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.77 2skd h TYR 262 Cb 0.00 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2skd h TYR 262 CO 0.00 0.65 0.07 0.82 -1.64 0.00 0.00 178.16 178.06 2skd h ILE 263 N 0.18 1.07 -0.61 1.81 1.08 -2.00 -2.43 117.51 116.61 2skd h ILE 263 Ca 0.06 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.35 2skd h ILE 263 Cb 0.49 0.99 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 2skd h ILE 263 CO 0.02 0.06 0.39 1.56 -0.69 0.00 0.00 178.15 179.50 2skd h GLN 264 N 0.11 0.81 -0.53 2.37 1.08 -1.85 -0.87 115.11 116.24 2skd h GLN 264 Ca 0.04 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 2skd h GLN 264 Cb 0.04 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.27 2skd h GLN 264 CO -0.01 0.55 0.29 0.00 -0.95 0.00 0.00 178.83 178.71 2skd h ALA 265 N 1.60 0.68 -0.39 3.87 0.00 -0.99 0.15 119.26 124.18 2skd h ALA 265 Ca 0.22 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 2skd h ALA 265 Cb -0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2skd h ALA 265 CO -0.05 0.20 -0.27 0.28 0.00 0.00 0.00 179.25 179.42 2skd h VAL 266 N 0.71 1.27 0.00 0.00 2.07 -0.88 -2.81 116.25 116.61 2skd h VAL 266 Ca 0.19 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.22 2skd h VAL 266 Cb 0.05 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2skd h VAL 266 CO -0.03 0.47 -0.40 -0.07 0.02 0.00 0.00 177.57 177.56 2skd h LEU 267 N 0.70 0.00 0.00 2.57 3.38 -0.88 -2.83 115.31 118.24 2skd h LEU 267 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2skd h LEU 267 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2skd h LEU 267 CO 0.07 0.40 0.00 0.47 0.09 0.00 0.00 178.44 179.46 2skd n ASP 268 N -3.65 0.00 0.25 -0.43 8.00 0.50 -3.16 116.55 118.06 2skd n ASP 268 Ca -0.01 0.06 0.08 0.00 0.71 0.00 0.00 54.79 55.63 2skd n ASP 268 Cb 0.50 -0.33 0.62 0.00 -0.02 0.00 0.00 41.12 41.89 2skd n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2skd h ARG 269 N 0.00 0.00 -3.74 -1.24 3.08 -1.48 -3.13 114.38 107.87 2skd h ARG 269 Ca 0.00 0.00 -0.71 0.00 0.07 0.00 0.00 59.98 59.34 2skd h ARG 269 Cb 0.26 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 2skd h ARG 269 CO 0.00 0.07 3.14 0.09 -1.07 0.00 0.00 179.97 182.20 2skd n ASN 270 N -4.34 4.95 0.00 7.04 3.02 -1.19 -2.06 115.26 122.68 2skd n ASN 270 Ca -0.03 -2.83 0.00 0.00 -0.03 0.00 0.00 54.58 51.70 2skd n ASN 270 Cb 0.15 -1.62 0.00 0.00 -0.61 0.00 0.00 39.78 37.70 2skd n ASN 270 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2skd n LEU 271 N 5.33 0.00 -0.03 3.41 7.94 -1.18 -4.72 117.00 127.75 2skd n LEU 271 Ca 0.56 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 55.37 2skd n LEU 271 Cb 0.36 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.16 2skd n LEU 271 CO 0.88 0.00 -0.62 0.00 -1.11 0.00 0.00 177.39 176.54 2skd n ALA 272 N -0.92 1.49 0.88 1.96 0.00 -0.88 -3.95 120.51 119.09 2skd n ALA 272 Ca 0.00 -0.85 0.13 0.00 0.00 0.00 0.00 53.44 52.72 2skd n ALA 272 Cb 0.00 -0.75 0.48 0.00 0.00 0.00 0.00 19.45 19.18 2skd n ALA 272 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2skd n GLU 273 N -3.00 0.08 0.07 0.00 1.02 -1.11 -3.36 120.64 114.34 2skd n GLU 273 Ca -0.19 0.06 0.10 0.00 -0.02 0.00 0.00 57.16 57.11 2skd n GLU 273 Cb 1.07 -1.59 0.42 0.00 -0.02 0.00 0.00 31.44 31.32 2skd n GLU 273 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2skd n ASN 274 N -1.73 0.39 -0.17 1.62 3.02 -1.25 -3.12 115.26 114.01 2skd n ASN 274 Ca 0.06 0.59 0.03 0.00 -0.03 0.00 0.00 54.58 55.23 2skd n ASN 274 Cb 0.37 -0.68 0.31 0.00 -0.61 0.00 0.00 39.78 39.17 2skd n ASN 274 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2skd h ILE 275 N 0.00 1.12 -0.27 2.41 2.04 -1.79 -2.63 117.51 118.39 2skd h ILE 275 Ca 0.00 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2skd h ILE 275 Cb 0.34 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2skd h ILE 275 CO 0.00 0.16 -0.00 -1.54 0.00 0.00 0.00 178.15 176.77 2skd n SER 276 N -4.45 3.70 -0.03 1.72 3.41 -1.18 -4.70 113.62 112.08 2skd n SER 276 Ca 0.08 -3.10 -0.16 0.00 -0.26 0.00 0.00 58.87 55.43 2skd n SER 276 Cb 0.10 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.42 2skd n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2skd h ARG 277 N 1.65 0.64 -3.05 4.33 9.65 -1.57 -2.79 114.38 123.24 2skd h ARG 277 Ca 0.03 -0.51 -0.15 0.00 -1.10 0.00 0.00 59.98 58.25 2skd h ARG 277 Cb 1.47 0.10 -0.24 0.00 -1.39 0.00 0.00 29.97 29.91 2skd h ARG 277 CO 0.24 1.13 -0.36 0.54 2.80 0.00 0.00 179.97 184.32 2skd s VAL 278 N -3.74 0.01 0.23 0.20 0.11 -1.26 -1.78 120.40 114.17 2skd s VAL 278 Ca -0.12 -0.12 -0.30 0.00 -2.93 0.00 0.00 61.98 58.51 2skd s VAL 278 Cb 0.07 -0.45 -0.09 0.00 -1.53 0.00 0.00 36.38 34.38 2skd s VAL 278 CO 0.86 -0.07 0.97 -0.22 -3.33 0.00 0.00 175.10 173.31 2skd s LEU 279 N -0.19 4.62 -0.07 2.54 2.96 -1.00 -5.00 118.68 122.54 2skd s LEU 279 Ca -0.03 1.97 -0.30 0.00 -0.22 0.00 0.00 54.13 55.55 2skd s LEU 279 Cb -0.03 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 2skd s LEU 279 CO 0.01 0.09 1.28 -0.31 -1.32 0.00 0.00 176.35 176.09 2skd s TYR 280 N -1.00 2.99 -0.02 5.38 1.51 -1.26 -4.86 117.35 120.08 2skd s TYR 280 Ca 0.42 1.04 0.00 0.00 -1.01 0.00 0.00 57.07 57.52 2skd s TYR 280 Cb -0.26 -3.51 0.00 0.00 -0.11 0.00 0.00 41.96 38.07 2skd s TYR 280 CO 0.33 -1.75 0.93 -0.35 -1.11 0.00 0.00 175.55 173.60 2skd n PRO 281 N 5.65 0.94 -3.43 -1.71 -0.04 -1.26 -4.89 135.00 130.27 2skd n PRO 281 Ca 0.12 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.21 2skd n PRO 281 Cb 0.45 -1.04 -0.07 0.00 -0.04 0.00 0.00 33.50 32.81 2skd n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2skd s ASN 282 N 0.98 6.52 -0.20 3.54 0.01 -1.26 -4.49 114.94 120.04 2skd s ASN 282 Ca 0.00 0.62 -0.02 0.00 -0.71 0.00 0.00 52.86 52.74 2skd s ASN 282 Cb 0.00 -2.23 -0.00 0.00 0.41 0.00 0.00 41.25 39.43 2skd s ASN 282 CO 0.00 0.03 -0.09 -0.62 -1.51 0.00 0.00 177.10 174.91 2skd s ASP 283 N 0.65 3.97 -1.35 -1.22 -1.08 -1.26 -4.64 116.67 111.74 2skd s ASP 283 Ca 0.20 -0.45 -0.01 0.00 -0.52 0.00 0.00 52.55 51.77 2skd s ASP 283 Cb -0.14 -1.66 0.00 0.00 -1.46 0.00 0.00 42.92 39.66 2skd s ASP 283 CO 0.07 -0.00 0.61 0.59 0.52 0.00 0.00 175.17 176.96 2skd n ASN 284 N 4.66 -0.99 -3.64 -0.34 3.02 -1.26 -4.97 115.26 111.74 2skd n ASN 284 Ca -0.19 -0.88 -0.08 0.00 -0.03 0.00 0.00 54.58 53.39 2skd n ASN 284 Cb 0.51 -3.69 -0.07 0.00 -0.61 0.00 0.00 39.78 35.91 2skd n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2skd s PHE 285 N -3.76 -1.00 -0.20 3.10 5.36 -1.26 -4.36 117.98 115.86 2skd s PHE 285 Ca 0.03 2.05 -0.10 0.00 -0.96 0.00 0.00 56.93 57.95 2skd s PHE 285 Cb -0.02 0.57 -0.05 0.00 -0.34 0.00 0.00 43.02 43.18 2skd s PHE 285 CO 0.84 -0.50 0.13 0.12 -1.46 0.00 0.00 175.22 174.35 2skd s PHE 286 N 1.45 3.40 -0.22 10.12 5.36 0.13 -4.86 117.98 133.36 2skd s PHE 286 Ca -0.09 0.32 0.02 0.00 -0.96 0.00 0.00 56.93 56.23 2skd s PHE 286 Cb -0.05 -2.17 0.04 0.00 -0.34 0.00 0.00 43.02 40.51 2skd s PHE 286 CO -0.17 0.28 -0.13 -1.21 -1.46 0.00 0.00 175.22 172.53 2skd s GLU 287 N 0.40 2.37 -1.47 10.12 2.02 -1.26 -4.97 118.70 125.91 2skd s GLU 287 Ca 0.08 -1.07 -0.10 0.00 0.02 0.00 0.00 54.97 53.90 2skd s GLU 287 Cb -0.11 -2.67 0.03 0.00 0.10 0.00 0.00 34.13 31.47 2skd s GLU 287 CO -0.02 -0.44 2.50 0.41 0.02 0.00 0.00 175.26 177.74 2skd n GLY 288 N 4.55 4.60 3.92 -1.39 0.00 -1.26 -4.92 105.19 110.69 2skd n GLY 288 Ca -0.16 -1.74 -0.29 0.00 0.00 0.00 0.00 46.02 43.83 2skd n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2skd s LYS 289 N 1.35 3.51 0.26 1.61 -0.14 -1.26 -5.00 119.74 120.07 2skd s LYS 289 Ca 0.57 -0.36 -0.03 0.00 -1.36 0.00 0.00 55.97 54.79 2skd s LYS 289 Cb 0.16 -2.92 0.34 0.00 -1.68 0.00 0.00 37.83 33.73 2skd s LYS 289 CO -0.07 0.49 1.81 1.49 -0.76 0.00 0.00 175.35 178.32 2skd h GLU 290 N 2.49 0.93 -1.01 1.68 4.81 -2.00 -2.82 114.58 118.65 2skd h GLU 290 Ca -0.47 -0.18 0.05 0.00 -0.13 0.00 0.00 59.36 58.63 2skd h GLU 290 Cb 1.18 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 30.35 2skd h GLU 290 CO 0.71 0.81 0.66 1.25 -0.73 0.00 0.00 179.01 181.70 2skd h LEU 291 N 0.90 1.08 0.17 1.64 5.85 -1.98 -1.48 115.31 121.49 2skd h LEU 291 Ca 0.20 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 2skd h LEU 291 Cb 0.27 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.07 2skd h LEU 291 CO -0.01 0.71 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.63 2skd h ARG 292 N 1.23 -0.23 -1.00 1.25 1.12 -1.86 -1.85 114.38 113.05 2skd h ARG 292 Ca 0.42 0.02 0.11 0.00 -1.11 0.00 0.00 59.98 59.41 2skd h ARG 292 Cb 0.08 0.05 -0.08 0.00 -0.01 0.00 0.00 29.97 30.01 2skd h ARG 292 CO -0.15 -0.04 0.64 1.25 -3.11 0.00 0.00 179.97 178.56 2skd h LEU 293 N -0.38 0.95 -1.05 3.80 5.85 -1.35 0.13 115.31 123.26 2skd h LEU 293 Ca -0.02 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 2skd h LEU 293 Cb 0.29 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2skd h LEU 293 CO 0.04 0.53 -0.18 0.11 -0.34 0.00 0.00 178.44 178.60 2skd h LYS 294 N 1.03 0.46 -0.32 1.25 1.57 -1.05 -1.37 116.57 118.15 2skd h LYS 294 Ca 0.48 -0.15 -0.13 0.00 -1.87 0.00 0.00 60.65 58.99 2skd h LYS 294 Cb 0.41 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2skd h LYS 294 CO -0.24 0.63 -0.29 1.96 -0.57 0.00 0.00 179.45 180.94 2skd h GLN 295 N 0.42 0.77 -0.79 3.15 4.20 -0.23 -1.22 115.11 121.40 2skd h GLN 295 Ca 0.07 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.38 2skd h GLN 295 Cb 0.56 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 2skd h GLN 295 CO 0.04 1.02 0.46 0.93 -0.67 0.00 0.00 178.83 180.60 2skd h GLU 296 N 0.54 1.09 0.04 1.46 5.08 -0.72 -2.12 114.58 119.95 2skd h GLU 296 Ca 0.06 -0.11 -0.25 0.00 -1.00 0.00 0.00 59.36 58.06 2skd h GLU 296 Cb 0.86 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.89 2skd h GLU 296 CO 0.07 0.79 -1.04 -0.92 -1.00 0.00 0.00 179.01 176.91 2skd h TYR 297 N 1.09 0.66 -0.56 4.33 3.20 -1.24 -3.10 116.97 121.36 2skd h TYR 297 Ca 0.28 -0.39 0.05 0.00 3.14 0.00 0.00 58.73 61.82 2skd h TYR 297 Cb -0.01 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.15 2skd h TYR 297 CO -0.00 1.23 0.29 0.35 -1.64 0.00 0.00 178.16 178.38 2skd h PHE 298 N 0.22 0.52 -0.17 -3.82 3.57 -1.01 0.36 116.94 116.61 2skd h PHE 298 Ca -0.11 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.24 2skd h PHE 298 Cb 1.70 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 40.28 2skd h PHE 298 CO 0.07 0.25 -0.61 -0.24 -2.23 0.00 0.00 178.31 175.55 2skd h VAL 299 N 0.55 1.32 0.01 1.41 3.04 -1.47 -2.86 116.25 118.24 2skd h VAL 299 Ca 0.25 -1.87 -0.00 0.00 -1.01 0.00 0.00 66.70 64.07 2skd h VAL 299 Cb 0.17 1.84 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 2skd h VAL 299 CO -0.18 0.58 -0.01 0.58 -1.01 0.00 0.00 177.57 177.54 2skd h VAL 300 N 0.44 1.28 -0.05 1.51 2.07 -1.38 -2.42 116.25 117.70 2skd h VAL 300 Ca -0.00 -0.90 0.02 0.00 0.82 0.00 0.00 66.70 66.63 2skd h VAL 300 Cb 1.17 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.81 2skd h VAL 300 CO 0.12 0.23 -0.04 0.00 0.02 0.00 0.00 177.57 177.90 2skd h ALA 301 N 0.57 0.01 -0.35 1.67 0.00 -0.37 -1.88 119.26 118.91 2skd h ALA 301 Ca -0.00 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2skd h ALA 301 Cb 0.39 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2skd h ALA 301 CO 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 179.25 178.74 2skd h ALA 302 N 1.00 0.47 -0.57 0.00 0.00 -1.60 -3.10 119.26 115.45 2skd h ALA 302 Ca 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2skd h ALA 302 Cb 0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2skd h ALA 302 CO -0.08 0.22 0.35 1.15 0.00 0.00 0.00 179.25 180.89 2skd h THR 303 N 0.42 1.17 -0.46 0.00 2.02 -1.40 -2.88 112.91 111.78 2skd h THR 303 Ca 0.10 -0.35 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 2skd h THR 303 Cb 0.44 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2skd h THR 303 CO 0.02 0.17 0.03 -0.07 0.37 0.00 0.00 175.52 176.03 2skd h LEU 304 N 0.77 0.69 -0.93 2.58 3.38 -1.35 -0.23 115.31 120.23 2skd h LEU 304 Ca 0.21 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2skd h LEU 304 Cb -0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2skd h LEU 304 CO -0.04 0.74 0.18 1.56 0.09 0.00 0.00 178.44 180.97 2skd h GLN 305 N 0.69 0.96 -0.41 1.13 4.20 -1.45 -0.40 115.11 119.83 2skd h GLN 305 Ca 0.14 -0.20 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 2skd h GLN 305 Cb 0.39 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2skd h GLN 305 CO 0.01 0.84 -0.03 0.22 -0.67 0.00 0.00 178.83 179.20 2skd h ASP 306 N 0.93 0.75 -0.48 1.46 3.58 -1.20 -0.84 116.42 120.61 2skd h ASP 306 Ca 0.20 -0.33 -0.03 0.00 0.42 0.00 0.00 57.03 57.29 2skd h ASP 306 Cb 0.29 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 2skd h ASP 306 CO -0.01 0.90 0.17 0.40 -2.88 0.00 0.00 179.24 177.82 2skd h ILE 307 N 0.58 1.22 -0.18 2.25 2.04 -0.68 -1.97 117.51 120.77 2skd h ILE 307 Ca 0.11 -0.69 -0.14 0.00 1.00 0.00 0.00 64.86 65.14 2skd h ILE 307 Cb 0.53 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2skd h ILE 307 CO 0.03 0.26 -0.48 0.40 0.00 0.00 0.00 178.15 178.36 2skd h ILE 308 N 0.63 1.32 -0.43 -0.67 2.04 -0.99 -2.02 117.51 117.38 2skd h ILE 308 Ca 0.16 -1.69 -0.04 0.00 1.00 0.00 0.00 64.86 64.29 2skd h ILE 308 Cb 0.23 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 2skd h ILE 308 CO -0.01 0.52 0.10 -0.09 0.00 0.00 0.00 178.15 178.67 2skd h ARG 309 N 0.37 0.69 -0.77 2.37 2.43 -1.04 0.11 114.38 118.55 2skd h ARG 309 Ca 0.02 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 58.98 2skd h ARG 309 Cb 0.97 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 2skd h ARG 309 CO 0.09 0.70 0.32 -0.09 -1.51 0.00 0.00 179.97 179.48 2skd h ARG 310 N 0.56 1.13 -0.30 0.20 2.43 -1.28 -2.86 114.38 114.27 2skd h ARG 310 Ca 0.14 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 2skd h ARG 310 Cb 0.32 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2skd h ARG 310 CO 0.00 0.90 -0.25 0.35 -1.51 0.00 0.00 179.97 179.46 2skd h PHE 311 N 1.11 0.83 -0.01 2.20 3.57 -1.05 -2.05 116.94 121.54 2skd h PHE 311 Ca 0.26 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2skd h PHE 311 Cb 0.18 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 2skd h PHE 311 CO 0.02 0.97 0.04 0.87 -2.23 0.00 0.00 178.31 177.98 2skd h LYS 312 N 0.45 0.00 0.00 1.11 1.57 -0.60 -3.10 116.57 116.00 2skd h LYS 312 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2skd h LYS 312 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2skd h LYS 312 CO 0.06 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.37 2skd n SER 313 N -3.24 0.00 0.00 0.86 7.64 -1.10 -2.39 113.62 115.39 2skd n SER 313 Ca -0.03 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.10 2skd n SER 313 Cb 0.12 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2skd n SER 313 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2skd n SER 314 N -2.20 0.00 0.00 6.43 7.64 -0.79 0.62 113.62 125.32 2skd n SER 314 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2skd n SER 314 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2skd n SER 314 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2skd n LYS 315 N 3.66 -0.19 0.02 1.43 4.01 -1.26 -4.58 118.16 121.24 2skd n LYS 315 Ca 0.00 -0.38 -0.13 0.00 -0.51 0.00 0.00 58.31 57.29 2skd n LYS 315 Cb 0.00 -0.76 -0.14 0.00 -0.51 0.00 0.00 35.03 33.62 2skd n LYS 315 CO 0.00 0.00 0.00 0.74 -1.11 0.00 0.00 177.40 177.03 2skd h PHE 316 N 0.00 0.21 -0.14 2.13 -1.00 -1.76 -2.49 116.94 113.89 2skd h PHE 316 Ca 0.00 -0.16 -0.14 0.00 2.81 0.00 0.00 57.97 60.49 2skd h PHE 316 Cb 0.32 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 39.82 2skd h PHE 316 CO 0.00 1.24 -0.03 0.41 -1.61 0.00 0.00 178.31 178.32 2skd n GLY 317 N 1.64 3.00 2.18 -1.45 0.00 0.20 -2.96 105.19 107.80 2skd n GLY 317 Ca -0.17 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2skd n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2skd n ARG 319 N -3.42 0.00 0.00 0.00 0.00 -0.94 -5.06 116.66 107.24 2skd n ARG 319 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2skd n ARG 319 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 2skd n ARG 319 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2skd n ASP 320 N 0.00 0.00 0.33 2.89 8.00 -1.25 -2.36 116.55 124.15 2skd n ASP 320 Ca 0.00 0.00 0.22 0.00 0.71 0.00 0.00 54.79 55.72 2skd n ASP 320 Cb 0.00 0.00 1.12 0.00 -0.02 0.00 0.00 41.12 42.22 2skd n ASP 320 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2skd h PRO 321 N 0.00 0.00 -4.04 -0.24 0.13 -1.95 -3.47 132.00 122.43 2skd h PRO 321 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2skd h PRO 321 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2skd h PRO 321 CO 0.00 0.00 -0.85 0.28 -0.23 0.00 0.00 178.00 177.20 2skd n VAL 322 N -3.09 -9.62 0.00 1.56 0.31 -1.00 -5.06 118.33 101.43 2skd n VAL 322 Ca -0.02 1.99 0.00 0.00 -0.01 0.00 0.00 64.34 66.30 2skd n VAL 322 Cb 0.12 -5.29 0.00 0.00 -0.91 0.00 0.00 33.84 27.76 2skd n VAL 322 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2skd n ARG 323 N 1.18 0.00 -1.12 5.55 3.00 -1.26 -4.96 116.66 119.05 2skd n ARG 323 Ca -0.14 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.60 2skd n ARG 323 Cb 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.61 2skd n ARG 323 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2skd n THR 324 N 0.00 0.00 -2.91 5.15 -1.04 -1.26 -4.80 114.28 109.42 2skd n THR 324 Ca 0.00 -0.26 -0.43 0.00 -2.04 0.00 0.00 64.05 61.32 2skd n THR 324 Cb 0.00 -0.95 -0.05 0.00 -1.82 0.00 0.00 70.33 67.51 2skd n THR 324 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2skd s ASN 325 N 4.35 6.53 0.00 8.00 0.02 -1.26 -4.89 114.94 127.69 2skd s ASN 325 Ca 0.37 0.24 0.05 0.00 -1.02 0.00 0.00 52.86 52.50 2skd s ASN 325 Cb 0.01 -2.42 0.21 0.00 0.02 0.00 0.00 41.25 39.07 2skd s ASN 325 CO 0.11 -0.86 1.15 0.49 0.02 0.00 0.00 177.10 178.02 2skd n PHE 326 N 6.70 0.10 0.21 2.20 3.01 -1.26 -3.67 117.46 124.75 2skd n PHE 326 Ca 0.04 -0.05 0.04 0.00 1.01 0.00 0.00 57.45 58.49 2skd n PHE 326 Cb 0.48 0.00 0.44 0.00 -0.01 0.00 0.00 39.48 40.39 2skd n PHE 326 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2skd h ASP 327 N 0.50 0.00 -0.08 4.37 3.32 -1.97 -1.95 116.42 120.61 2skd h ASP 327 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2skd h ASP 327 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2skd h ASP 327 CO 0.00 0.29 0.00 0.00 -1.72 0.00 0.00 179.24 177.81 2skd n ALA 328 N -2.45 2.53 -0.00 3.45 0.00 -1.24 -4.38 120.51 118.42 2skd n ALA 328 Ca -0.02 -0.55 -0.09 0.00 0.00 0.00 0.00 53.44 52.77 2skd n ALA 328 Cb 0.34 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 2skd n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2skd h PHE 329 N 2.95 -0.56 0.00 0.00 3.57 -1.58 -1.31 116.94 120.00 2skd h PHE 329 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2skd h PHE 329 Cb 0.63 0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.64 2skd h PHE 329 CO 0.04 -0.29 0.00 -1.35 -2.23 0.00 0.00 178.31 174.48 2skd h PRO 330 N -0.27 0.00 0.00 6.41 0.11 -1.78 0.29 132.00 136.76 2skd h PRO 330 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2skd h PRO 330 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.53 2skd h PRO 330 CO -0.29 0.00 -0.59 -0.44 -0.21 0.00 0.00 178.00 176.47 2skd h ASP 331 N 0.00 0.00 0.00 -2.05 3.32 -1.53 -3.35 116.42 112.81 2skd h ASP 331 Ca 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2skd h ASP 331 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2skd h ASP 331 CO 0.00 0.08 -0.80 0.29 -1.72 0.00 0.00 179.24 177.08 2skd n LYS 332 N -2.24 2.31 -4.48 3.56 4.76 -0.49 -4.58 118.16 117.01 2skd n LYS 332 Ca 0.03 -0.02 -0.21 0.00 -2.87 0.00 0.00 58.31 55.24 2skd n LYS 332 Cb 0.46 -0.95 -0.14 0.00 -1.84 0.00 0.00 35.03 32.56 2skd n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2skd s VAL 333 N -1.95 1.02 -0.07 -0.18 1.01 0.90 -0.72 120.40 120.40 2skd s VAL 333 Ca -0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 2skd s VAL 333 Cb 0.03 -0.88 0.04 0.00 0.00 0.00 0.00 36.38 35.57 2skd s VAL 333 CO 0.18 0.17 0.13 0.00 0.00 0.00 0.00 175.10 175.59 2skd s ALA 334 N -0.50 -0.08 -0.18 5.51 0.00 -0.67 -4.49 121.76 121.35 2skd s ALA 334 Ca 0.03 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.49 2skd s ALA 334 Cb -0.06 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.37 2skd s ALA 334 CO 0.00 -0.48 -0.19 0.96 0.00 0.00 0.00 175.76 176.05 2skd s ILE 335 N 2.07 2.14 -0.22 0.00 -5.25 -0.39 0.07 121.20 119.63 2skd s ILE 335 Ca 0.01 -0.92 -0.12 0.00 -0.99 0.00 0.00 60.65 58.64 2skd s ILE 335 Cb -0.12 -1.90 -0.05 0.00 2.95 0.00 0.00 42.46 43.34 2skd s ILE 335 CO -0.05 0.53 0.21 -1.58 -1.79 0.00 0.00 174.94 172.26 2skd s GLN 336 N 1.25 4.13 -0.42 0.37 2.00 0.20 -2.43 119.66 124.77 2skd s GLN 336 Ca 0.04 -0.14 -0.20 0.00 -2.00 0.00 0.00 55.36 53.06 2skd s GLN 336 Cb -0.13 -3.50 0.02 0.00 0.80 0.00 0.00 33.01 30.19 2skd s GLN 336 CO -0.11 0.11 0.60 -0.51 -0.50 0.00 0.00 175.29 174.88 2skd s LEU 337 N 0.90 4.52 -0.86 3.68 1.02 0.40 -1.83 118.68 126.50 2skd s LEU 337 Ca 0.11 -0.32 -0.23 0.00 0.02 0.00 0.00 54.13 53.70 2skd s LEU 337 Cb -0.13 -2.68 0.06 0.00 0.02 0.00 0.00 46.19 43.46 2skd s LEU 337 CO 0.04 -0.71 1.27 0.21 0.02 0.00 0.00 176.35 177.17 2skd s ASN 338 N 1.94 6.37 0.33 2.29 2.47 -0.91 -1.41 114.94 126.02 2skd s ASN 338 Ca 0.21 -1.18 0.00 0.00 0.42 0.00 0.00 52.86 52.31 2skd s ASN 338 Cb -0.15 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 2skd s ASN 338 CO 0.17 -1.52 0.00 -0.67 -3.72 0.00 0.00 177.10 171.36 2skd n ASP 339 N 8.46 -2.66 -0.37 -4.21 -0.08 -0.74 -4.16 116.55 112.79 2skd n ASP 339 Ca 0.17 0.17 0.11 0.00 -1.51 0.00 0.00 54.79 53.72 2skd n ASP 339 Cb 0.49 -0.46 0.47 0.00 2.34 0.00 0.00 41.12 43.96 2skd n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2skd n THR 340 N -1.19 0.12 -0.34 5.18 -2.24 -1.26 -4.24 114.28 110.31 2skd n THR 340 Ca 0.00 -0.22 -0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2skd n THR 340 Cb 0.07 0.16 0.16 0.00 -2.10 0.00 0.00 70.33 68.62 2skd n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2skd h HIS 341 N 1.52 1.17 -0.66 4.78 3.86 -1.97 -2.05 115.15 121.80 2skd h HIS 341 Ca 0.00 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.14 2skd h HIS 341 Cb 0.33 -0.39 -0.06 0.00 1.06 0.00 0.00 27.41 28.35 2skd h HIS 341 CO 0.06 0.71 0.13 -0.35 0.86 0.00 0.00 177.93 179.33 2skd n PRO 342 N -4.42 4.42 0.31 2.45 -0.04 -1.26 -4.62 135.00 131.84 2skd n PRO 342 Ca 0.12 -3.14 0.19 0.00 -0.04 0.00 0.00 63.50 60.63 2skd n PRO 342 Cb 0.06 -2.26 1.04 0.00 -0.04 0.00 0.00 33.50 32.30 2skd n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2skd h SER 343 N 3.43 0.00 0.16 3.54 4.64 -1.62 -1.73 113.55 121.97 2skd h SER 343 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2skd h SER 343 Cb 2.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.26 2skd h SER 343 CO 0.62 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.76 2skd n LEU 344 N -3.45 0.00 -0.01 5.97 4.77 -1.26 -2.20 117.00 120.82 2skd n LEU 344 Ca -0.02 0.17 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 2skd n LEU 344 Cb 0.12 -0.17 0.28 0.00 -2.33 0.00 0.00 43.42 41.32 2skd n LEU 344 CO 0.23 -0.09 0.91 0.00 -1.33 0.00 0.00 177.39 177.12 2skd h ALA 345 N 2.80 1.33 0.65 -1.18 0.00 -1.68 -1.12 119.26 120.06 2skd h ALA 345 Ca 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2skd h ALA 345 Cb 0.08 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2skd h ALA 345 CO 0.00 0.46 -0.31 0.82 0.00 0.00 0.00 179.25 180.21 2skd h ILE 346 N 0.51 0.00 0.00 0.00 2.04 -1.69 -0.00 117.51 118.37 2skd h ILE 346 Ca 0.11 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2skd h ILE 346 Cb 0.36 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2skd h ILE 346 CO 0.01 0.00 0.00 1.55 0.00 0.00 0.00 178.15 179.71 2skd h PRO 347 N -0.97 0.00 0.08 2.37 0.13 -1.75 -2.42 132.00 129.43 2skd h PRO 347 Ca -0.09 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.79 2skd h PRO 347 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 2skd h PRO 347 CO 0.15 0.00 -1.11 1.49 -0.23 0.00 0.00 178.00 178.29 2skd h GLU 348 N 0.00 0.30 -0.53 0.86 4.57 -1.14 -1.36 114.58 117.28 2skd h GLU 348 Ca 0.00 -0.43 -0.10 0.00 -1.18 0.00 0.00 59.36 57.65 2skd h GLU 348 Cb 0.35 0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 2skd h GLU 348 CO 0.00 1.16 -0.06 1.25 -1.18 0.00 0.00 179.01 180.17 2skd h LEU 349 N 0.12 0.98 -0.40 1.64 5.85 -0.61 -2.22 115.31 120.67 2skd h LEU 349 Ca -0.11 -0.33 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 2skd h LEU 349 Cb 1.80 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 2skd h LEU 349 CO 0.18 1.08 0.13 0.24 -0.34 0.00 0.00 178.44 179.73 2skd h MET 350 N 0.86 0.63 -0.53 1.25 2.86 -1.43 -1.89 114.93 116.67 2skd h MET 350 Ca 0.14 -0.13 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 2skd h MET 350 Cb 0.62 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.14 2skd h MET 350 CO 0.04 0.62 0.27 -0.09 1.06 0.00 0.00 176.91 178.81 2skd h ARG 351 N 0.51 0.50 0.16 1.72 2.43 -1.07 0.12 114.38 118.75 2skd h ARG 351 Ca 0.13 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2skd h ARG 351 Cb 0.26 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2skd h ARG 351 CO -0.00 0.33 -0.08 0.28 -1.51 0.00 0.00 179.97 178.99 2skd h VAL 352 N 0.51 0.97 -0.43 0.20 2.07 -1.30 0.19 116.25 118.46 2skd h VAL 352 Ca 0.24 -0.68 0.03 0.00 0.82 0.00 0.00 66.70 67.11 2skd h VAL 352 Cb 0.16 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2skd h VAL 352 CO -0.17 0.16 0.22 -0.07 0.02 0.00 0.00 177.57 177.73 2skd h LEU 353 N -0.55 0.33 0.11 2.57 3.38 -1.19 0.14 115.31 120.09 2skd h LEU 353 Ca -0.02 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2skd h LEU 353 Cb 0.42 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2skd h LEU 353 CO 0.04 0.23 -0.05 0.58 0.09 0.00 0.00 178.44 179.33 2skd h VAL 354 N 0.44 0.38 -0.19 1.22 2.07 -0.80 0.15 116.25 119.52 2skd h VAL 354 Ca 0.18 -1.12 -0.17 0.00 0.82 0.00 0.00 66.70 66.41 2skd h VAL 354 Cb 0.08 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2skd h VAL 354 CO -0.12 0.12 -0.56 0.44 0.02 0.00 0.00 177.57 177.47 2skd h ASP 355 N -1.01 0.83 0.00 0.57 3.32 -0.70 -2.80 116.42 116.62 2skd h ASP 355 Ca -0.02 -0.58 -0.24 0.00 0.02 0.00 0.00 57.03 56.21 2skd h ASP 355 Cb 0.31 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 2skd h ASP 355 CO 0.03 1.26 -1.45 0.18 -1.72 0.00 0.00 179.24 177.54 2skd n LEU 356 N -4.10 1.88 0.15 1.55 4.77 -0.22 -4.47 117.00 116.56 2skd n LEU 356 Ca -0.06 0.43 0.13 0.00 -0.03 0.00 0.00 56.01 56.47 2skd n LEU 356 Cb 0.63 -0.91 0.29 0.00 -2.33 0.00 0.00 43.42 41.10 2skd n LEU 356 CO 0.49 0.21 0.82 -0.33 -1.33 0.00 0.00 177.39 177.25 2skd h GLU 357 N -1.00 0.00 -4.58 3.23 4.39 -0.70 -3.48 114.58 112.43 2skd h GLU 357 Ca -0.37 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.07 2skd h GLU 357 Cb 1.25 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 30.02 2skd h GLU 357 CO -0.22 0.00 -0.53 0.54 -1.16 0.00 0.00 179.01 177.64 2skd n ARG 358 N -2.62 -5.29 -2.76 2.33 1.74 0.36 -4.95 116.66 105.47 2skd n ARG 358 Ca 0.05 0.61 -0.26 0.00 -0.77 0.00 0.00 57.85 57.47 2skd n ARG 358 Cb 0.47 -4.95 0.00 0.00 -1.02 0.00 0.00 32.46 26.97 2skd n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2skd s LEU 359 N -5.36 3.64 0.56 0.55 1.02 -0.20 -4.98 118.68 113.92 2skd s LEU 359 Ca 0.21 0.76 -0.15 0.00 0.02 0.00 0.00 54.13 54.96 2skd s LEU 359 Cb -0.09 -3.68 -0.05 0.00 0.02 0.00 0.00 46.19 42.39 2skd s LEU 359 CO 0.53 -0.60 1.02 1.51 0.02 0.00 0.00 176.35 178.83 2skd s ASP 360 N -4.13 6.19 0.14 2.29 -4.77 -1.26 -4.50 116.67 110.62 2skd s ASP 360 Ca 0.47 1.66 -0.32 0.00 -3.30 0.00 0.00 52.55 51.06 2skd s ASP 360 Cb -0.10 -2.51 -0.09 0.00 -1.09 0.00 0.00 42.92 39.13 2skd s ASP 360 CO 0.43 -0.89 1.55 -0.25 0.70 0.00 0.00 175.17 176.71 2skd h TRP 361 N 0.53 -1.63 -0.83 2.11 2.91 -1.97 -1.81 115.95 115.26 2skd h TRP 361 Ca -0.46 0.08 0.09 0.00 1.13 0.00 0.00 58.89 59.72 2skd h TRP 361 Cb 1.20 0.77 -0.06 0.00 -0.51 0.00 0.00 29.16 30.56 2skd h TRP 361 CO 0.62 -0.48 0.54 -0.44 -1.03 0.00 0.00 178.44 177.64 2skd h ASP 362 N -0.38 0.74 -0.29 2.65 3.32 -1.99 0.22 116.42 120.69 2skd h ASP 362 Ca 0.09 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 2skd h ASP 362 Cb 0.59 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 2skd h ASP 362 CO -0.60 0.45 -0.36 0.50 -1.72 0.00 0.00 179.24 177.51 2skd h LYS 363 N 0.82 0.75 -0.48 3.56 3.11 -1.86 -1.68 116.57 120.79 2skd h LYS 363 Ca 0.37 -0.42 -0.04 0.00 -2.81 0.00 0.00 60.65 57.75 2skd h LYS 363 Cb 0.37 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.61 2skd h LYS 363 CO -0.15 1.05 0.15 0.00 -2.81 0.00 0.00 179.45 177.69 2skd h ALA 364 N 0.69 0.63 -0.69 5.00 0.00 -0.55 -1.50 119.26 122.84 2skd h ALA 364 Ca 0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2skd h ALA 364 Cb 0.94 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2skd h ALA 364 CO 0.09 0.29 0.29 2.35 0.00 0.00 0.00 179.25 182.26 2skd h TRP 365 N 0.64 1.05 -0.02 0.00 2.91 -0.56 0.32 115.95 120.29 2skd h TRP 365 Ca 0.15 -0.07 0.01 0.00 1.13 0.00 0.00 58.89 60.11 2skd h TRP 365 Cb 0.28 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 28.60 2skd h TRP 365 CO 0.01 0.81 -0.05 1.49 -1.03 0.00 0.00 178.44 179.67 2skd h GLU 366 N 0.98 -0.07 -0.27 2.65 4.81 -1.08 -0.37 114.58 121.23 2skd h GLU 366 Ca 0.23 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 2skd h GLU 366 Cb 0.19 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 2skd h GLU 366 CO -0.02 -0.05 0.09 0.28 -0.73 0.00 0.00 179.01 178.58 2skd h VAL 367 N -0.08 0.93 -0.10 0.32 2.07 -0.91 -2.03 116.25 116.46 2skd h VAL 367 Ca 0.03 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2skd h VAL 367 Cb 0.12 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2skd h VAL 367 CO -0.07 0.04 0.06 0.74 0.02 0.00 0.00 177.57 178.36 2skd h THR 368 N 0.22 1.01 -0.35 2.57 2.02 -0.59 -2.23 112.91 115.56 2skd h THR 368 Ca 0.12 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.24 2skd h THR 368 Cb 0.08 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2skd h THR 368 CO -0.12 0.02 0.13 0.58 0.37 0.00 0.00 175.52 176.51 2skd h VAL 369 N 0.12 1.14 0.00 3.16 2.07 -0.98 -2.46 116.25 119.31 2skd h VAL 369 Ca 0.04 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 2skd h VAL 369 Cb -0.00 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2skd h VAL 369 CO -0.02 0.17 -0.16 0.11 0.02 0.00 0.00 177.57 177.69 2skd h LYS 370 N 0.49 0.00 0.00 1.57 1.57 -0.92 -2.01 116.57 117.27 2skd h LYS 370 Ca 0.12 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2skd h LYS 370 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2skd h LYS 370 CO -0.01 0.16 -2.02 0.25 -0.57 0.00 0.00 179.45 177.26 2skd n THR 371 N -3.20 0.18 -3.61 -0.16 -2.24 -0.88 -4.90 114.28 99.47 2skd n THR 371 Ca 0.02 -0.53 -0.36 0.00 -2.27 0.00 0.00 64.05 60.91 2skd n THR 371 Cb 0.49 -0.05 -0.06 0.00 -2.10 0.00 0.00 70.33 68.62 2skd n THR 371 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2skd s ALA 373 N -1.21 -0.11 -0.04 0.00 0.00 -1.02 -1.74 121.76 117.65 2skd s ALA 373 Ca 0.26 0.04 0.06 0.00 0.00 0.00 0.00 51.96 52.32 2skd s ALA 373 Cb -0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 2skd s ALA 373 CO 0.14 -0.05 -0.22 -0.47 0.00 0.00 0.00 175.76 175.16 2skd s TYR 374 N -0.25 2.48 -0.18 0.00 5.04 -0.48 -0.45 117.35 123.51 2skd s TYR 374 Ca -0.03 -0.41 -0.02 0.00 -2.44 0.00 0.00 57.07 54.18 2skd s TYR 374 Cb -0.02 -1.57 -0.00 0.00 0.35 0.00 0.00 41.96 40.71 2skd s TYR 374 CO 0.00 -0.01 -0.10 0.99 -1.34 0.00 0.00 175.55 175.09 2skd s THR 375 N -0.53 3.01 -0.07 4.34 2.01 -0.50 -1.76 115.64 122.14 2skd s THR 375 Ca 0.07 -0.63 -0.12 0.00 0.31 0.00 0.00 61.69 61.32 2skd s THR 375 Cb -0.11 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 2skd s THR 375 CO 0.01 0.48 0.30 0.21 -0.69 0.00 0.00 174.62 174.92 2skd s ASN 376 N 1.08 6.60 0.00 3.53 3.84 -0.61 -1.80 114.94 127.58 2skd s ASN 376 Ca 0.00 0.71 0.03 0.00 0.21 0.00 0.00 52.86 53.81 2skd s ASN 376 Cb -0.15 -2.18 -0.01 0.00 -0.55 0.00 0.00 41.25 38.37 2skd s ASN 376 CO -0.02 0.30 0.29 1.41 -2.79 0.00 0.00 177.10 176.29 2skd n HIS 377 N 2.27 0.00 -3.51 0.43 8.25 -1.26 -4.09 115.22 117.31 2skd n HIS 377 Ca -0.15 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.17 2skd n HIS 377 Cb 0.53 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.60 2skd n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2skd s THR 378 N -0.87 0.02 -0.79 1.59 -1.32 -1.26 -4.43 115.64 108.58 2skd s THR 378 Ca 0.02 -0.14 0.07 0.00 -1.21 0.00 0.00 61.69 60.43 2skd s THR 378 Cb 0.02 -1.01 0.03 0.00 -1.51 0.00 0.00 72.50 70.03 2skd s THR 378 CO 0.08 -0.08 0.63 1.33 -2.21 0.00 0.00 174.62 174.38 2skd n VAL 379 N 0.07 0.00 -2.56 5.08 0.24 -1.26 -4.99 118.33 114.91 2skd n VAL 379 Ca -0.18 -0.46 -0.42 0.00 -2.04 0.00 0.00 64.34 61.24 2skd n VAL 379 Cb 0.62 1.12 -0.03 0.00 -1.47 0.00 0.00 33.84 34.08 2skd n VAL 379 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2skd s ILE 380 N -0.86 4.29 0.31 1.34 -4.36 -1.26 -4.94 121.20 115.71 2skd s ILE 380 Ca 0.07 1.73 0.06 0.00 -0.26 0.00 0.00 60.65 62.25 2skd s ILE 380 Cb 0.06 -4.11 0.30 0.00 1.25 0.00 0.00 42.46 39.97 2skd s ILE 380 CO 0.14 0.18 1.80 1.55 0.24 0.00 0.00 174.94 178.85 2skd h PRO 381 N 6.32 0.77 0.00 0.37 0.13 -1.98 -1.86 132.00 135.75 2skd h PRO 381 Ca -0.42 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2skd h PRO 381 Cb 1.22 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2skd h PRO 381 CO 0.77 0.51 0.00 -0.85 -0.23 0.00 0.00 178.00 178.19 2skd n GLU 382 N -4.69 0.01 0.05 0.86 0.00 -1.26 -2.36 120.64 113.24 2skd n GLU 382 Ca 0.22 0.22 0.11 0.00 0.00 0.00 0.00 57.16 57.71 2skd n GLU 382 Cb 0.52 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.47 2skd n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2skd n ALA 383 N -1.49 3.02 -2.18 -1.84 0.00 -0.70 -0.70 120.51 116.62 2skd n ALA 383 Ca 0.04 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 2skd n ALA 383 Cb 0.19 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2skd n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2skd s LEU 384 N -4.45 4.40 -0.37 0.00 2.01 -1.00 -4.33 118.68 114.94 2skd s LEU 384 Ca 0.01 2.23 -0.26 0.00 0.01 0.00 0.00 54.13 56.13 2skd s LEU 384 Cb 0.13 -3.59 0.02 0.00 0.01 0.00 0.00 46.19 42.75 2skd s LEU 384 CO 0.80 -0.51 0.91 -1.61 1.01 0.00 0.00 176.35 176.95 2skd s GLU 385 N 0.56 3.81 -0.35 1.70 2.02 -1.26 -4.76 118.70 120.41 2skd s GLU 385 Ca 0.59 0.52 0.01 0.00 0.02 0.00 0.00 54.97 56.11 2skd s GLU 385 Cb -0.34 -3.81 0.11 0.00 0.10 0.00 0.00 34.13 30.19 2skd s GLU 385 CO 0.33 -0.96 0.11 1.03 0.02 0.00 0.00 175.26 175.79 2skd s ARG 386 N 3.46 1.09 -0.10 1.61 0.52 -1.26 -2.07 118.95 122.19 2skd s ARG 386 Ca 0.37 -1.53 -0.26 0.00 -0.52 0.00 0.00 55.73 53.79 2skd s ARG 386 Cb -0.12 -2.46 -0.02 0.00 0.52 0.00 0.00 34.95 32.87 2skd s ARG 386 CO 0.19 -1.01 0.84 -1.58 0.02 0.00 0.00 175.30 173.77 2skd s TRP 387 N 1.12 3.52 0.25 -0.53 0.52 -0.75 -4.72 118.94 118.34 2skd s TRP 387 Ca 0.12 1.37 -0.31 0.00 0.02 0.00 0.00 56.10 57.30 2skd s TRP 387 Cb -0.19 -3.00 -0.12 0.00 -1.15 0.00 0.00 33.47 29.01 2skd s TRP 387 CO -0.15 -0.11 1.56 -2.30 0.02 0.00 0.00 176.95 175.97 2skd n PRO 388 N 4.58 2.46 -0.01 4.98 -0.02 -1.26 -0.75 135.00 144.97 2skd n PRO 388 Ca 0.04 0.88 0.07 0.00 -2.02 0.00 0.00 63.50 62.46 2skd n PRO 388 Cb 0.50 -2.63 0.47 0.00 -0.02 0.00 0.00 33.50 31.81 2skd n PRO 388 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2skd h VAL 389 N 3.35 1.02 0.00 -1.45 2.07 -1.24 -1.87 116.25 118.13 2skd h VAL 389 Ca -0.46 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2skd h VAL 389 Cb 1.24 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2skd h VAL 389 CO 0.82 0.08 -0.09 1.12 0.02 0.00 0.00 177.57 179.52 2skd h HIS 390 N 0.46 0.00 0.01 1.57 2.07 -1.90 0.12 115.15 117.48 2skd h HIS 390 Ca 0.18 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.66 2skd h HIS 390 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.14 2skd h HIS 390 CO -0.00 0.09 -0.16 -0.07 -3.07 0.00 0.00 177.93 174.72 2skd h LEU 391 N 0.00 0.13 -0.80 6.12 3.38 -1.71 -2.89 115.31 119.54 2skd h LEU 391 Ca -0.00 -0.82 -0.04 0.00 0.09 0.00 0.00 57.88 57.11 2skd h LEU 391 Cb 0.32 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2skd h LEU 391 CO 0.01 0.94 0.34 -0.07 0.09 0.00 0.00 178.44 179.75 2skd h LEU 392 N -0.66 1.09 -0.89 1.67 3.38 -1.43 -1.14 115.31 117.33 2skd h LEU 392 Ca -0.02 -0.16 0.09 0.00 0.09 0.00 0.00 57.88 57.88 2skd h LEU 392 Cb 0.97 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 2skd h LEU 392 CO 0.03 0.95 0.53 -0.08 0.09 0.00 0.00 178.44 179.97 2skd h GLU 393 N 1.16 0.87 0.10 1.13 4.81 -0.84 0.11 114.58 121.92 2skd h GLU 393 Ca 0.27 -0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 59.24 2skd h GLU 393 Cb 0.18 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2skd h GLU 393 CO -0.03 0.58 -1.00 1.15 -0.73 0.00 0.00 179.01 178.98 2skd h THR 394 N 0.90 1.29 0.09 0.32 2.02 -1.28 -3.33 112.91 112.93 2skd h THR 394 Ca 0.42 -2.43 -0.13 0.00 0.77 0.00 0.00 66.41 65.05 2skd h THR 394 Cb 0.35 2.94 0.01 0.00 -1.74 0.00 0.00 68.15 69.71 2skd h THR 394 CO -0.23 0.66 -0.57 0.25 0.37 0.00 0.00 175.52 176.00 2skd h LEU 395 N -0.48 0.30 -6.24 2.58 5.85 -1.19 -3.38 115.31 112.75 2skd h LEU 395 Ca -0.21 -0.96 -0.59 0.00 0.84 0.00 0.00 57.88 56.96 2skd h LEU 395 Cb 1.58 -0.10 -0.40 0.00 0.37 0.00 0.00 40.66 42.11 2skd h LEU 395 CO 0.06 1.27 -0.83 0.18 -0.34 0.00 0.00 178.44 178.79 2skd n LEU 396 N -4.29 1.87 -0.20 2.25 4.77 0.37 0.05 117.00 121.83 2skd n LEU 396 Ca -0.13 -5.02 -0.00 0.00 -0.03 0.00 0.00 56.01 50.83 2skd n LEU 396 Cb 0.71 -0.05 0.10 0.00 -2.33 0.00 0.00 43.42 41.85 2skd n LEU 396 CO 0.43 2.01 0.97 1.55 -1.33 0.00 0.00 177.39 181.02 2skd h PRO 397 N 4.41 0.36 -0.27 3.23 0.13 -1.65 -2.67 132.00 135.54 2skd h PRO 397 Ca 0.15 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 65.16 2skd h PRO 397 Cb 0.78 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 2skd h PRO 397 CO 0.63 0.24 -0.27 -0.09 -0.23 0.00 0.00 178.00 178.28 2skd h ARG 398 N 0.38 0.55 -0.13 0.86 9.65 -1.91 -2.92 114.38 120.86 2skd h ARG 398 Ca 0.30 -0.22 -0.06 0.00 -1.10 0.00 0.00 59.98 58.90 2skd h ARG 398 Cb 0.38 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 2skd h ARG 398 CO -0.32 0.77 -0.18 0.45 2.80 0.00 0.00 179.97 183.49 2skd h HIS 399 N 0.48 0.22 -0.39 2.20 3.86 -1.84 -1.44 115.15 118.24 2skd h HIS 399 Ca 0.06 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.12 2skd h HIS 399 Cb 0.72 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.12 2skd h HIS 399 CO 0.03 0.38 -0.23 1.25 0.86 0.00 0.00 177.93 180.21 2skd h LEU 400 N 0.19 0.87 -0.65 2.43 6.46 -1.32 -0.82 115.31 122.48 2skd h LEU 400 Ca 0.04 -0.42 -0.01 0.00 -0.12 0.00 0.00 57.88 57.36 2skd h LEU 400 Cb 0.44 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.09 2skd h LEU 400 CO 0.03 1.11 0.37 1.56 -0.62 0.00 0.00 178.44 180.89 2skd h GLN 401 N 0.64 0.90 -0.39 1.25 4.20 -1.28 -0.22 115.11 120.20 2skd h GLN 401 Ca 0.08 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.60 2skd h GLN 401 Cb 0.80 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2skd h GLN 401 CO 0.07 0.66 -0.16 0.82 -0.67 0.00 0.00 178.83 179.55 2skd h ILE 402 N 0.88 1.26 -0.47 2.54 2.04 -1.13 -2.01 117.51 120.63 2skd h ILE 402 Ca 0.23 -1.22 -0.13 0.00 1.00 0.00 0.00 64.86 64.75 2skd h ILE 402 Cb 0.01 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2skd h ILE 402 CO -0.04 0.41 -0.21 0.40 0.00 0.00 0.00 178.15 178.71 2skd h ILE 403 N 0.65 1.27 -0.59 -0.67 2.04 -0.63 -0.21 117.51 119.37 2skd h ILE 403 Ca 0.10 -1.37 -0.06 0.00 1.00 0.00 0.00 64.86 64.53 2skd h ILE 403 Cb 0.63 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 2skd h ILE 403 CO 0.04 0.47 0.12 1.88 0.00 0.00 0.00 178.15 180.66 2skd h TYR 404 N 0.83 1.02 -0.39 1.37 0.05 -0.89 -0.51 116.97 118.45 2skd h TYR 404 Ca 0.11 -0.13 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 2skd h TYR 404 Cb 0.78 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2skd h TYR 404 CO 0.05 0.88 -0.16 1.49 -1.05 0.00 0.00 178.16 179.37 2skd h GLU 405 N 0.87 0.72 -0.43 4.88 4.57 -1.20 0.37 114.58 124.36 2skd h GLU 405 Ca 0.18 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 58.03 2skd h GLU 405 Cb 0.39 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2skd h GLU 405 CO 0.01 0.83 -0.05 0.82 -1.18 0.00 0.00 179.01 179.44 2skd h ILE 406 N 0.64 1.27 -0.20 2.32 2.04 -0.71 -2.51 117.51 120.36 2skd h ILE 406 Ca 0.10 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.83 2skd h ILE 406 Cb 0.63 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2skd h ILE 406 CO 0.04 0.38 0.10 -1.13 0.00 0.00 0.00 178.15 177.55 2skd h ASN 407 N 0.63 0.26 -0.07 1.72 -1.24 -0.83 -1.38 115.58 114.66 2skd h ASN 407 Ca 0.12 -0.11 0.04 0.00 0.71 0.00 0.00 56.30 57.06 2skd h ASN 407 Cb 0.57 -0.07 -0.06 0.00 0.73 0.00 0.00 38.32 39.49 2skd h ASN 407 CO 0.03 0.29 -0.36 -0.61 -1.29 0.00 0.00 177.43 175.49 2skd h GLN 408 N 0.21 -0.46 -0.22 6.67 4.15 -0.83 0.27 115.11 124.90 2skd h GLN 408 Ca 0.07 0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.45 2skd h GLN 408 Cb 0.10 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 2skd h GLN 408 CO -0.01 -0.31 -0.19 0.00 -1.93 0.00 0.00 178.83 176.40 2skd h ARG 409 N -0.48 0.38 -0.20 1.69 3.08 -1.41 -2.46 114.38 114.99 2skd h ARG 409 Ca 0.07 -0.12 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 2skd h ARG 409 Cb 0.59 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2skd h ARG 409 CO -0.34 0.56 -0.20 0.35 -1.07 0.00 0.00 179.97 179.28 2skd h PHE 410 N 0.35 0.58 -0.09 3.04 3.57 -0.81 -2.79 116.94 120.80 2skd h PHE 410 Ca 0.06 -0.17 -0.05 0.00 3.53 0.00 0.00 57.97 61.34 2skd h PHE 410 Cb 0.53 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 2skd h PHE 410 CO 0.01 0.84 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.68 2skd h LEU 411 N 0.15 0.13 -1.13 0.59 3.38 -0.88 -0.71 115.31 116.84 2skd h LEU 411 Ca 0.03 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2skd h LEU 411 Cb 0.74 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2skd h LEU 411 CO 0.05 0.33 -0.20 0.78 0.09 0.00 0.00 178.44 179.49 2skd h ASN 412 N 0.13 0.36 -0.52 -0.43 -0.26 -1.34 0.64 115.58 114.16 2skd h ASN 412 Ca 0.02 -0.10 -0.08 0.00 -0.56 0.00 0.00 56.30 55.58 2skd h ASN 412 Cb 0.41 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 2skd h ASN 412 CO 0.03 0.58 0.02 0.03 -1.06 0.00 0.00 177.43 177.02 2skd h ARG 413 N 0.34 0.90 -0.01 0.81 3.08 -0.88 -1.47 114.38 117.14 2skd h ARG 413 Ca 0.06 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 2skd h ARG 413 Cb 0.55 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 2skd h ARG 413 CO 0.04 0.92 -0.00 0.28 -1.07 0.00 0.00 179.97 180.13 2skd h VAL 414 N 0.77 1.29 -0.62 2.04 2.07 -0.73 -1.92 116.25 119.14 2skd h VAL 414 Ca 0.15 -0.86 0.10 0.00 0.82 0.00 0.00 66.70 66.90 2skd h VAL 414 Cb 0.50 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 32.04 2skd h VAL 414 CO 0.02 0.23 0.23 0.00 0.02 0.00 0.00 177.57 178.07 2skd h ALA 415 N 0.64 0.80 0.00 1.67 0.00 -0.83 0.71 119.26 122.25 2skd h ALA 415 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2skd h ALA 415 Cb 0.37 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2skd h ALA 415 CO 0.00 -0.20 -0.17 0.00 0.00 0.00 0.00 179.25 178.88 2skd h ALA 416 N 1.43 1.63 0.09 0.00 0.00 -1.15 -2.13 119.26 119.13 2skd h ALA 416 Ca 0.32 -0.15 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 2skd h ALA 416 Cb 0.40 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2skd h ALA 416 CO -0.32 0.21 -1.66 0.00 0.00 0.00 0.00 179.25 177.48 2skd h ALA 417 N 1.83 0.44 -2.41 0.00 0.00 -0.04 -3.40 119.26 115.68 2skd h ALA 417 Ca -0.00 -1.26 -0.60 0.00 0.00 0.00 0.00 54.91 53.06 2skd h ALA 417 Cb 0.32 0.41 -0.41 0.00 0.00 0.00 0.00 17.79 18.11 2skd h ALA 417 CO 0.02 1.30 -0.74 1.19 0.00 0.00 0.00 179.25 181.02 2skd n PHE 418 N -3.35 2.14 -1.67 0.00 3.72 0.22 -5.09 117.46 113.43 2skd n PHE 418 Ca -0.19 -3.97 -0.48 0.00 -0.05 0.00 0.00 57.45 52.76 2skd n PHE 418 Cb 1.04 -0.43 -0.05 0.00 -0.94 0.00 0.00 39.48 39.11 2skd n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2skd n PRO 419 N 1.51 2.05 0.00 -1.08 -0.02 -0.82 -1.82 135.00 134.82 2skd n PRO 419 Ca 0.26 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2skd n PRO 419 Cb 0.43 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2skd n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2skd n GLY 420 N 3.90 2.50 3.41 -1.23 0.00 -1.26 -4.95 105.19 107.56 2skd n GLY 420 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 2skd n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2skd n ASP 421 N 0.00 3.97 0.22 1.61 -0.08 -0.76 -4.75 116.55 116.75 2skd n ASP 421 Ca 0.00 -2.82 0.07 0.00 -1.51 0.00 0.00 54.79 50.54 2skd n ASP 421 Cb 0.00 -1.67 0.49 0.00 2.34 0.00 0.00 41.12 42.28 2skd n ASP 421 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 2skd h VAL 422 N 5.42 0.89 0.08 5.18 3.04 -1.92 -2.86 116.25 126.08 2skd h VAL 422 Ca 0.39 -1.04 -0.26 0.00 -1.01 0.00 0.00 66.70 64.78 2skd h VAL 422 Cb 0.84 1.62 0.01 0.00 -2.01 0.00 0.00 31.29 31.74 2skd h VAL 422 CO 1.50 0.26 -1.13 -0.78 -1.01 0.00 0.00 177.57 176.41 2skd h ASP 423 N 0.00 0.56 -0.28 3.17 3.58 -2.00 -3.09 116.42 118.36 2skd h ASP 423 Ca -0.00 -0.52 -0.01 0.00 0.42 0.00 0.00 57.03 56.91 2skd h ASP 423 Cb 0.60 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.45 2skd h ASP 423 CO 0.03 1.36 0.14 -0.09 -2.88 0.00 0.00 179.24 177.80 2skd h ARG 424 N 0.17 0.44 -0.36 0.28 2.43 -1.92 -1.49 114.38 113.93 2skd h ARG 424 Ca -0.13 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 2skd h ARG 424 Cb 1.81 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 31.26 2skd h ARG 424 CO 0.20 0.36 0.18 -0.07 -1.51 0.00 0.00 179.97 179.12 2skd h LEU 425 N 0.44 0.47 -0.57 3.80 4.07 -1.43 -1.59 115.31 120.51 2skd h LEU 425 Ca 0.11 -0.12 -0.16 0.00 0.08 0.00 0.00 57.88 57.79 2skd h LEU 425 Cb 0.07 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 2skd h LEU 425 CO -0.01 0.46 -0.68 0.08 -1.08 0.00 0.00 178.44 177.21 2skd h ARG 426 N 0.45 0.18 -0.48 1.13 -0.00 -1.44 -2.83 114.38 111.39 2skd h ARG 426 Ca 0.12 -0.14 -0.10 0.00 -0.00 0.00 0.00 59.98 59.86 2skd h ARG 426 Cb 0.11 0.03 -0.02 0.00 -0.00 0.00 0.00 29.97 30.09 2skd h ARG 426 CO -0.02 0.79 -0.10 0.00 -0.00 0.00 0.00 179.97 180.65 2skd h ARG 427 N 0.12 0.87 0.00 0.08 3.08 -1.10 -3.14 114.38 114.29 2skd h ARG 427 Ca -0.02 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.74 2skd h ARG 427 Cb 1.22 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.20 2skd h ARG 427 CO 0.10 0.93 -0.46 -1.33 -1.07 0.00 0.00 179.97 178.14 2skd n MET 428 N -4.16 0.19 -1.56 0.04 2.81 -0.61 -4.95 117.12 108.87 2skd n MET 428 Ca 0.02 0.07 -0.41 0.00 -1.81 0.00 0.00 57.70 55.57 2skd n MET 428 Cb 0.37 -1.64 0.01 0.00 -0.71 0.00 0.00 33.22 31.26 2skd n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2skd n SER 429 N -1.93 0.56 0.18 7.83 2.88 -1.07 -4.87 113.62 117.20 2skd n SER 429 Ca 0.04 0.97 0.09 0.00 -1.33 0.00 0.00 58.87 58.64 2skd n SER 429 Cb 0.41 -1.29 0.11 0.00 -0.75 0.00 0.00 64.21 62.69 2skd n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2skd h LEU 430 N 1.19 0.00 -9.05 2.46 3.38 -1.91 -3.43 115.31 107.95 2skd h LEU 430 Ca -0.44 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.91 2skd h LEU 430 Cb 1.36 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.97 2skd h LEU 430 CO 0.54 0.17 -0.40 -0.69 0.09 0.00 0.00 178.44 178.15 2skd s VAL 431 N -3.13 5.29 -0.24 1.22 1.01 -1.26 0.10 120.40 123.38 2skd s VAL 431 Ca 0.05 0.35 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 2skd s VAL 431 Cb 0.06 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2skd s VAL 431 CO 0.70 0.29 0.13 -1.61 0.00 0.00 0.00 175.10 174.61 2skd s GLU 432 N 1.35 3.93 0.36 2.72 2.02 0.74 -4.96 118.70 124.86 2skd s GLU 432 Ca 0.11 -0.34 -0.04 0.00 0.02 0.00 0.00 54.97 54.72 2skd s GLU 432 Cb -0.14 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.57 2skd s GLU 432 CO 0.07 -0.02 0.63 -2.00 0.02 0.00 0.00 175.26 173.96 2skd s GLU 433 N 1.26 3.60 0.00 1.61 2.56 -1.26 -1.53 118.70 124.94 2skd s GLU 433 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 54.97 55.06 2skd s GLU 433 Cb -0.14 -2.56 0.00 0.00 2.00 0.00 0.00 34.13 33.43 2skd s GLU 433 CO 0.05 0.08 0.00 0.41 -0.56 0.00 0.00 175.26 175.24 2skd n GLY 434 N -1.46 0.33 0.00 -1.50 0.00 -1.26 -4.93 105.19 96.36 2skd n GLY 434 Ca -0.01 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2skd n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2skd n ALA 435 N -0.66 0.00 -2.44 4.61 0.00 -1.26 -4.33 120.51 116.42 2skd n ALA 435 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2skd n ALA 435 Cb 0.00 0.41 -0.14 0.00 0.00 0.00 0.00 19.45 19.71 2skd n ALA 435 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2skd s VAL 436 N -2.92 1.76 0.26 0.00 -7.23 -1.26 -5.11 120.40 105.91 2skd s VAL 436 Ca 0.00 -1.19 -0.29 0.00 -1.81 0.00 0.00 61.98 58.68 2skd s VAL 436 Cb 0.00 -1.52 -0.09 0.00 0.56 0.00 0.00 36.38 35.33 2skd s VAL 436 CO 0.00 0.28 1.18 -0.54 -0.31 0.00 0.00 175.10 175.71 2skd s LYS 437 N -1.08 4.53 0.16 4.82 1.02 -1.26 -4.79 119.74 123.13 2skd s LYS 437 Ca 0.08 1.92 0.04 0.00 0.02 0.00 0.00 55.97 58.04 2skd s LYS 437 Cb -0.09 -3.18 -0.05 0.00 -0.52 0.00 0.00 37.83 34.00 2skd s LYS 437 CO 0.01 0.02 -0.08 1.03 -0.92 0.00 0.00 175.35 175.42 2skd s ARG 438 N -1.11 1.11 -0.17 1.68 0.52 -0.58 -0.72 118.95 119.68 2skd s ARG 438 Ca 0.48 -1.49 -0.03 0.00 -0.52 0.00 0.00 55.73 54.17 2skd s ARG 438 Cb -0.34 -0.59 -0.02 0.00 0.52 0.00 0.00 34.95 34.52 2skd s ARG 438 CO 0.42 0.03 -0.06 0.42 0.02 0.00 0.00 175.30 176.13 2skd s ILE 439 N -3.37 3.55 -0.64 1.52 -1.09 0.07 -0.19 121.20 121.05 2skd s ILE 439 Ca 0.19 -0.47 -0.23 0.00 -2.23 0.00 0.00 60.65 57.91 2skd s ILE 439 Cb 0.03 -2.56 0.06 0.00 -1.58 0.00 0.00 42.46 38.42 2skd s ILE 439 CO 0.02 0.48 0.99 0.21 -1.23 0.00 0.00 174.94 175.41 2skd s ASN 440 N 0.65 6.21 0.44 3.58 3.84 0.11 -1.81 114.94 127.96 2skd s ASN 440 Ca -0.04 -0.81 0.12 0.00 0.21 0.00 0.00 52.86 52.35 2skd s ASN 440 Cb -0.15 -2.43 1.02 0.00 -0.55 0.00 0.00 41.25 39.14 2skd s ASN 440 CO 0.02 -1.43 2.04 0.24 -2.79 0.00 0.00 177.10 175.18 2skd h MET 441 N 9.56 0.37 -0.43 0.43 2.86 -1.72 -2.15 114.93 123.84 2skd h MET 441 Ca -0.28 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.21 2skd h MET 441 Cb 1.07 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.63 2skd h MET 441 CO 1.17 0.25 -0.23 0.00 1.06 0.00 0.00 176.91 179.15 2skd h ALA 442 N 1.77 0.77 -0.33 6.32 0.00 -1.91 -1.66 119.26 124.22 2skd h ALA 442 Ca 0.18 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 2skd h ALA 442 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2skd h ALA 442 CO -0.04 0.66 -0.08 0.45 0.00 0.00 0.00 179.25 180.24 2skd h HIS 443 N 0.77 0.58 -0.43 0.00 3.86 -1.78 -1.98 115.15 116.17 2skd h HIS 443 Ca 0.10 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 2skd h HIS 443 Cb 0.78 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 2skd h HIS 443 CO 0.05 0.61 0.17 1.25 0.86 0.00 0.00 177.93 180.87 2skd h LEU 444 N 0.51 0.59 -0.85 2.43 6.46 -1.12 -2.31 115.31 121.03 2skd h LEU 444 Ca 0.10 -0.17 -0.10 0.00 -0.12 0.00 0.00 57.88 57.59 2skd h LEU 444 Cb 0.45 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.21 2skd h LEU 444 CO 0.02 0.60 -0.19 0.00 -0.62 0.00 0.00 178.44 178.26 2skd h ILE 446 N 0.58 1.28 -0.53 0.00 2.04 -1.25 -2.53 117.51 117.10 2skd h ILE 446 Ca 0.09 -1.28 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 2skd h ILE 446 Cb 0.65 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2skd h ILE 446 CO 0.05 0.43 -0.03 0.00 0.00 0.00 0.00 178.15 178.59 2skd h ALA 447 N 0.81 0.94 -0.65 1.87 0.00 -1.29 -3.23 119.26 117.70 2skd h ALA 447 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2skd h ALA 447 Cb 0.71 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2skd h ALA 447 CO 0.05 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.34 2skd n GLY 448 N -0.48 2.76 3.27 0.00 0.00 -0.71 -4.94 105.19 105.09 2skd n GLY 448 Ca 0.02 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 2skd n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2skd s SER 449 N -0.88 2.50 0.00 1.61 0.01 -0.96 -3.86 113.70 112.12 2skd s SER 449 Ca 0.52 -0.60 0.28 0.00 1.31 0.00 0.00 55.95 57.46 2skd s SER 449 Cb 0.34 -0.17 0.99 0.00 0.21 0.00 0.00 66.02 67.39 2skd s SER 449 CO 0.24 0.11 1.71 0.00 0.41 0.00 0.00 173.24 175.71 2skd n HIS 450 N 1.50 0.00 -3.70 2.43 1.44 -0.71 -4.86 115.22 111.32 2skd n HIS 450 Ca -0.18 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.39 2skd n HIS 450 Cb 0.53 -0.06 -0.09 0.00 0.12 0.00 0.00 29.99 30.49 2skd n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2skd s ALA 451 N -2.23 -1.19 -0.05 1.59 0.00 -1.26 -4.56 121.76 114.05 2skd s ALA 451 Ca 0.32 1.21 -0.01 0.00 0.00 0.00 0.00 51.96 53.49 2skd s ALA 451 Cb 0.20 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.75 2skd s ALA 451 CO 0.42 -0.25 0.00 0.08 0.00 0.00 0.00 175.76 176.02 2skd s VAL 452 N -0.10 0.28 0.13 0.00 1.01 -0.02 -1.39 120.40 120.32 2skd s VAL 452 Ca -0.03 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.14 2skd s VAL 452 Cb -0.03 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 2skd s VAL 452 CO 0.02 0.21 -0.16 0.54 0.00 0.00 0.00 175.10 175.71 2skd s ASN 453 N 1.57 2.25 0.58 3.32 4.22 -0.72 -0.23 114.94 125.92 2skd s ASN 453 Ca -0.02 -0.82 0.04 0.00 -2.14 0.00 0.00 52.86 49.92 2skd s ASN 453 Cb -0.13 -0.10 0.07 0.00 1.28 0.00 0.00 41.25 42.37 2skd s ASN 453 CO -0.03 -0.10 0.80 -0.83 -2.04 0.00 0.00 177.10 174.90 2skd s GLY 454 N -2.48 1.81 0.00 0.45 0.00 -0.86 -1.57 107.32 104.66 2skd s GLY 454 Ca 0.11 -1.68 0.13 0.00 0.00 0.00 0.00 44.72 43.27 2skd s GLY 454 CO 0.04 -1.30 1.12 3.33 0.00 0.00 0.00 173.10 176.29 2skd n VAL 455 N -2.36 0.54 -3.51 1.40 0.24 -1.26 -2.39 118.33 110.99 2skd n VAL 455 Ca 0.12 -0.77 -0.14 0.00 -2.04 0.00 0.00 64.34 61.51 2skd n VAL 455 Cb 0.60 0.85 -0.04 0.00 -1.47 0.00 0.00 33.84 33.78 2skd n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2skd s ALA 456 N -1.03 -1.78 0.15 2.33 0.00 -1.26 -0.80 121.76 119.37 2skd s ALA 456 Ca 0.21 1.15 -0.19 0.00 0.00 0.00 0.00 51.96 53.13 2skd s ALA 456 Cb 0.12 0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.40 2skd s ALA 456 CO 0.17 -0.49 1.67 -0.09 0.00 0.00 0.00 175.76 177.02 2skd h ARG 457 N 2.53 -0.06 -0.33 0.00 2.43 -1.89 -0.80 114.38 116.26 2skd h ARG 457 Ca -0.26 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 58.82 2skd h ARG 457 Cb 1.20 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 2skd h ARG 457 CO 0.36 -0.04 -0.18 0.97 -1.51 0.00 0.00 179.97 179.57 2skd h ILE 458 N -0.06 1.26 -0.51 1.20 2.10 -1.91 -1.97 117.51 117.62 2skd h ILE 458 Ca 0.15 -1.20 -0.07 0.00 1.08 0.00 0.00 64.86 64.82 2skd h ILE 458 Cb 0.29 1.21 -0.02 0.00 -1.09 0.00 0.00 36.82 37.21 2skd h ILE 458 CO -0.34 0.39 0.04 -0.74 -1.08 0.00 0.00 178.15 176.42 2skd h HIS 459 N 0.54 0.94 -0.30 2.19 2.76 -1.69 -0.44 115.15 119.15 2skd h HIS 459 Ca 0.09 -0.15 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 2skd h HIS 459 Cb 0.62 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 2skd h HIS 459 CO 0.02 0.86 -0.11 0.77 -1.30 0.00 0.00 177.93 178.18 2skd h SER 460 N 0.74 0.48 -0.24 3.26 0.02 -0.98 -1.32 113.55 115.51 2skd h SER 460 Ca 0.15 -0.12 -0.20 0.00 -0.84 0.00 0.00 61.79 60.78 2skd h SER 460 Cb 0.47 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2skd h SER 460 CO 0.02 0.63 -0.62 -0.33 -1.14 0.00 0.00 176.83 175.38 2skd h GLU 461 N 0.46 0.86 -0.66 3.45 4.39 -1.07 -3.05 114.58 118.97 2skd h GLU 461 Ca 0.09 -0.59 -0.00 0.00 0.34 0.00 0.00 59.36 59.19 2skd h GLU 461 Cb 0.47 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.18 2skd h GLU 461 CO 0.03 1.22 0.40 0.82 -1.16 0.00 0.00 179.01 180.31 2skd h ILE 462 N 0.63 1.19 -0.88 3.13 2.04 -0.63 -0.29 117.51 122.70 2skd h ILE 462 Ca -0.01 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 2skd h ILE 462 Cb 1.24 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 2skd h ILE 462 CO 0.14 0.19 0.50 -0.07 0.00 0.00 0.00 178.15 178.91 2skd h LEU 463 N 0.91 1.08 -0.21 1.44 3.38 -1.15 0.25 115.31 121.00 2skd h LEU 463 Ca 0.24 -0.09 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 2skd h LEU 463 Cb -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2skd h LEU 463 CO -0.04 0.86 -0.93 0.11 0.09 0.00 0.00 178.44 178.53 2skd h LYS 464 N 1.22 0.24 0.07 1.13 1.57 -1.26 0.15 116.57 119.68 2skd h LYS 464 Ca 0.31 -0.27 -0.28 0.00 -1.87 0.00 0.00 60.65 58.54 2skd h LYS 464 Cb 0.00 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2skd h LYS 464 CO -0.05 1.01 -1.44 0.87 -0.57 0.00 0.00 179.45 179.27 2skd h LYS 465 N 0.13 0.14 0.00 3.15 1.57 -0.89 -3.31 116.57 117.35 2skd h LYS 465 Ca -0.06 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2skd h LYS 465 Cb 1.57 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.97 2skd h LYS 465 CO 0.15 0.97 0.00 2.41 -0.57 0.00 0.00 179.45 182.40 2skd n THR 466 N -3.35 0.00 -0.29 -0.16 -1.04 0.85 -4.69 114.28 105.61 2skd n THR 466 Ca -0.13 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.00 2skd n THR 466 Cb 1.02 0.00 0.23 0.00 -1.82 0.00 0.00 70.33 69.76 2skd n THR 466 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2skd n ILE 467 N 0.00 -0.35 -1.45 12.58 0.13 -1.24 -1.36 119.36 127.66 2skd n ILE 467 Ca 0.00 1.86 0.02 0.00 -1.10 0.00 0.00 62.75 63.52 2skd n ILE 467 Cb 0.00 -2.70 0.20 0.00 -0.84 0.00 0.00 39.64 36.31 2skd n ILE 467 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 2skd n PHE 468 N -5.22 0.56 -0.13 9.51 3.72 0.51 -4.81 117.46 121.60 2skd n PHE 468 Ca 0.19 -1.47 -0.04 0.00 -0.05 0.00 0.00 57.45 56.08 2skd n PHE 468 Cb 0.62 -0.36 0.02 0.00 -0.94 0.00 0.00 39.48 38.83 2skd n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2skd h LYS 469 N 0.96 -0.05 -0.95 -1.08 3.64 -1.20 -0.35 116.57 117.54 2skd h LYS 469 Ca 0.10 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 2skd h LYS 469 Cb 1.34 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.11 2skd h LYS 469 CO 0.20 -0.03 0.62 -0.44 -2.27 0.00 0.00 179.45 177.52 2skd h ASP 470 N -0.05 1.04 0.14 4.20 3.32 -1.87 -1.10 116.42 122.09 2skd h ASP 470 Ca 0.21 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 2skd h ASP 470 Cb 0.38 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 2skd h ASP 470 CO -0.48 0.71 -0.48 -0.26 -1.72 0.00 0.00 179.24 177.02 2skd h PHE 471 N 1.21 0.48 -0.52 4.55 -1.00 -1.75 -2.42 116.94 117.49 2skd h PHE 471 Ca 0.38 -0.15 -0.09 0.00 2.81 0.00 0.00 57.97 60.91 2skd h PHE 471 Cb -0.01 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 2skd h PHE 471 CO -0.01 0.80 -0.03 -0.92 -1.61 0.00 0.00 178.31 176.54 2skd h TYR 472 N 0.32 1.03 -0.42 -0.55 3.20 -0.45 -1.47 116.97 118.62 2skd h TYR 472 Ca 0.02 -0.19 -0.05 0.00 3.14 0.00 0.00 58.73 61.64 2skd h TYR 472 Cb 0.96 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 2skd h TYR 472 CO 0.03 0.96 0.04 0.93 -1.64 0.00 0.00 178.16 178.48 2skd h GLU 473 N 0.81 0.65 0.01 1.82 5.08 -1.08 -1.05 114.58 120.83 2skd h GLU 473 Ca 0.14 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2skd h GLU 473 Cb 0.57 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2skd h GLU 473 CO 0.03 0.65 -0.00 1.25 -1.00 0.00 0.00 179.01 179.93 2skd h LEU 474 N 0.63 -0.01 -6.47 1.33 6.46 -1.19 -3.40 115.31 112.65 2skd h LEU 474 Ca 0.13 -0.48 -0.59 0.00 -0.12 0.00 0.00 57.88 56.82 2skd h LEU 474 Cb 0.33 0.00 -0.39 0.00 -0.73 0.00 0.00 40.66 39.88 2skd h LEU 474 CO 0.01 0.48 -0.92 -1.61 -0.62 0.00 0.00 178.44 175.78 2skd s GLU 475 N -4.22 1.05 0.56 1.25 2.02 -0.58 -4.98 118.70 113.81 2skd s GLU 475 Ca -0.16 -2.18 0.25 0.00 0.02 0.00 0.00 54.97 52.90 2skd s GLU 475 Cb 0.02 -1.64 1.55 0.00 0.10 0.00 0.00 34.13 34.15 2skd s GLU 475 CO 0.67 -1.36 2.14 -1.00 0.02 0.00 0.00 175.26 175.73 2skd h PRO 476 N 5.74 0.00 0.00 0.39 0.13 -1.42 -2.58 132.00 134.27 2skd h PRO 476 Ca 0.23 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.33 2skd h PRO 476 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 2skd h PRO 476 CO 0.40 0.00 -0.14 1.12 -0.23 0.00 0.00 178.00 179.16 2skd h HIS 477 N 0.00 0.00 -0.27 1.56 2.07 -1.94 -3.19 115.15 113.37 2skd h HIS 477 Ca 0.06 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.42 2skd h HIS 477 Cb 0.30 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.28 2skd h HIS 477 CO 0.00 0.14 -0.48 0.87 -3.07 0.00 0.00 177.93 175.38 2skd h LYS 478 N 0.00 0.74 -6.23 5.12 1.57 -1.70 -3.45 116.57 112.62 2skd h LYS 478 Ca -0.00 -0.43 -0.56 0.00 -1.87 0.00 0.00 60.65 57.79 2skd h LYS 478 Cb 0.48 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 2skd h LYS 478 CO 0.02 1.05 0.75 -0.06 -0.57 0.00 0.00 179.45 180.64 2skd s PHE 479 N -4.18 3.15 0.39 -1.35 0.40 -1.21 -0.84 117.98 114.35 2skd s PHE 479 Ca -0.09 1.24 0.04 0.00 -0.60 0.00 0.00 56.93 57.52 2skd s PHE 479 Cb 0.11 -3.40 -0.02 0.00 0.51 0.00 0.00 43.02 40.22 2skd s PHE 479 CO 0.86 -1.18 0.16 -0.65 0.70 0.00 0.00 175.22 175.12 2skd s GLN 480 N 2.69 1.90 0.05 0.44 -0.21 0.67 -4.94 119.66 120.26 2skd s GLN 480 Ca 0.53 -2.15 0.04 0.00 0.02 0.00 0.00 55.36 53.80 2skd s GLN 480 Cb -0.22 -0.40 -0.03 0.00 1.00 0.00 0.00 33.01 33.37 2skd s GLN 480 CO 0.17 -0.53 -0.12 1.21 -2.12 0.00 0.00 175.29 173.90 2skd s ASN 481 N -3.56 1.46 -0.36 5.90 3.04 -1.26 -2.04 114.94 118.13 2skd s ASN 481 Ca 0.27 -0.54 0.04 0.00 0.04 0.00 0.00 52.86 52.67 2skd s ASN 481 Cb 0.02 -0.05 0.16 0.00 -1.54 0.00 0.00 41.25 39.85 2skd s ASN 481 CO 0.17 -0.07 0.45 -0.54 -3.04 0.00 0.00 177.10 174.07 2skd s LYS 482 N -1.49 0.62 0.22 0.43 -0.14 -1.01 -4.89 119.74 113.49 2skd s LYS 482 Ca -0.03 -0.45 -0.32 0.00 -1.36 0.00 0.00 55.97 53.82 2skd s LYS 482 Cb -0.09 -0.41 -0.12 0.00 -1.68 0.00 0.00 37.83 35.53 2skd s LYS 482 CO 0.02 -1.15 1.69 0.99 -0.76 0.00 0.00 175.35 176.14 2skd s THR 483 N 1.83 2.06 1.22 2.17 2.01 -1.26 -4.26 115.64 119.41 2skd s THR 483 Ca 0.15 0.05 -0.14 0.00 0.31 0.00 0.00 61.69 62.05 2skd s THR 483 Cb -0.12 -3.03 0.29 0.00 0.01 0.00 0.00 72.50 69.65 2skd s THR 483 CO -0.11 0.00 0.88 0.59 -0.69 0.00 0.00 174.62 175.29 2skd n ASN 484 N 3.68 -2.14 -3.80 3.53 5.03 0.02 -4.64 115.26 116.93 2skd n ASN 484 Ca 0.14 -0.26 -0.07 0.00 0.87 0.00 0.00 54.58 55.27 2skd n ASN 484 Cb 0.36 -1.19 -0.02 0.00 -1.02 0.00 0.00 39.78 37.91 2skd n ASN 484 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2skd s GLY 485 N -2.36 -0.06 0.22 7.41 0.00 -1.26 -4.80 107.32 106.47 2skd s GLY 485 Ca 0.67 -0.33 0.09 0.00 0.00 0.00 0.00 44.72 45.15 2skd s GLY 485 CO 0.65 -0.10 -0.17 -0.26 0.00 0.00 0.00 173.10 173.23 2skd s ILE 486 N -3.82 1.95 -0.17 0.90 -4.36 0.65 -4.38 121.20 111.97 2skd s ILE 486 Ca 0.11 -2.22 -0.26 0.00 -0.26 0.00 0.00 60.65 58.03 2skd s ILE 486 Cb -0.06 -2.08 -0.01 0.00 1.25 0.00 0.00 42.46 41.56 2skd s ILE 486 CO 0.07 -0.50 0.86 0.28 0.24 0.00 0.00 174.94 175.89 2skd s THR 487 N -2.71 4.86 -0.98 8.37 -1.32 -1.26 -0.42 115.64 122.18 2skd s THR 487 Ca 0.23 1.68 0.14 0.00 -1.21 0.00 0.00 61.69 62.54 2skd s THR 487 Cb -0.03 -4.16 0.12 0.00 -1.51 0.00 0.00 72.50 66.92 2skd s THR 487 CO 0.09 0.01 1.45 -0.81 -2.21 0.00 0.00 174.62 173.14 2skd n PRO 488 N 5.33 0.01 0.10 7.08 -0.04 -1.26 -1.89 135.00 144.34 2skd n PRO 488 Ca 0.05 0.27 -0.05 0.00 -0.04 0.00 0.00 63.50 63.73 2skd n PRO 488 Cb 0.48 -1.51 -0.02 0.00 -0.04 0.00 0.00 33.50 32.41 2skd n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2skd h ARG 489 N 0.00 -0.31 -0.39 0.54 -0.00 -1.91 -2.59 114.38 109.72 2skd h ARG 489 Ca 0.00 0.02 -0.15 0.00 -0.50 0.00 0.00 59.98 59.35 2skd h ARG 489 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 29.97 30.27 2skd h ARG 489 CO 0.00 -0.21 -0.35 -0.09 0.00 0.00 0.00 179.97 179.32 2skd h ARG 490 N -0.79 0.92 -0.34 0.04 2.43 -1.96 0.15 114.38 114.82 2skd h ARG 490 Ca -0.03 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2skd h ARG 490 Cb 0.25 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2skd h ARG 490 CO 0.05 1.13 0.00 0.91 -1.51 0.00 0.00 179.97 180.55 2skd n TRP 491 N -4.09 0.32 0.00 2.20 7.02 -0.79 -2.73 117.44 119.37 2skd n TRP 491 Ca -0.02 -0.14 0.00 0.00 -1.02 0.00 0.00 57.50 56.32 2skd n TRP 491 Cb 0.53 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 2skd n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2skd n LEU 492 N 0.08 0.00 -0.26 -0.99 7.94 -1.05 -4.80 117.00 117.92 2skd n LEU 492 Ca 0.07 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 55.01 2skd n LEU 492 Cb 0.23 0.05 0.17 0.00 0.53 0.00 0.00 43.42 44.41 2skd n LEU 492 CO 0.05 -0.12 1.06 0.58 -1.11 0.00 0.00 177.39 177.85 2skd h VAL 493 N 0.00 0.75 0.05 1.96 2.07 -1.23 0.49 116.25 120.34 2skd h VAL 493 Ca 0.00 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2skd h VAL 493 Cb 0.00 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 2skd h VAL 493 CO 0.00 0.10 -0.02 0.25 0.02 0.00 0.00 177.57 177.92 2skd h LEU 494 N 0.55 -0.05 0.00 2.57 6.46 -0.83 -3.27 115.31 120.73 2skd h LEU 494 Ca 0.40 -0.60 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 2skd h LEU 494 Cb 0.52 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 2skd h LEU 494 CO -0.34 0.62 -0.40 0.00 -0.62 0.00 0.00 178.44 177.71 2skd n ASN 496 N -2.53 0.54 -0.02 0.00 2.85 0.17 -4.86 115.26 111.40 2skd n ASN 496 Ca 0.03 -2.86 0.03 0.00 -0.11 0.00 0.00 54.58 51.68 2skd n ASN 496 Cb 0.49 -0.63 0.39 0.00 1.24 0.00 0.00 39.78 41.27 2skd n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2skd h PRO 497 N 3.49 0.59 -0.73 1.20 0.13 -1.66 -1.36 132.00 133.66 2skd h PRO 497 Ca 0.09 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2skd h PRO 497 Cb 0.92 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 31.88 2skd h PRO 497 CO 0.48 0.41 0.47 0.78 -0.23 0.00 0.00 178.00 179.91 2skd h GLY 498 N 0.63 1.04 1.62 1.56 0.00 -1.91 0.17 103.07 106.18 2skd h GLY 498 Ca 0.16 -0.37 -0.22 0.00 0.00 0.00 0.00 47.33 46.90 2skd h GLY 498 CO -0.03 0.34 -0.94 -2.00 0.00 0.00 0.00 176.54 173.90 2skd h LEU 499 N 0.94 0.44 -0.93 3.11 5.85 -1.78 -3.02 115.31 119.92 2skd h LEU 499 Ca 0.28 -0.36 -0.05 0.00 0.84 0.00 0.00 57.88 58.58 2skd h LEU 499 Cb -0.05 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2skd h LEU 499 CO -0.08 1.17 0.17 0.00 -0.34 0.00 0.00 178.44 179.36 2skd h ALA 500 N 0.80 1.14 -0.12 1.25 0.00 -0.80 -2.77 119.26 118.76 2skd h ALA 500 Ca -0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2skd h ALA 500 Cb 1.58 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 2skd h ALA 500 CO 0.16 0.59 0.03 1.49 0.00 0.00 0.00 179.25 181.51 2skd h GLU 501 N 0.91 0.19 0.00 0.00 4.57 -0.66 -1.52 114.58 118.07 2skd h GLU 501 Ca 0.20 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.30 2skd h GLU 501 Cb 0.30 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 2skd h GLU 501 CO -0.00 0.36 -0.18 -0.84 -1.18 0.00 0.00 179.01 177.16 2skd h ILE 502 N -0.01 0.56 0.00 2.32 3.07 -1.49 -0.30 117.51 121.66 2skd h ILE 502 Ca 0.04 -0.87 -0.19 0.00 1.55 0.00 0.00 64.86 65.39 2skd h ILE 502 Cb 0.25 1.58 0.02 0.00 -0.27 0.00 0.00 36.82 38.40 2skd h ILE 502 CO 0.00 0.18 -0.75 0.40 -1.05 0.00 0.00 178.15 176.93 2skd h ILE 503 N 0.00 1.38 -0.06 0.16 2.04 -1.38 -3.18 117.51 116.46 2skd h ILE 503 Ca -0.00 -2.14 -0.05 0.00 1.00 0.00 0.00 64.86 63.67 2skd h ILE 503 Cb 0.56 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 2skd h ILE 503 CO 0.02 0.64 -0.18 0.00 0.00 0.00 0.00 178.15 178.63 2skd h ALA 504 N 0.34 1.59 -0.16 1.87 0.00 -0.85 -0.05 119.26 122.00 2skd h ALA 504 Ca -0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2skd h ALA 504 Cb 1.45 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2skd h ALA 504 CO 0.15 0.30 0.00 0.93 0.00 0.00 0.00 179.25 180.63 2skd h GLU 505 N 0.09 0.23 0.01 0.00 5.08 -1.04 -1.02 114.58 117.93 2skd h GLU 505 Ca 0.02 -0.03 -0.40 0.00 -1.00 0.00 0.00 59.36 57.94 2skd h GLU 505 Cb 0.38 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.52 2skd h GLU 505 CO 0.03 0.25 -2.31 0.54 -1.00 0.00 0.00 179.01 176.51 2skd n ARG 506 N -4.40 0.62 -0.12 2.33 5.12 -0.82 -4.74 116.66 114.64 2skd n ARG 506 Ca -0.01 0.27 0.04 0.00 -1.93 0.00 0.00 57.85 56.23 2skd n ARG 506 Cb 0.16 -1.55 0.11 0.00 -1.16 0.00 0.00 32.46 30.02 2skd n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2skd n ILE 507 N -3.91 0.92 -1.39 0.55 -5.35 -0.10 -5.12 119.36 104.96 2skd n ILE 507 Ca -0.47 -0.96 0.00 0.00 -0.27 0.00 0.00 62.75 61.05 2skd n ILE 507 Cb 0.91 0.56 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 2skd n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2skd n GLY 508 N 0.28 -2.41 0.10 3.28 0.00 -0.39 -4.68 105.19 101.38 2skd n GLY 508 Ca 0.08 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.45 2skd n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2skd n GLU 509 N -0.21 1.16 0.16 1.61 1.02 -1.26 -4.02 120.64 119.09 2skd n GLU 509 Ca 0.00 -0.21 0.12 0.00 -0.02 0.00 0.00 57.16 57.05 2skd n GLU 509 Cb 0.00 -1.35 0.58 0.00 -0.02 0.00 0.00 31.44 30.65 2skd n GLU 509 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2skd h GLU 510 N 0.50 0.00 0.00 3.49 4.22 -1.97 -2.77 114.58 118.05 2skd h GLU 510 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 2skd h GLU 510 Cb 0.48 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2skd h GLU 510 CO 0.00 0.00 -0.07 0.10 -2.18 0.00 0.00 179.01 176.86 2skd h TYR 511 N 0.00 0.00 -0.18 0.92 -0.00 -1.80 -2.84 116.97 113.07 2skd h TYR 511 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 58.73 58.78 2skd h TYR 511 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.86 2skd h TYR 511 CO 0.00 0.07 0.13 0.82 -0.00 0.00 0.00 178.16 179.18 2skd h ILE 512 N 0.00 0.90 -0.01 -0.90 1.08 -1.84 -0.64 117.51 116.10 2skd h ILE 512 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2skd h ILE 512 Cb 0.60 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 35.25 2skd h ILE 512 CO 0.01 0.00 0.00 -1.54 -0.69 0.00 0.00 178.15 175.93 2skd n SER 513 N -4.47 2.18 -2.89 1.72 3.41 -1.17 -4.68 113.62 107.72 2skd n SER 513 Ca 0.01 -2.43 -0.13 0.00 -0.26 0.00 0.00 58.87 56.07 2skd n SER 513 Cb 0.27 -0.18 0.03 0.00 -0.26 0.00 0.00 64.21 64.07 2skd n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2skd n ASP 514 N -0.83 -1.54 0.22 4.04 2.03 -0.53 -5.01 116.55 114.92 2skd n ASP 514 Ca 0.07 -3.30 0.16 0.00 0.52 0.00 0.00 54.79 52.23 2skd n ASP 514 Cb 0.41 1.04 0.65 0.00 -0.72 0.00 0.00 41.12 42.50 2skd n ASP 514 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2skd h LEU 515 N 3.45 0.00 -2.28 -2.67 3.38 -1.44 -1.61 115.31 114.15 2skd h LEU 515 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2skd h LEU 515 Cb 1.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2skd h LEU 515 CO 0.31 0.00 0.01 0.44 0.09 0.00 0.00 178.44 179.28 2skd h ASP 516 N 0.00 0.00 0.09 -0.43 3.32 -1.85 -1.76 116.42 115.80 2skd h ASP 516 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2skd h ASP 516 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2skd h ASP 516 CO -0.00 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 179.08 2skd h GLN 517 N 0.00 0.00 0.00 3.56 4.20 -1.62 -2.24 115.11 119.01 2skd h GLN 517 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2skd h GLN 517 Cb 0.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2skd h GLN 517 CO -0.00 0.00 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.09 2skd h LEU 518 N 0.00 0.00 -1.93 1.46 4.07 -1.55 -1.21 115.31 116.15 2skd h LEU 518 Ca 0.00 0.00 0.12 0.00 0.08 0.00 0.00 57.88 58.08 2skd h LEU 518 Cb 0.05 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 2skd h LEU 518 CO 0.00 0.00 0.32 0.03 -1.08 0.00 0.00 178.44 177.72 2skd h ARG 519 N 0.00 0.07 0.00 1.13 3.08 -0.95 0.15 114.38 117.86 2skd h ARG 519 Ca -0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2skd h ARG 519 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2skd h ARG 519 CO 0.00 0.05 0.00 0.87 -1.07 0.00 0.00 179.97 179.82 2skd h LYS 520 N 0.07 0.00 0.00 0.04 1.57 -1.46 -0.52 116.57 116.27 2skd h LYS 520 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2skd h LYS 520 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 2skd h LYS 520 CO -0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.14 2skd n LEU 521 N -2.60 0.26 0.23 2.94 4.77 0.52 -2.97 117.00 120.15 2skd n LEU 521 Ca -0.02 0.55 0.06 0.00 -0.03 0.00 0.00 56.01 56.57 2skd n LEU 521 Cb 0.08 -0.49 0.54 0.00 -2.33 0.00 0.00 43.42 41.22 2skd n LEU 521 CO 0.15 -0.24 0.97 -0.07 -1.33 0.00 0.00 177.39 176.86 2skd h LEU 522 N 0.00 0.02 -0.02 2.23 4.07 -1.25 -1.66 115.31 118.70 2skd h LEU 522 Ca 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2skd h LEU 522 Cb 0.41 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.14 2skd h LEU 522 CO 0.00 0.13 0.00 -1.54 -1.08 0.00 0.00 178.44 175.95 2skd n SER 523 N -4.40 0.03 -0.33 -0.43 3.41 -1.16 -2.71 113.62 108.03 2skd n SER 523 Ca -0.02 -1.36 0.03 0.00 -0.26 0.00 0.00 58.87 57.26 2skd n SER 523 Cb 0.19 -0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.22 2skd n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2skd n TYR 524 N -0.80 0.25 0.30 7.33 4.01 -0.63 -4.65 117.16 122.97 2skd n TYR 524 Ca 0.15 -0.53 0.11 0.00 -0.16 0.00 0.00 57.90 57.48 2skd n TYR 524 Cb 0.08 -0.05 0.52 0.00 -0.31 0.00 0.00 39.34 39.57 2skd n TYR 524 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 2skd n VAL 525 N -0.07 0.93 -0.00 -0.72 3.14 -1.10 -1.57 118.33 118.94 2skd n VAL 525 Ca 0.07 0.42 0.00 0.00 -2.96 0.00 0.00 64.34 61.87 2skd n VAL 525 Cb 0.37 -1.38 0.00 0.00 -1.06 0.00 0.00 33.84 31.77 2skd n VAL 525 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2skd n ASP 526 N -2.23 1.47 -4.66 6.55 8.00 -1.26 -4.88 116.55 119.54 2skd n ASP 526 Ca 0.01 -1.47 -0.43 0.00 0.71 0.00 0.00 54.79 53.61 2skd n ASP 526 Cb 0.15 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 2skd n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2skd s ASP 527 N -0.47 6.91 0.18 -2.24 -1.08 -0.61 -4.93 116.67 114.43 2skd s ASP 527 Ca 0.00 1.76 -0.12 0.00 -0.52 0.00 0.00 52.55 53.67 2skd s ASP 527 Cb 0.00 -2.54 0.09 0.00 -1.46 0.00 0.00 42.92 39.01 2skd s ASP 527 CO 0.00 -0.78 1.80 -0.08 0.52 0.00 0.00 175.17 176.63 2skd h GLU 528 N 8.34 0.85 -0.38 4.34 4.57 -1.94 -2.36 114.58 127.99 2skd h GLU 528 Ca -0.28 -0.09 -0.08 0.00 -1.18 0.00 0.00 59.36 57.72 2skd h GLU 528 Cb 1.11 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2skd h GLU 528 CO 0.97 0.64 -0.08 0.00 -1.18 0.00 0.00 179.01 179.35 2skd h ALA 529 N 1.16 0.53 -0.03 2.92 0.00 -1.95 -2.54 119.26 119.35 2skd h ALA 529 Ca 0.22 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2skd h ALA 529 Cb 0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2skd h ALA 529 CO -0.04 0.38 0.02 0.35 0.00 0.00 0.00 179.25 179.96 2skd h PHE 530 N 0.54 0.05 -0.77 0.00 3.57 -1.86 -0.07 116.94 118.39 2skd h PHE 530 Ca 0.10 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.72 2skd h PHE 530 Cb 0.59 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.23 2skd h PHE 530 CO 0.05 0.12 0.37 0.82 -2.23 0.00 0.00 178.31 177.44 2skd h ILE 531 N -0.04 0.76 -0.72 1.41 2.04 -1.42 0.60 117.51 120.14 2skd h ILE 531 Ca 0.01 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 2skd h ILE 531 Cb 0.09 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 2skd h ILE 531 CO -0.00 0.11 0.19 -0.09 0.00 0.00 0.00 178.15 178.35 2skd h ARG 532 N 0.58 1.14 0.01 2.37 2.43 -1.17 -1.71 114.38 118.02 2skd h ARG 532 Ca 0.40 -0.26 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2skd h ARG 532 Cb 0.52 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2skd h ARG 532 CO -0.33 0.99 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.68 2skd h ASP 533 N 1.08 -0.01 -0.67 -3.80 3.32 0.98 -0.48 116.42 116.85 2skd h ASP 533 Ca 0.23 -0.54 0.11 0.00 0.02 0.00 0.00 57.03 56.84 2skd h ASP 533 Cb 0.36 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.83 2skd h ASP 533 CO -0.00 0.54 0.28 0.58 -1.72 0.00 0.00 179.24 178.92 2skd h VAL 534 N -0.56 0.76 -0.30 -1.35 2.07 0.12 -0.13 116.25 116.86 2skd h VAL 534 Ca -0.00 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 2skd h VAL 534 Cb 0.55 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2skd h VAL 534 CO 0.00 0.09 -0.14 0.00 0.02 0.00 0.00 177.57 177.53 2skd h ALA 535 N 1.45 1.20 -0.19 1.67 0.00 -1.28 -3.04 119.26 119.07 2skd h ALA 535 Ca 0.34 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2skd h ALA 535 Cb 0.44 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2skd h ALA 535 CO -0.32 0.51 -0.16 -0.22 0.00 0.00 0.00 179.25 179.06 2skd h LYS 536 N 0.47 0.44 -0.45 0.00 3.64 0.66 -2.44 116.57 118.89 2skd h LYS 536 Ca 0.08 -0.22 -0.05 0.00 -1.27 0.00 0.00 60.65 59.20 2skd h LYS 536 Cb 0.53 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 2skd h LYS 536 CO 0.03 0.78 0.09 -0.39 -2.27 0.00 0.00 179.45 177.69 2skd h VAL 537 N 0.11 1.21 -0.59 2.00 -1.51 -1.24 0.30 116.25 116.53 2skd h VAL 537 Ca 0.03 -0.76 -0.10 0.00 -1.23 0.00 0.00 66.70 64.65 2skd h VAL 537 Cb 0.68 0.77 -0.02 0.00 -2.13 0.00 0.00 31.29 30.59 2skd h VAL 537 CO 0.04 0.28 -0.01 0.50 -1.23 0.00 0.00 177.57 177.14 2skd h LYS 538 N 0.66 1.05 -0.58 5.19 1.63 -1.52 0.88 116.57 123.87 2skd h LYS 538 Ca 0.15 -0.33 -0.09 0.00 -0.85 0.00 0.00 60.65 59.52 2skd h LYS 538 Cb 0.28 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 2skd h LYS 538 CO 0.00 1.03 -0.00 0.37 -3.45 0.00 0.00 179.45 177.40 2skd h GLN 539 N 0.95 1.03 -0.55 1.90 5.75 -0.87 -0.57 115.11 122.75 2skd h GLN 539 Ca 0.17 -0.33 -0.09 0.00 -0.15 0.00 0.00 58.65 58.25 2skd h GLN 539 Cb 0.57 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.00 2skd h GLN 539 CO 0.03 1.02 -0.00 0.93 -2.65 0.00 0.00 178.83 178.16 2skd h GLU 540 N 0.92 0.94 -0.41 1.69 5.08 -0.67 -2.04 114.58 120.09 2skd h GLU 540 Ca 0.16 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2skd h GLU 540 Cb 0.55 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2skd h GLU 540 CO 0.03 0.93 0.05 -0.91 -1.00 0.00 0.00 179.01 178.12 2skd h ASN 541 N 0.87 0.66 -0.82 1.42 2.35 -0.48 -2.04 115.58 117.53 2skd h ASN 541 Ca 0.16 -0.27 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 2skd h ASN 541 Cb 0.51 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 2skd h ASN 541 CO 0.03 0.77 0.41 0.11 -1.65 0.00 0.00 177.43 177.09 2skd h LYS 542 N 0.54 1.18 -0.73 0.81 1.57 -0.97 -1.54 116.57 117.42 2skd h LYS 542 Ca 0.12 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2skd h LYS 542 Cb 0.39 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 2skd h LYS 542 CO 0.01 0.90 0.22 -0.07 -0.57 0.00 0.00 179.45 179.94 2skd h LEU 543 N 1.16 1.06 -0.61 2.94 3.38 -1.22 0.51 115.31 122.54 2skd h LEU 543 Ca 0.28 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 2skd h LEU 543 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2skd h LEU 543 CO -0.04 0.98 -0.47 0.50 0.09 0.00 0.00 178.44 179.50 2skd h LYS 544 N 1.08 0.55 -0.05 1.13 3.11 -1.06 -2.22 116.57 119.12 2skd h LYS 544 Ca 0.23 -0.31 -0.07 0.00 -2.81 0.00 0.00 60.65 57.70 2skd h LYS 544 Cb 0.31 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.56 2skd h LYS 544 CO -0.01 0.91 -0.23 0.35 -2.81 0.00 0.00 179.45 177.65 2skd h PHE 545 N 0.44 0.33 -0.61 1.91 3.57 -1.02 -1.46 116.94 120.10 2skd h PHE 545 Ca 0.02 -0.14 0.16 0.00 3.53 0.00 0.00 57.97 61.54 2skd h PHE 545 Cb 0.99 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.65 2skd h PHE 545 CO 0.04 0.86 0.43 0.00 -2.23 0.00 0.00 178.31 177.42 2skd h ALA 546 N 0.40 2.43 0.00 2.41 0.00 -0.89 0.80 119.26 124.42 2skd h ALA 546 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2skd h ALA 546 Cb 0.89 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2skd h ALA 546 CO 0.05 -0.61 -0.07 0.00 0.00 0.00 0.00 179.25 178.63 2skd h ALA 547 N 1.70 0.00 -0.83 0.00 0.00 -1.29 -3.17 119.26 115.67 2skd h ALA 547 Ca 0.29 -0.44 0.15 0.00 0.00 0.00 0.00 54.91 54.92 2skd h ALA 547 Cb 1.03 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.72 2skd h ALA 547 CO -0.03 -0.04 0.40 -0.92 0.00 0.00 0.00 179.25 178.66 2skd h TYR 548 N -0.77 0.69 -0.36 0.00 5.03 -0.09 0.81 116.97 122.27 2skd h TYR 548 Ca -0.01 0.04 0.08 0.00 2.58 0.00 0.00 58.73 61.41 2skd h TYR 548 Cb 0.90 -0.18 -0.08 0.00 1.55 0.00 0.00 36.73 38.92 2skd h TYR 548 CO 0.22 0.12 -0.16 1.25 -1.32 0.00 0.00 178.16 178.27 2skd h LEU 549 N 0.55 -0.55 -0.63 2.82 5.85 -0.93 -0.27 115.31 122.16 2skd h LEU 549 Ca 0.46 0.13 -0.15 0.00 0.84 0.00 0.00 57.88 59.17 2skd h LEU 549 Cb 0.70 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2skd h LEU 549 CO -0.39 -0.19 -0.61 -0.33 -0.34 0.00 0.00 178.44 176.57 2skd h GLU 550 N -0.09 0.25 0.05 1.25 5.08 -1.16 0.67 114.58 120.63 2skd h GLU 550 Ca 0.18 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2skd h GLU 550 Cb 0.37 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2skd h GLU 550 CO -0.43 0.79 -0.03 0.00 -1.00 0.00 0.00 179.01 178.34 2skd h ARG 551 N 0.18 -0.07 0.00 2.33 3.08 0.07 -3.05 114.38 116.93 2skd h ARG 551 Ca -0.01 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2skd h ARG 551 Cb 1.12 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2skd h ARG 551 CO 0.10 -0.05 -0.69 0.93 -1.07 0.00 0.00 179.97 179.19 2skd h GLU 552 N -0.07 0.00 0.00 0.04 3.07 -1.20 -3.41 114.58 113.02 2skd h GLU 552 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2skd h GLU 552 Cb 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2skd h GLU 552 CO 0.01 0.26 -0.90 0.66 -1.40 0.00 0.00 179.01 177.64 2skd n TYR 553 N -3.02 0.00 -2.68 4.33 4.01 -0.08 -5.08 117.16 114.63 2skd n TYR 553 Ca -0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.71 2skd n TYR 553 Cb 0.68 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.69 2skd n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2skd n LYS 554 N -1.40 -3.94 0.00 -0.72 4.76 0.03 -4.96 118.16 111.94 2skd n LYS 554 Ca 0.00 3.06 0.00 0.00 -2.87 0.00 0.00 58.31 58.50 2skd n LYS 554 Cb 0.00 -5.29 0.00 0.00 -1.84 0.00 0.00 35.03 27.90 2skd n LYS 554 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2skd n VAL 555 N 1.08 0.00 -0.88 -0.18 0.24 -1.26 -5.01 118.33 112.32 2skd n VAL 555 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2skd n VAL 555 Cb 0.25 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 2skd n VAL 555 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 2skd n HIS 556 N 0.00 0.00 -3.95 6.34 -0.00 -1.26 -5.08 115.22 111.28 2skd n HIS 556 Ca 0.00 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.09 2skd n HIS 556 Cb 0.00 -0.19 -0.07 0.00 -0.12 0.00 0.00 29.99 29.60 2skd n HIS 556 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 2skd s ILE 557 N -3.14 0.10 -0.36 3.57 -4.36 -1.26 -5.10 121.20 110.65 2skd s ILE 557 Ca 0.00 -1.38 -0.10 0.00 -0.26 0.00 0.00 60.65 58.91 2skd s ILE 557 Cb 0.00 -1.68 0.02 0.00 1.25 0.00 0.00 42.46 42.05 2skd s ILE 557 CO 0.00 -0.45 0.18 0.21 0.24 0.00 0.00 174.94 175.12 2skd s ASN 558 N -2.94 5.63 0.00 4.36 2.47 -1.26 -4.98 114.94 118.22 2skd s ASN 558 Ca 0.13 -0.93 0.09 0.00 0.42 0.00 0.00 52.86 52.58 2skd s ASN 558 Cb 0.04 -1.99 0.52 0.00 -1.45 0.00 0.00 41.25 38.37 2skd s ASN 558 CO -0.04 -0.34 1.09 -2.65 -3.72 0.00 0.00 177.10 171.44 2skd n PRO 559 N 4.97 0.22 0.01 0.43 -0.02 -1.26 -2.25 135.00 137.10 2skd n PRO 559 Ca -0.12 0.10 0.11 0.00 -2.02 0.00 0.00 63.50 61.56 2skd n PRO 559 Cb 0.46 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.46 2skd n PRO 559 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2skd n ASN 560 N -1.14 0.67 -4.88 2.55 5.03 -1.26 -4.89 115.26 111.33 2skd n ASN 560 Ca 0.06 -0.43 -0.29 0.00 0.87 0.00 0.00 54.58 54.78 2skd n ASN 560 Cb 0.05 0.82 0.08 0.00 -1.02 0.00 0.00 39.78 39.72 2skd n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2skd s SER 561 N -3.52 4.65 -0.13 6.41 1.04 -0.95 -4.95 113.70 116.24 2skd s SER 561 Ca 0.06 0.90 -0.29 0.00 0.48 0.00 0.00 55.95 57.10 2skd s SER 561 Cb 0.15 -1.49 -0.01 0.00 0.10 0.00 0.00 66.02 64.77 2skd s SER 561 CO 0.81 -1.83 1.10 -0.22 0.98 0.00 0.00 173.24 174.08 2skd s LEU 562 N -5.57 4.22 -0.72 2.42 0.20 0.18 -4.81 118.68 114.60 2skd s LEU 562 Ca 0.61 1.60 -0.24 0.00 0.69 0.00 0.00 54.13 56.79 2skd s LEU 562 Cb -0.11 -3.55 0.06 0.00 -0.43 0.00 0.00 46.19 42.16 2skd s LEU 562 CO 0.50 -0.57 1.09 -0.36 -0.29 0.00 0.00 176.35 176.72 2skd s PHE 563 N 2.51 2.58 -0.57 5.38 0.40 -1.26 -0.95 117.98 126.06 2skd s PHE 563 Ca 0.50 -0.48 -0.20 0.00 -0.60 0.00 0.00 56.93 56.16 2skd s PHE 563 Cb -0.20 -4.41 0.08 0.00 0.51 0.00 0.00 43.02 39.00 2skd s PHE 563 CO 0.16 -1.78 0.74 0.34 0.70 0.00 0.00 175.22 175.38 2skd s ASP 564 N 3.76 6.20 -0.04 1.36 -1.08 0.35 -1.66 116.67 125.57 2skd s ASP 564 Ca 0.28 -1.13 0.04 0.00 -0.52 0.00 0.00 52.55 51.22 2skd s ASP 564 Cb -0.13 -2.33 -0.00 0.00 -1.46 0.00 0.00 42.92 39.00 2skd s ASP 564 CO 0.09 -1.11 -0.17 0.54 0.52 0.00 0.00 175.17 175.04 2skd s VAL 565 N 2.99 1.39 -0.29 1.11 0.11 -0.76 0.75 120.40 125.71 2skd s VAL 565 Ca 0.16 -0.70 0.01 0.00 -2.93 0.00 0.00 61.98 58.51 2skd s VAL 565 Cb -0.21 -1.20 0.08 0.00 -1.53 0.00 0.00 36.38 33.53 2skd s VAL 565 CO 0.09 0.40 0.03 -1.58 -3.33 0.00 0.00 175.10 170.72 2skd s GLN 566 N 0.00 1.25 -0.15 1.54 0.74 -0.08 -2.66 119.66 120.30 2skd s GLN 566 Ca -0.03 -1.26 0.01 0.00 0.05 0.00 0.00 55.36 54.13 2skd s GLN 566 Cb -0.11 -2.55 0.02 0.00 1.10 0.00 0.00 33.01 31.47 2skd s GLN 566 CO 0.02 -0.83 -0.15 0.14 -0.55 0.00 0.00 175.29 173.92 2skd s VAL 567 N 1.34 1.65 -0.05 1.34 -7.23 -1.26 -2.00 120.40 114.18 2skd s VAL 567 Ca 0.04 -0.69 -0.30 0.00 -1.81 0.00 0.00 61.98 59.22 2skd s VAL 567 Cb -0.18 -1.53 0.11 0.00 0.56 0.00 0.00 36.38 35.33 2skd s VAL 567 CO -0.13 0.47 1.34 -1.59 -0.31 0.00 0.00 175.10 174.88 2skd s LYS 568 N 1.37 0.21 0.54 4.82 0.00 -0.91 -4.99 119.74 120.78 2skd s LYS 568 Ca 0.03 -0.13 -0.21 0.00 0.00 0.00 0.00 55.97 55.66 2skd s LYS 568 Cb -0.13 0.06 -0.05 0.00 0.00 0.00 0.00 37.83 37.71 2skd s LYS 568 CO -0.10 -0.10 1.22 1.03 0.00 0.00 0.00 175.35 177.41 2skd s ARG 569 N -2.06 3.29 -0.17 1.78 1.81 -1.26 -3.97 118.95 118.37 2skd s ARG 569 Ca 0.27 1.89 -0.29 0.00 -1.72 0.00 0.00 55.73 55.88 2skd s ARG 569 Cb 0.02 -2.16 -0.01 0.00 -0.45 0.00 0.00 34.95 32.34 2skd s ARG 569 CO -0.03 -0.97 1.16 0.42 -0.68 0.00 0.00 175.30 175.21 2skd s ILE 570 N -1.52 4.45 0.07 1.52 -1.09 -0.53 -4.89 121.20 119.22 2skd s ILE 570 Ca 0.71 1.75 -0.07 0.00 -2.23 0.00 0.00 60.65 60.81 2skd s ILE 570 Cb -0.32 -4.13 -0.01 0.00 -1.58 0.00 0.00 42.46 36.43 2skd s ILE 570 CO 0.37 -0.12 0.15 -1.00 -1.23 0.00 0.00 174.94 173.10 2skd s HIS 571 N 3.13 0.21 0.17 3.97 3.76 -1.26 -4.77 115.29 120.50 2skd s HIS 571 Ca 0.51 -0.63 0.08 0.00 -0.15 0.00 0.00 55.06 54.87 2skd s HIS 571 Cb -0.20 -0.12 -0.01 0.00 1.11 0.00 0.00 32.58 33.37 2skd s HIS 571 CO 0.13 -0.49 1.40 0.93 -0.85 0.00 0.00 174.74 175.85 2skd h GLU 572 N 2.95 0.01 0.00 1.40 5.08 -1.97 -3.21 114.58 118.83 2skd h GLU 572 Ca -0.34 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.96 2skd h GLU 572 Cb 1.19 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2skd h GLU 572 CO 0.57 0.87 -0.21 0.10 -1.00 0.00 0.00 179.01 179.34 2skd h TYR 573 N 0.01 0.00 0.00 4.33 -0.00 -1.97 -2.97 116.97 116.36 2skd h TYR 573 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.72 2skd h TYR 573 Cb 1.53 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.26 2skd h TYR 573 CO 0.00 0.21 0.00 0.87 -0.00 0.00 0.00 178.16 179.24 2skd h LYS 574 N 0.00 0.00 -5.54 0.10 1.79 -1.90 -3.05 116.57 107.97 2skd h LYS 574 Ca -0.00 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.15 2skd h LYS 574 Cb 0.94 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 31.75 2skd h LYS 574 CO 0.03 0.00 -0.74 0.54 -1.08 0.00 0.00 179.45 178.19 2skd n ARG 575 N -3.02 -6.45 0.27 3.15 1.74 -1.12 -3.95 116.66 107.27 2skd n ARG 575 Ca 0.04 0.82 0.11 0.00 -0.77 0.00 0.00 57.85 58.06 2skd n ARG 575 Cb 0.50 -5.76 0.75 0.00 -1.02 0.00 0.00 32.46 26.93 2skd n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2skd h GLN 576 N -1.86 0.00 -0.51 5.56 7.50 -1.87 -0.81 115.11 123.13 2skd h GLN 576 Ca -0.57 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 58.55 2skd h GLN 576 Cb 1.33 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.84 2skd h GLN 576 CO 0.49 0.05 0.18 -0.07 -1.50 0.00 0.00 178.83 177.97 2skd h LEU 577 N 0.00 0.67 -0.93 1.46 3.38 -1.89 0.14 115.31 118.14 2skd h LEU 577 Ca -0.00 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 2skd h LEU 577 Cb 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2skd h LEU 577 CO 0.01 0.63 -0.26 0.25 0.09 0.00 0.00 178.44 179.15 2skd h LEU 578 N 0.73 0.48 -0.39 1.67 5.85 -1.51 -1.08 115.31 121.06 2skd h LEU 578 Ca 0.17 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 2skd h LEU 578 Cb 0.18 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2skd h LEU 578 CO -0.01 0.74 -0.03 -1.13 -0.34 0.00 0.00 178.44 177.67 2skd h ASN 579 N 0.42 0.70 -0.32 1.25 -0.00 -1.11 -2.88 115.58 113.66 2skd h ASN 579 Ca 0.06 -0.32 0.05 0.00 -0.00 0.00 0.00 56.30 56.08 2skd h ASN 579 Cb 0.68 -0.19 -0.04 0.00 -0.00 0.00 0.00 38.32 38.77 2skd h ASN 579 CO 0.05 0.86 0.06 0.00 -0.00 0.00 0.00 177.43 178.40 2skd h LEU 581 N 0.17 0.62 -0.15 0.00 3.38 -1.07 -0.88 115.31 117.38 2skd h LEU 581 Ca 0.15 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 2skd h LEU 581 Cb 0.16 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2skd h LEU 581 CO -0.20 0.34 -0.22 -0.74 0.09 0.00 0.00 178.44 177.71 2skd h HIS 582 N 0.67 0.52 -0.60 1.13 2.76 -1.13 -1.94 115.15 116.56 2skd h HIS 582 Ca 0.41 -0.17 0.06 0.00 -2.20 0.00 0.00 60.37 58.46 2skd h HIS 582 Cb 0.64 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.45 2skd h HIS 582 CO -0.00 0.85 0.31 0.28 -1.30 0.00 0.00 177.93 178.07 2skd h VAL 583 N 0.05 0.95 -0.35 5.26 2.07 -0.30 -0.88 116.25 123.04 2skd h VAL 583 Ca 0.02 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 67.25 2skd h VAL 583 Cb 0.79 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2skd h VAL 583 CO 0.05 0.11 -0.14 0.40 0.02 0.00 0.00 177.57 178.01 2skd h ILE 584 N 0.59 1.25 -0.60 4.57 2.04 -1.19 -2.21 117.51 121.95 2skd h ILE 584 Ca 0.27 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.96 2skd h ILE 584 Cb 0.18 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 2skd h ILE 584 CO -0.18 0.37 0.20 0.74 0.00 0.00 0.00 178.15 179.28 2skd h THR 585 N 0.57 1.24 -0.37 -0.27 2.02 -0.50 -0.58 112.91 115.02 2skd h THR 585 Ca 0.10 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 2skd h THR 585 Cb 0.56 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2skd h THR 585 CO 0.04 0.31 0.21 -0.07 0.37 0.00 0.00 175.52 176.37 2skd h LEU 586 N 0.85 0.46 -0.21 2.58 4.07 -0.95 -1.10 115.31 121.01 2skd h LEU 586 Ca 0.20 -0.08 0.01 0.00 0.08 0.00 0.00 57.88 58.09 2skd h LEU 586 Cb 0.27 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 2skd h LEU 586 CO -0.01 0.40 0.09 0.22 -1.08 0.00 0.00 178.44 178.07 2skd h TYR 587 N 0.48 0.18 -0.29 1.13 3.20 -1.14 -1.69 116.97 118.83 2skd h TYR 587 Ca 0.13 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2skd h TYR 587 Cb 0.04 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 2skd h TYR 587 CO -0.03 0.10 -0.06 -0.91 -1.64 0.00 0.00 178.16 175.62 2skd h ASN 588 N 0.21 0.44 -0.02 -2.11 2.35 -0.89 -1.45 115.58 114.10 2skd h ASN 588 Ca 0.09 -0.09 -0.16 0.00 -0.55 0.00 0.00 56.30 55.58 2skd h ASN 588 Cb 0.03 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 2skd h ASN 588 CO -0.07 0.55 -0.54 0.03 -1.65 0.00 0.00 177.43 175.75 2skd h ARG 589 N 0.44 0.60 -0.47 0.81 3.08 -0.94 -2.26 114.38 115.65 2skd h ARG 589 Ca 0.09 -0.37 -0.10 0.00 0.07 0.00 0.00 59.98 59.67 2skd h ARG 589 Cb 0.38 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2skd h ARG 589 CO 0.02 0.99 -0.09 0.82 -1.07 0.00 0.00 179.97 180.63 2skd h ILE 590 N 0.47 1.27 0.00 2.04 2.04 -0.93 -2.13 117.51 120.26 2skd h ILE 590 Ca 0.01 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2skd h ILE 590 Cb 1.09 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 2skd h ILE 590 CO 0.10 0.42 0.00 0.11 0.00 0.00 0.00 178.15 178.78 2skd h LYS 591 N 0.74 0.00 0.13 2.37 1.79 -1.19 -0.48 116.57 119.92 2skd h LYS 591 Ca 0.12 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.36 2skd h LYS 591 Cb 0.63 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.29 2skd h LYS 591 CO 0.04 0.00 -1.09 -0.22 -1.08 0.00 0.00 179.45 177.10 2skd h LYS 592 N 0.00 0.27 -2.73 3.15 1.63 -1.08 -3.40 116.57 114.40 2skd h LYS 592 Ca 0.00 -0.46 -0.60 0.00 -0.85 0.00 0.00 60.65 58.74 2skd h LYS 592 Cb 0.44 0.17 -0.40 0.00 -0.60 0.00 0.00 32.23 31.84 2skd h LYS 592 CO 0.00 1.22 -0.78 -1.21 -3.45 0.00 0.00 179.45 175.23 2skd s GLU 593 N -2.45 1.60 0.21 1.90 2.02 -0.83 -4.99 118.70 116.16 2skd s GLU 593 Ca -0.17 -2.62 -0.10 0.00 0.02 0.00 0.00 54.97 52.11 2skd s GLU 593 Cb 0.03 -2.36 0.19 0.00 0.10 0.00 0.00 34.13 32.09 2skd s GLU 593 CO 0.80 -1.32 1.85 -1.35 0.02 0.00 0.00 175.26 175.26 2skd h PRO 594 N 5.66 0.87 -0.92 0.39 0.11 -1.32 -3.05 132.00 133.74 2skd h PRO 594 Ca 0.19 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.16 2skd h PRO 594 Cb 0.85 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 31.71 2skd h PRO 594 CO 0.53 0.58 0.10 0.09 -0.21 0.00 0.00 178.00 179.08 2skd n ASN 595 N -4.64 2.91 -4.75 -2.05 4.13 -1.26 -4.84 115.26 104.76 2skd n ASN 595 Ca 0.08 -2.42 -0.35 0.00 1.68 0.00 0.00 54.58 53.57 2skd n ASN 595 Cb 0.08 -0.59 -0.08 0.00 -1.54 0.00 0.00 39.78 37.65 2skd n ASN 595 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2skd s LYS 596 N -1.38 3.11 0.08 3.52 2.20 -1.15 -5.08 119.74 121.03 2skd s LYS 596 Ca 0.19 -0.36 -0.30 0.00 -0.36 0.00 0.00 55.97 55.14 2skd s LYS 596 Cb 0.15 -2.90 -0.05 0.00 -1.51 0.00 0.00 37.83 33.52 2skd s LYS 596 CO 0.05 0.71 0.98 0.12 -0.36 0.00 0.00 175.35 176.85 2skd s PHE 597 N -0.98 3.75 0.03 4.03 5.36 -1.26 -5.04 117.98 123.85 2skd s PHE 597 Ca 0.16 1.75 0.01 0.00 -0.96 0.00 0.00 56.93 57.89 2skd s PHE 597 Cb -0.12 -3.10 -0.02 0.00 -0.34 0.00 0.00 43.02 39.45 2skd s PHE 597 CO 0.05 0.05 -0.06 0.14 -1.46 0.00 0.00 175.22 173.94 2skd s VAL 598 N 0.28 0.39 0.04 3.12 -7.23 -1.26 -5.12 120.40 110.63 2skd s VAL 598 Ca 0.49 -0.80 -0.30 0.00 -1.81 0.00 0.00 61.98 59.56 2skd s VAL 598 Cb -0.23 -0.44 -0.08 0.00 0.56 0.00 0.00 36.38 36.19 2skd s VAL 598 CO 0.30 -0.28 1.67 -0.69 -0.31 0.00 0.00 175.10 175.79 2skd s VAL 599 N -1.05 3.15 0.44 1.32 1.01 -1.26 -4.96 120.40 119.06 2skd s VAL 599 Ca -0.08 0.51 -0.25 0.00 0.00 0.00 0.00 61.98 62.16 2skd s VAL 599 Cb -0.08 -3.33 -0.08 0.00 0.00 0.00 0.00 36.38 32.90 2skd s VAL 599 CO -0.00 -0.01 1.35 -2.84 0.00 0.00 0.00 175.10 173.60 2skd s PRO 600 N 3.03 3.75 -0.02 2.72 0.02 -1.26 -4.92 135.00 138.31 2skd s PRO 600 Ca 0.75 2.25 -0.03 0.00 0.02 0.00 0.00 61.00 63.99 2skd s PRO 600 Cb -0.39 -2.64 0.00 0.00 0.02 0.00 0.00 34.50 31.50 2skd s PRO 600 CO 0.32 -0.71 0.08 1.03 -0.33 0.00 0.00 177.00 177.39 2skd s ARG 601 N -2.43 0.15 -0.31 5.54 0.52 -0.72 -0.64 118.95 121.07 2skd s ARG 601 Ca 0.61 -0.00 -0.00 0.00 -0.52 0.00 0.00 55.73 55.81 2skd s ARG 601 Cb -0.40 0.07 0.06 0.00 0.52 0.00 0.00 34.95 35.20 2skd s ARG 601 CO 0.51 -0.02 0.01 0.99 0.02 0.00 0.00 175.30 176.80 2skd s THR 602 N -0.24 2.80 -0.29 0.02 2.01 -0.13 -2.06 115.64 117.76 2skd s THR 602 Ca -0.03 -1.61 -0.12 0.00 0.31 0.00 0.00 61.69 60.24 2skd s THR 602 Cb -0.02 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 2skd s THR 602 CO 0.00 -0.21 0.25 0.68 -0.69 0.00 0.00 174.62 174.65 2skd s VAL 603 N 1.18 5.26 -0.19 3.82 -7.23 -0.54 -0.49 120.40 122.21 2skd s VAL 603 Ca -0.03 0.22 -0.04 0.00 -1.81 0.00 0.00 61.98 60.32 2skd s VAL 603 Cb -0.20 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.11 2skd s VAL 603 CO -0.03 0.18 -0.04 -0.04 -0.31 0.00 0.00 175.10 174.86 2skd s MET 604 N 1.85 3.50 -0.11 4.82 -1.94 0.23 -1.83 119.30 125.83 2skd s MET 604 Ca 0.09 -0.58 0.03 0.00 -1.71 0.00 0.00 55.69 53.52 2skd s MET 604 Cb -0.16 -2.97 0.01 0.00 2.01 0.00 0.00 34.83 33.71 2skd s MET 604 CO 0.11 -0.01 -0.21 0.42 -0.01 0.00 0.00 175.02 175.31 2skd s ILE 605 N 1.01 1.89 0.03 2.53 1.01 -0.72 -0.90 121.20 126.05 2skd s ILE 605 Ca 0.01 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 59.68 2skd s ILE 605 Cb -0.15 -1.66 -0.00 0.00 0.01 0.00 0.00 42.46 40.66 2skd s ILE 605 CO 0.01 0.52 0.13 -0.83 0.00 0.00 0.00 174.94 174.77 2skd s GLY 606 N 0.55 0.10 0.00 6.18 0.00 -0.85 -0.65 107.32 112.65 2skd s GLY 606 Ca -0.15 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2skd s GLY 606 CO 0.05 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.24 2skd n GLY 607 N 0.92 3.26 3.79 0.20 0.00 -1.25 -2.15 105.19 109.96 2skd n GLY 607 Ca -0.20 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2skd n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2skd s LYS 608 N -2.19 3.01 -0.02 1.61 1.02 -1.26 -4.74 119.74 117.18 2skd s LYS 608 Ca 0.00 -0.57 0.02 0.00 0.02 0.00 0.00 55.97 55.44 2skd s LYS 608 Cb 0.00 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.46 2skd s LYS 608 CO 0.00 0.61 -0.06 0.00 -0.92 0.00 0.00 175.35 174.98 2skd s ALA 609 N -1.30 3.05 0.42 5.17 0.00 -1.26 -1.45 121.76 126.39 2skd s ALA 609 Ca 0.27 -0.97 -0.26 0.00 0.00 0.00 0.00 51.96 50.99 2skd s ALA 609 Cb -0.12 -1.19 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 2skd s ALA 609 CO 0.19 0.61 1.34 0.00 0.00 0.00 0.00 175.76 177.89 2skd s ALA 610 N -0.96 3.26 0.45 0.00 0.00 -1.26 -4.90 121.76 118.36 2skd s ALA 610 Ca 0.16 1.30 0.23 0.00 0.00 0.00 0.00 51.96 53.65 2skd s ALA 610 Cb -0.11 -3.51 1.24 0.00 0.00 0.00 0.00 23.12 20.73 2skd s ALA 610 CO 0.06 -0.92 1.83 -1.35 0.00 0.00 0.00 175.76 175.39 2skd h PRO 611 N 2.60 0.25 -0.08 0.00 0.11 -1.99 -1.86 132.00 131.04 2skd h PRO 611 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2skd h PRO 611 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2skd h PRO 611 CO 0.62 0.17 0.00 0.41 -0.21 0.00 0.00 178.00 178.99 2skd n GLY 612 N -1.58 0.93 3.53 -0.55 0.00 -1.26 -4.78 105.19 101.48 2skd n GLY 612 Ca 0.22 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 2skd n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2skd s TYR 613 N -1.92 2.89 0.16 1.61 6.14 -0.70 -4.87 117.35 120.66 2skd s TYR 613 Ca 0.31 -1.41 -0.21 0.00 0.64 0.00 0.00 57.07 56.40 2skd s TYR 613 Cb 0.20 -4.57 0.06 0.00 0.42 0.00 0.00 41.96 38.07 2skd s TYR 613 CO 0.31 -1.72 1.63 1.25 0.64 0.00 0.00 175.55 177.66 2skd h HIS 614 N 8.48 -0.57 -0.76 4.97 -0.00 -1.86 -2.24 115.15 123.16 2skd h HIS 614 Ca 0.29 0.04 0.07 0.00 -0.00 0.00 0.00 60.37 60.77 2skd h HIS 614 Cb 0.95 0.30 -0.06 0.00 -0.00 0.00 0.00 27.41 28.59 2skd h HIS 614 CO 1.27 -0.30 0.43 1.98 -0.00 0.00 0.00 177.93 181.32 2skd h MET 615 N -0.19 0.75 -0.85 5.26 -1.53 -1.98 -1.33 114.93 115.06 2skd h MET 615 Ca 0.16 -0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.35 2skd h MET 615 Cb 0.44 -0.17 -0.04 0.00 -0.55 0.00 0.00 31.60 31.28 2skd h MET 615 CO -0.43 0.49 0.43 0.00 0.14 0.00 0.00 176.91 177.55 2skd h ALA 616 N 1.40 1.16 0.00 0.39 0.00 -1.77 -1.10 119.26 119.33 2skd h ALA 616 Ca 0.35 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2skd h ALA 616 Cb 0.26 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2skd h ALA 616 CO -0.21 0.65 -0.43 0.87 0.00 0.00 0.00 179.25 180.13 2skd h LYS 617 N 1.20 0.00 -0.02 0.00 1.57 -0.84 -2.55 116.57 115.93 2skd h LYS 617 Ca 0.29 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.92 2skd h LYS 617 Cb 0.08 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2skd h LYS 617 CO -0.04 0.43 -0.70 0.52 -0.57 0.00 0.00 179.45 179.09 2skd h MET 618 N 0.00 0.10 -0.15 3.15 2.86 -0.53 -2.81 114.93 117.54 2skd h MET 618 Ca -0.00 -0.08 -0.16 0.00 -2.06 0.00 0.00 59.70 57.40 2skd h MET 618 Cb 0.91 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 2skd h MET 618 CO 0.06 0.75 -0.58 0.82 1.06 0.00 0.00 176.91 179.02 2skd h ILE 619 N 0.06 1.34 -0.56 -1.22 2.04 -0.84 -2.22 117.51 116.11 2skd h ILE 619 Ca -0.01 -1.87 -0.08 0.00 1.00 0.00 0.00 64.86 63.90 2skd h ILE 619 Cb 1.23 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 2skd h ILE 619 CO 0.10 0.57 0.02 0.40 0.00 0.00 0.00 178.15 179.23 2skd h ILE 620 N 0.36 1.26 -0.09 -0.67 2.04 -1.37 -1.83 117.51 117.21 2skd h ILE 620 Ca -0.00 -1.07 -0.11 0.00 1.00 0.00 0.00 64.86 64.68 2skd h ILE 620 Cb 1.12 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2skd h ILE 620 CO 0.10 0.39 -0.42 0.50 0.00 0.00 0.00 178.15 178.72 2skd h LYS 621 N 0.88 0.21 -0.31 2.37 1.63 -1.37 -2.29 116.57 117.69 2skd h LYS 621 Ca 0.16 -0.10 -0.10 0.00 -0.85 0.00 0.00 60.65 59.77 2skd h LYS 621 Cb 0.49 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.11 2skd h LYS 621 CO 0.02 0.60 -0.18 1.25 -3.45 0.00 0.00 179.45 177.69 2skd h LEU 622 N 0.17 0.69 -0.12 5.20 6.46 -1.05 -0.23 115.31 126.43 2skd h LEU 622 Ca 0.01 -0.42 0.01 0.00 -0.12 0.00 0.00 57.88 57.36 2skd h LEU 622 Cb 0.83 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.55 2skd h LEU 622 CO 0.06 0.96 0.05 0.40 -0.62 0.00 0.00 178.44 179.30 2skd h ILE 623 N 0.42 0.99 0.00 4.05 2.04 -1.16 0.10 117.51 123.96 2skd h ILE 623 Ca 0.06 -0.04 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 2skd h ILE 623 Cb 0.72 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2skd h ILE 623 CO 0.05 0.02 -0.41 0.71 0.00 0.00 0.00 178.15 178.53 2skd h THR 624 N 0.12 1.27 -0.58 -0.27 1.35 -1.39 -1.94 112.91 111.46 2skd h THR 624 Ca 0.05 -1.41 -0.10 0.00 -0.55 0.00 0.00 66.41 64.39 2skd h THR 624 Cb 0.01 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.18 2skd h THR 624 CO -0.04 0.40 -0.04 0.00 -0.25 0.00 0.00 175.52 175.59 2skd h ALA 625 N 1.59 0.82 -0.56 6.62 0.00 -0.28 -1.23 119.26 126.21 2skd h ALA 625 Ca -0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 2skd h ALA 625 Cb 0.73 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2skd h ALA 625 CO 0.05 0.67 -0.08 0.82 0.00 0.00 0.00 179.25 180.71 2skd h ILE 626 N 0.95 1.27 -0.68 0.00 2.04 -0.53 -2.88 117.51 117.68 2skd h ILE 626 Ca 0.16 -1.24 -0.02 0.00 1.00 0.00 0.00 64.86 64.76 2skd h ILE 626 Cb 0.61 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2skd h ILE 626 CO 0.04 0.44 0.33 1.23 0.00 0.00 0.00 178.15 180.19 2skd h GLY 627 N 0.95 1.02 1.07 5.37 0.00 -0.99 -0.39 103.07 110.10 2skd h GLY 627 Ca 0.15 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 47.01 2skd h GLY 627 CO 0.04 0.46 0.62 -0.55 0.00 0.00 0.00 176.54 177.11 2skd h ASP 628 N 0.95 1.09 0.01 0.19 3.32 -1.02 -0.40 116.42 120.56 2skd h ASP 628 Ca 0.24 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 2skd h ASP 628 Cb 0.09 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.36 2skd h ASP 628 CO -0.03 0.80 -0.01 0.58 -1.72 0.00 0.00 179.24 178.86 2skd h VAL 629 N 1.28 0.65 -0.38 -1.35 2.07 -1.37 -3.33 116.25 113.82 2skd h VAL 629 Ca 0.34 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.41 2skd h VAL 629 Cb -0.14 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2skd h VAL 629 CO -0.07 0.22 0.23 0.58 0.02 0.00 0.00 177.57 178.54 2skd h VAL 630 N -1.00 1.04 0.00 2.57 2.07 -1.11 -2.78 116.25 117.04 2skd h VAL 630 Ca -0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2skd h VAL 630 Cb 0.37 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2skd h VAL 630 CO 0.00 0.08 0.00 0.59 0.02 0.00 0.00 177.57 178.27 2skd n ASN 631 N -4.87 0.00 -0.15 0.57 3.02 -0.16 -2.93 115.26 110.74 2skd n ASN 631 Ca 0.01 0.08 0.05 0.00 -0.03 0.00 0.00 54.58 54.69 2skd n ASN 631 Cb 0.06 -0.29 0.08 0.00 -0.61 0.00 0.00 39.78 39.01 2skd n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2skd n HIS 632 N -1.29 0.00 -3.22 3.10 8.25 -1.06 -4.97 115.22 116.03 2skd n HIS 632 Ca 0.07 -0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 56.49 2skd n HIS 632 Cb 0.12 -0.10 -0.08 0.00 1.12 0.00 0.00 29.99 31.06 2skd n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2skd s ASP 633 N -1.96 6.30 0.36 0.41 -1.08 -1.14 -4.95 116.67 114.61 2skd s ASP 633 Ca 0.17 -0.18 0.05 0.00 -0.52 0.00 0.00 52.55 52.08 2skd s ASP 633 Cb 0.15 -2.27 0.73 0.00 -1.46 0.00 0.00 42.92 40.07 2skd s ASP 633 CO 0.02 -0.56 1.95 -0.65 0.52 0.00 0.00 175.17 176.45 2skd h PRO 634 N 8.58 0.75 0.00 4.34 0.11 -1.93 -2.20 132.00 141.65 2skd h PRO 634 Ca -0.27 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 2skd h PRO 634 Cb 1.12 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 2skd h PRO 634 CO 0.80 0.50 -0.22 0.28 -0.21 0.00 0.00 178.00 179.15 2skd h VAL 635 N 0.77 0.93 -0.11 3.15 2.07 -1.97 -2.77 116.25 118.32 2skd h VAL 635 Ca 0.32 -0.82 -0.23 0.00 0.82 0.00 0.00 66.70 66.79 2skd h VAL 635 Cb 0.26 1.47 0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2skd h VAL 635 CO -0.11 0.22 -0.84 0.58 0.02 0.00 0.00 177.57 177.44 2skd h VAL 636 N 0.00 1.29 0.00 2.57 2.07 -1.74 -3.49 116.25 116.96 2skd h VAL 636 Ca -0.00 -2.07 0.00 0.00 0.82 0.00 0.00 66.70 65.45 2skd h VAL 636 Cb 0.46 2.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 2skd h VAL 636 CO 0.03 0.65 0.00 0.61 0.02 0.00 0.00 177.57 178.88 2skd n GLY 637 N 0.78 2.53 1.52 2.17 0.00 -1.05 -2.45 105.19 108.69 2skd n GLY 637 Ca -0.08 -0.35 0.09 0.00 0.00 0.00 0.00 46.02 45.68 2skd n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2skd n ASP 638 N 4.49 4.80 0.19 1.61 5.68 -1.26 -4.41 116.55 127.64 2skd n ASP 638 Ca 0.00 -2.61 0.12 0.00 -0.50 0.00 0.00 54.79 51.80 2skd n ASP 638 Cb 0.00 -0.58 0.16 0.00 -1.14 0.00 0.00 41.12 39.56 2skd n ASP 638 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2skd h ARG 639 N 3.67 0.00 -2.40 0.11 3.08 -1.84 -3.43 114.38 113.58 2skd h ARG 639 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2skd h ARG 639 Cb 1.54 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 31.32 2skd h ARG 639 CO 0.28 0.00 -0.37 -1.17 -1.07 0.00 0.00 179.97 177.64 2skd s LEU 640 N -5.89 -0.67 -0.00 3.04 2.96 -1.26 -1.75 118.68 115.10 2skd s LEU 640 Ca 0.06 0.92 0.06 0.00 -0.22 0.00 0.00 54.13 54.95 2skd s LEU 640 Cb 0.07 1.37 -0.02 0.00 0.50 0.00 0.00 46.19 48.11 2skd s LEU 640 CO 0.68 -0.24 -0.19 -0.13 -1.32 0.00 0.00 176.35 175.16 2skd s ARG 641 N 2.62 1.48 -0.24 1.98 1.81 -0.88 -4.63 118.95 121.09 2skd s ARG 641 Ca 0.00 -0.73 0.02 0.00 -1.72 0.00 0.00 55.73 53.31 2skd s ARG 641 Cb -0.12 -1.46 0.06 0.00 -0.45 0.00 0.00 34.95 32.97 2skd s ARG 641 CO -0.13 0.40 -0.11 0.08 -0.68 0.00 0.00 175.30 174.85 2skd s VAL 642 N -0.52 2.00 -0.04 3.52 1.01 -1.26 -1.46 120.40 123.65 2skd s VAL 642 Ca 0.07 -1.46 0.07 0.00 0.00 0.00 0.00 61.98 60.66 2skd s VAL 642 Cb -0.08 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 2skd s VAL 642 CO -0.00 0.02 -0.25 -0.63 0.00 0.00 0.00 175.10 174.23 2skd s ILE 643 N 1.19 2.03 -0.36 2.22 1.09 -0.76 -4.56 121.20 122.06 2skd s ILE 643 Ca -0.07 -1.07 -0.13 0.00 -1.10 0.00 0.00 60.65 58.28 2skd s ILE 643 Cb -0.19 -1.71 -0.00 0.00 -1.06 0.00 0.00 42.46 39.50 2skd s ILE 643 CO -0.06 0.57 0.24 0.12 -0.10 0.00 0.00 174.94 175.71 2skd s PHE 644 N -0.32 3.22 -0.48 3.97 5.36 -1.26 -1.75 117.98 126.73 2skd s PHE 644 Ca 0.01 -0.44 -0.28 0.00 -0.96 0.00 0.00 56.93 55.26 2skd s PHE 644 Cb -0.12 -2.48 -0.00 0.00 -0.34 0.00 0.00 43.02 40.07 2skd s PHE 644 CO 0.02 -0.46 1.61 -0.51 -1.46 0.00 0.00 175.22 174.42 2skd s LEU 645 N 1.68 3.44 0.31 6.12 1.02 0.17 -4.96 118.68 126.46 2skd s LEU 645 Ca 0.05 0.68 -0.29 0.00 0.02 0.00 0.00 54.13 54.60 2skd s LEU 645 Cb -0.18 -3.17 -0.10 0.00 0.02 0.00 0.00 46.19 42.76 2skd s LEU 645 CO 0.09 -1.79 1.25 -0.70 0.02 0.00 0.00 176.35 175.22 2skd s GLU 646 N 5.75 4.44 -1.34 1.70 2.12 -1.26 -3.92 118.70 126.18 2skd s GLU 646 Ca 0.65 2.09 -0.01 0.00 0.36 0.00 0.00 54.97 58.06 2skd s GLU 646 Cb -0.15 -3.11 0.01 0.00 0.26 0.00 0.00 34.13 31.14 2skd s GLU 646 CO 0.28 -0.08 0.64 -1.71 -0.54 0.00 0.00 175.26 173.86 2skd n ASN 647 N 1.00 -1.12 -4.68 -1.70 5.15 -1.25 -4.87 115.26 107.79 2skd n ASN 647 Ca -0.00 -0.86 -0.45 0.00 -0.60 0.00 0.00 54.58 52.66 2skd n ASN 647 Cb 0.43 -3.80 -0.04 0.00 -0.53 0.00 0.00 39.78 35.83 2skd n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2skd n TYR 648 N -4.32 2.42 -4.01 1.20 9.36 -1.26 -4.87 117.16 115.67 2skd n TYR 648 Ca -0.29 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 60.80 2skd n TYR 648 Cb 0.67 -2.66 -0.02 0.00 -0.63 0.00 0.00 39.34 36.70 2skd n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 2skd s ARG 649 N 2.81 2.06 0.14 2.98 1.70 -1.26 -4.75 118.95 122.62 2skd s ARG 649 Ca 0.85 -1.72 -0.24 0.00 -0.47 0.00 0.00 55.73 54.16 2skd s ARG 649 Cb -0.61 0.50 -0.01 0.00 -0.57 0.00 0.00 34.95 34.26 2skd s ARG 649 CO 0.43 -0.89 1.63 0.28 -1.08 0.00 0.00 175.30 175.67 2skd h VAL 650 N 2.05 0.39 -0.03 4.99 2.07 -1.96 -0.72 116.25 123.05 2skd h VAL 650 Ca -0.30 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2skd h VAL 650 Cb 1.24 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2skd h VAL 650 CO 0.39 0.00 -0.01 0.77 0.02 0.00 0.00 177.57 178.75 2skd h SER 651 N -0.32 0.04 0.70 0.57 4.64 -1.97 -0.73 113.55 116.49 2skd h SER 651 Ca 0.10 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.24 2skd h SER 651 Cb 0.47 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 2skd h SER 651 CO -0.32 0.06 -0.83 0.25 -0.87 0.00 0.00 176.83 175.11 2skd h LEU 652 N 0.05 0.12 -0.96 5.97 5.85 -1.71 -3.15 115.31 121.47 2skd h LEU 652 Ca 0.01 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 2skd h LEU 652 Cb 0.05 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2skd h LEU 652 CO 0.00 0.90 -0.16 0.00 -0.34 0.00 0.00 178.44 178.84 2skd h ALA 653 N 1.10 1.13 0.00 1.25 0.00 0.31 -1.41 119.26 121.63 2skd h ALA 653 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2skd h ALA 653 Cb 1.46 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2skd h ALA 653 CO 0.12 0.55 0.00 0.93 0.00 0.00 0.00 179.25 180.84 2skd h GLU 654 N 0.52 0.00 0.04 0.00 5.08 -1.32 -2.34 114.58 116.56 2skd h GLU 654 Ca 0.09 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.11 2skd h GLU 654 Cb 0.58 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2skd h GLU 654 CO 0.04 0.00 -1.90 1.63 -1.00 0.00 0.00 179.01 177.77 2skd n LYS 655 N -2.87 0.64 0.03 2.33 5.02 -0.60 -4.47 118.16 118.24 2skd n LYS 655 Ca -0.01 0.36 -0.19 0.00 -2.02 0.00 0.00 58.31 56.45 2skd n LYS 655 Cb 0.17 -1.65 -0.11 0.00 -0.02 0.00 0.00 35.03 33.42 2skd n LYS 655 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 2skd h VAL 656 N -0.54 1.33 -0.40 -0.18 -1.51 -1.33 -3.34 116.25 110.27 2skd h VAL 656 Ca -0.47 -2.19 0.05 0.00 -1.23 0.00 0.00 66.70 62.86 2skd h VAL 656 Cb 1.67 2.45 -0.04 0.00 -2.13 0.00 0.00 31.29 33.23 2skd h VAL 656 CO -0.15 0.66 0.14 0.40 -1.23 0.00 0.00 177.57 177.40 2skd h ILE 657 N 0.23 0.88 0.00 7.19 2.04 -1.68 -1.01 117.51 125.17 2skd h ILE 657 Ca -0.11 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 2skd h ILE 657 Cb 1.57 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 2skd h ILE 657 CO 0.18 0.06 -0.02 -0.65 0.00 0.00 0.00 178.15 177.72 2skd h PRO 658 N 0.30 0.00 -0.36 2.37 0.11 -1.78 -2.30 132.00 130.34 2skd h PRO 658 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2skd h PRO 658 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 2skd h PRO 658 CO -0.18 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 177.62 2skd n ALA 659 N -2.13 2.43 -2.21 -0.75 0.00 -0.45 -4.76 120.51 112.65 2skd n ALA 659 Ca -0.02 -0.94 -0.37 0.00 0.00 0.00 0.00 53.44 52.11 2skd n ALA 659 Cb 0.15 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 2skd n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2skd s ALA 660 N -1.54 3.50 -0.22 0.00 0.00 -0.82 -4.65 121.76 118.03 2skd s ALA 660 Ca 0.38 0.06 0.01 0.00 0.00 0.00 0.00 51.96 52.41 2skd s ALA 660 Cb 0.22 -2.70 -0.14 0.00 0.00 0.00 0.00 23.12 20.50 2skd s ALA 660 CO 0.31 0.38 -0.20 -0.25 0.00 0.00 0.00 175.76 176.00 2skd n ASP 661 N 1.04 2.26 -4.17 0.00 8.00 -0.67 -4.07 116.55 118.94 2skd n ASP 661 Ca -0.05 -0.10 -0.30 0.00 0.71 0.00 0.00 54.79 55.04 2skd n ASP 661 Cb 0.51 -0.36 -0.17 0.00 -0.02 0.00 0.00 41.12 41.08 2skd n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2skd s LEU 662 N -6.34 1.98 -0.19 0.64 0.20 -0.67 -0.35 118.68 113.97 2skd s LEU 662 Ca -0.30 -0.51 -0.06 0.00 0.69 0.00 0.00 54.13 53.95 2skd s LEU 662 Cb 0.08 -1.29 -0.03 0.00 -0.43 0.00 0.00 46.19 44.52 2skd s LEU 662 CO 0.50 0.12 0.04 -0.55 -0.29 0.00 0.00 176.35 176.17 2skd s SER 663 N 0.51 5.31 -0.41 3.68 0.15 0.22 -1.82 113.70 121.34 2skd s SER 663 Ca -0.16 -0.03 -0.14 0.00 0.70 0.00 0.00 55.95 56.33 2skd s SER 663 Cb -0.17 -1.91 0.03 0.00 -1.71 0.00 0.00 66.02 62.26 2skd s SER 663 CO 0.06 0.13 0.29 -1.61 1.20 0.00 0.00 173.24 173.31 2skd s GLU 664 N 0.59 2.92 -0.57 5.44 0.41 -1.09 -1.60 118.70 124.80 2skd s GLU 664 Ca 0.02 -1.09 0.06 0.00 -0.41 0.00 0.00 54.97 53.55 2skd s GLU 664 Cb -0.13 -3.93 0.24 0.00 -1.78 0.00 0.00 34.13 28.53 2skd s GLU 664 CO 0.02 -0.78 0.66 1.04 -0.49 0.00 0.00 175.26 175.71 2skd n GLN 665 N 5.11 1.95 -1.63 1.61 1.13 -0.98 -4.78 117.38 119.79 2skd n GLN 665 Ca -0.11 -4.24 -0.31 0.00 -1.94 0.00 0.00 57.00 50.40 2skd n GLN 665 Cb 0.46 -1.96 0.06 0.00 0.11 0.00 0.00 30.24 28.91 2skd n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2skd n ILE 666 N 1.11 3.24 -1.57 5.09 -5.35 -1.26 -2.36 119.36 118.25 2skd n ILE 666 Ca 0.27 -3.49 -0.31 0.00 -0.27 0.00 0.00 62.75 58.95 2skd n ILE 666 Cb 0.44 -1.16 0.05 0.00 -1.74 0.00 0.00 39.64 37.23 2skd n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2skd s SER 667 N -2.41 5.38 0.14 7.28 1.04 -1.25 -4.58 113.70 119.29 2skd s SER 667 Ca 0.59 1.62 -0.31 0.00 0.48 0.00 0.00 55.95 58.33 2skd s SER 667 Cb 0.47 -2.50 -0.09 0.00 0.10 0.00 0.00 66.02 64.01 2skd s SER 667 CO -0.02 -1.44 1.47 -0.89 0.98 0.00 0.00 173.24 173.33 2skd s THR 668 N -3.04 3.00 -0.14 2.02 2.01 -1.15 -4.69 115.64 113.64 2skd s THR 668 Ca 0.58 0.72 -0.38 0.00 0.31 0.00 0.00 61.69 62.91 2skd s THR 668 Cb -0.14 -3.46 -0.16 0.00 0.01 0.00 0.00 72.50 68.76 2skd s THR 668 CO 0.55 0.06 1.64 0.00 -0.69 0.00 0.00 174.62 176.17 2skd n ALA 669 N 3.92 -0.27 0.00 7.40 0.00 -1.26 -1.71 120.51 128.58 2skd n ALA 669 Ca 0.12 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2skd n ALA 669 Cb 0.41 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2skd n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2skd n GLY 670 N 3.71 0.43 0.08 0.00 0.00 -1.26 -4.65 105.19 103.49 2skd n GLY 670 Ca 0.23 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 2skd n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2skd n THR 671 N -1.78 1.09 -3.09 2.61 -2.24 -0.70 -4.90 114.28 105.28 2skd n THR 671 Ca 0.00 -0.61 -0.43 0.00 -2.27 0.00 0.00 64.05 60.74 2skd n THR 671 Cb 0.00 -0.73 -0.07 0.00 -2.10 0.00 0.00 70.33 67.43 2skd n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2skd s GLU 672 N -2.38 3.31 0.21 -0.78 2.56 -1.26 -4.70 118.70 115.67 2skd s GLU 672 Ca -0.12 -0.32 -0.12 0.00 0.00 0.00 0.00 54.97 54.41 2skd s GLU 672 Cb 0.05 -3.94 0.27 0.00 2.00 0.00 0.00 34.13 32.51 2skd s GLU 672 CO 0.60 -1.02 1.64 0.00 -0.56 0.00 0.00 175.26 175.93 2skd h ALA 673 N 8.88 0.52 0.00 6.30 0.00 -1.91 -2.93 119.26 130.12 2skd h ALA 673 Ca -0.25 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2skd h ALA 673 Cb 1.09 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2skd h ALA 673 CO 0.90 -0.42 0.00 0.45 0.00 0.00 0.00 179.25 180.18 2skd n SER 674 N -5.36 -1.70 0.00 0.00 2.88 -1.26 -4.18 113.62 103.99 2skd n SER 674 Ca 0.08 0.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2skd n SER 674 Cb 0.35 1.75 0.00 0.00 -0.75 0.00 0.00 64.21 65.56 2skd n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2skd n GLY 675 N -0.35 -0.39 0.00 0.46 0.00 -1.26 -2.03 105.19 101.63 2skd n GLY 675 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2skd n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2skd n THR 676 N 0.15 0.00 -0.17 2.61 -2.24 -1.26 -4.75 114.28 108.62 2skd n THR 676 Ca 0.00 -0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.74 2skd n THR 676 Cb 0.00 0.15 0.17 0.00 -2.10 0.00 0.00 70.33 68.54 2skd n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2skd h GLY 677 N 0.00 0.98 0.53 3.38 0.00 -1.94 -1.36 103.07 104.66 2skd h GLY 677 Ca 0.00 -0.55 0.11 0.00 0.00 0.00 0.00 47.33 46.90 2skd h GLY 677 CO 0.00 0.51 0.63 3.45 0.00 0.00 0.00 176.54 181.13 2skd h ASN 678 N 0.88 0.91 -0.33 0.19 -0.00 -1.94 -0.47 115.58 114.83 2skd h ASN 678 Ca 0.20 0.04 -0.13 0.00 -0.00 0.00 0.00 56.30 56.40 2skd h ASN 678 Cb 0.26 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 38.43 2skd h ASN 678 CO -0.01 0.50 -0.32 0.24 -0.00 0.00 0.00 177.43 177.84 2skd h MET 679 N 0.99 0.80 -0.68 4.14 2.86 -1.59 -2.46 114.93 118.98 2skd h MET 679 Ca 0.48 -0.42 0.07 0.00 -2.06 0.00 0.00 59.70 57.77 2skd h MET 679 Cb 0.46 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.07 2skd h MET 679 CO -0.24 1.05 0.36 0.87 1.06 0.00 0.00 176.91 180.01 2skd h LYS 680 N 0.57 0.63 -0.45 1.72 1.57 -0.15 -2.26 116.57 118.21 2skd h LYS 680 Ca 0.05 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 2skd h LYS 680 Cb 0.90 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 2skd h LYS 680 CO 0.08 0.42 -0.17 0.74 -0.57 0.00 0.00 179.45 179.94 2skd h PHE 681 N 0.65 0.98 -0.80 -1.35 0.04 -1.23 -3.05 116.94 112.18 2skd h PHE 681 Ca 0.31 -0.21 -0.03 0.00 2.80 0.00 0.00 57.97 60.84 2skd h PHE 681 Cb 0.25 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 38.12 2skd h PHE 681 CO -0.09 0.97 0.37 1.98 -0.60 0.00 0.00 178.31 180.94 2skd h MET 682 N 0.76 1.15 0.00 1.51 4.05 -0.93 -2.23 114.93 119.24 2skd h MET 682 Ca 0.11 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2skd h MET 682 Cb 0.70 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2skd h MET 682 CO 0.05 0.90 0.00 1.25 0.23 0.00 0.00 176.91 179.35 2skd h LEU 683 N 1.13 0.00 -3.11 3.39 5.85 -1.43 -3.29 115.31 117.86 2skd h LEU 683 Ca 0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.99 2skd h LEU 683 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2skd h LEU 683 CO -0.03 0.00 0.00 0.59 -0.34 0.00 0.00 178.44 178.66 2skd n ASN 684 N -2.38 4.13 0.00 1.25 3.02 -0.97 -4.92 115.26 115.39 2skd n ASN 684 Ca 0.04 -2.47 0.00 0.00 -0.03 0.00 0.00 54.58 52.12 2skd n ASN 684 Cb 0.38 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 2skd n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2skd n GLY 685 N 0.61 0.91 3.62 7.41 0.00 -1.15 -4.78 105.19 111.81 2skd n GLY 685 Ca 0.21 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2skd n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2skd s ALA 686 N -2.00 3.09 0.22 4.61 0.00 -0.88 -4.76 121.76 122.04 2skd s ALA 686 Ca 0.00 -1.16 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 2skd s ALA 686 Cb 0.00 -1.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.02 2skd s ALA 686 CO 0.00 0.66 0.48 -0.51 0.00 0.00 0.00 175.76 176.39 2skd s LEU 687 N -2.12 4.17 -0.17 0.00 1.02 0.53 -4.46 118.68 117.65 2skd s LEU 687 Ca 0.22 0.70 -0.04 0.00 0.02 0.00 0.00 54.13 55.03 2skd s LEU 687 Cb -0.11 -3.47 -0.02 0.00 0.02 0.00 0.00 46.19 42.60 2skd s LEU 687 CO 0.14 -0.07 -0.04 -0.89 0.02 0.00 0.00 176.35 175.51 2skd s THR 688 N -1.86 3.82 -0.21 5.49 2.01 -1.26 -0.61 115.64 123.01 2skd s THR 688 Ca 0.43 -0.38 -0.04 0.00 0.31 0.00 0.00 61.69 62.02 2skd s THR 688 Cb -0.11 -2.68 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 2skd s THR 688 CO 0.26 0.48 -0.05 -0.51 -0.69 0.00 0.00 174.62 174.11 2skd s ILE 689 N 0.54 3.33 0.24 1.82 2.07 -0.63 -1.50 121.20 127.07 2skd s ILE 689 Ca -0.03 -0.51 -0.18 0.00 -1.41 0.00 0.00 60.65 58.53 2skd s ILE 689 Cb -0.14 -2.51 0.06 0.00 0.13 0.00 0.00 42.46 40.00 2skd s ILE 689 CO 0.03 0.43 0.87 0.61 -1.91 0.00 0.00 174.94 174.97 2skd n GLY 690 N 4.71 0.80 3.97 1.50 0.00 -0.42 -2.33 105.19 113.44 2skd n GLY 690 Ca -0.18 -1.17 -0.21 0.00 0.00 0.00 0.00 46.02 44.46 2skd n GLY 690 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2skd s THR 691 N -2.13 4.41 -1.43 2.61 -4.23 -1.00 -2.06 115.64 111.82 2skd s THR 691 Ca 0.19 -0.83 -0.15 0.00 -1.18 0.00 0.00 61.69 59.72 2skd s THR 691 Cb -0.03 -3.56 0.05 0.00 1.34 0.00 0.00 72.50 70.29 2skd s THR 691 CO 0.07 -0.27 2.15 0.23 -0.54 0.00 0.00 174.62 176.26 2skd n MET 692 N -1.70 2.91 -4.19 3.99 2.81 -1.26 -4.71 117.12 114.97 2skd n MET 692 Ca -0.02 -2.72 -0.17 0.00 -1.81 0.00 0.00 57.70 52.98 2skd n MET 692 Cb 0.58 -3.32 -0.11 0.00 -0.71 0.00 0.00 33.22 29.65 2skd n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2skd s ASP 693 N 3.34 1.73 0.32 7.83 2.15 -1.26 -4.63 116.67 126.15 2skd s ASP 693 Ca 0.48 -0.72 0.00 0.00 0.43 0.00 0.00 52.55 52.74 2skd s ASP 693 Cb 0.12 -0.04 0.00 0.00 -0.30 0.00 0.00 42.92 42.70 2skd s ASP 693 CO -0.06 -0.14 0.00 0.61 -0.17 0.00 0.00 175.17 175.41 2skd n GLY 694 N 0.88 1.60 0.00 2.66 0.00 -1.11 -1.31 105.19 107.90 2skd n GLY 694 Ca -0.18 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.53 2skd n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2skd n ALA 695 N 5.70 1.68 -0.18 4.61 0.00 -0.86 -3.02 120.51 128.45 2skd n ALA 695 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.51 2skd n ALA 695 Cb 0.00 -1.23 0.45 0.00 0.00 0.00 0.00 19.45 18.67 2skd n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2skd h ASN 696 N 0.00 0.50 -0.49 0.00 4.21 -1.43 -0.28 115.58 118.10 2skd h ASN 696 Ca 0.00 0.02 -0.05 0.00 1.21 0.00 0.00 56.30 57.49 2skd h ASN 696 Cb 0.22 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.32 2skd h ASN 696 CO 0.00 0.27 0.12 0.58 -1.29 0.00 0.00 177.43 177.12 2skd h VAL 697 N 0.54 1.24 0.00 2.81 2.07 -1.63 -1.21 116.25 120.07 2skd h VAL 697 Ca 0.37 -0.83 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 2skd h VAL 697 Cb 0.68 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2skd h VAL 697 CO -0.13 0.30 -0.62 -0.33 0.02 0.00 0.00 177.57 176.81 2skd h GLU 698 N 0.66 0.00 -0.07 1.57 5.08 -1.44 -1.51 114.58 118.87 2skd h GLU 698 Ca 0.15 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 2skd h GLU 698 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2skd h GLU 698 CO 0.00 0.62 -0.13 0.52 -1.00 0.00 0.00 179.01 179.02 2skd h MET 699 N 0.00 0.21 -0.15 2.33 2.86 -0.89 -1.20 114.93 118.08 2skd h MET 699 Ca -0.01 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 2skd h MET 699 Cb 1.15 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 2skd h MET 699 CO 0.08 0.72 -0.20 0.00 1.06 0.00 0.00 176.91 178.57 2skd h ALA 700 N 0.48 1.38 -0.14 6.32 0.00 -1.24 0.47 119.26 126.54 2skd h ALA 700 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 2skd h ALA 700 Cb 0.72 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2skd h ALA 700 CO 0.03 0.43 -0.46 1.49 0.00 0.00 0.00 179.25 180.74 2skd h GLU 701 N 0.24 0.34 0.10 0.00 4.81 -1.21 0.21 114.58 119.09 2skd h GLU 701 Ca 0.04 -0.18 -0.29 0.00 -0.13 0.00 0.00 59.36 58.80 2skd h GLU 701 Cb 0.50 0.01 0.03 0.00 0.63 0.00 0.00 28.75 29.91 2skd h GLU 701 CO 0.03 0.74 -1.21 0.93 -0.73 0.00 0.00 179.01 178.76 2skd h GLU 702 N 0.28 0.63 0.00 1.92 4.39 -0.26 -3.34 114.58 118.20 2skd h GLU 702 Ca 0.02 -0.81 0.00 0.00 0.34 0.00 0.00 59.36 58.91 2skd h GLU 702 Cb 0.92 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2skd h GLU 702 CO 0.08 1.37 -0.96 0.00 -1.16 0.00 0.00 179.01 178.33 2skd n ALA 703 N -2.67 2.64 0.00 3.43 0.00 0.06 -4.91 120.51 119.07 2skd n ALA 703 Ca -0.13 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2skd n ALA 703 Cb 0.97 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 19.32 2skd n ALA 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2skd n GLY 704 N 1.22 2.05 0.30 0.00 0.00 0.74 -4.57 105.19 104.93 2skd n GLY 704 Ca 0.01 -1.46 0.20 0.00 0.00 0.00 0.00 46.02 44.77 2skd n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2skd h GLU 705 N 0.00 0.00 0.00 1.61 5.08 -1.85 -1.64 114.58 117.78 2skd h GLU 705 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2skd h GLU 705 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2skd h GLU 705 CO 0.00 0.00 -0.08 0.93 -1.00 0.00 0.00 179.01 178.86 2skd h GLU 706 N 0.00 0.00 -0.51 2.33 3.07 -1.89 -2.77 114.58 114.81 2skd h GLU 706 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2skd h GLU 706 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 2skd h GLU 706 CO 0.00 0.08 0.00 0.09 -1.40 0.00 0.00 179.01 177.78 2skd n ASN 707 N -3.19 4.47 -4.15 1.42 3.02 -0.62 -4.93 115.26 111.28 2skd n ASN 707 Ca 0.01 -2.58 -0.20 0.00 -0.03 0.00 0.00 54.58 51.77 2skd n ASN 707 Cb 0.39 -0.54 -0.13 0.00 -0.61 0.00 0.00 39.78 38.89 2skd n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2skd s PHE 708 N -2.08 1.26 -1.04 3.10 5.36 -1.04 -4.78 117.98 118.75 2skd s PHE 708 Ca 0.46 -0.36 -0.06 0.00 -0.96 0.00 0.00 56.93 56.01 2skd s PHE 708 Cb 0.32 -0.74 0.26 0.00 -0.34 0.00 0.00 43.02 42.52 2skd s PHE 708 CO 0.19 0.04 1.04 1.19 -1.46 0.00 0.00 175.22 176.22 2skd n PHE 709 N 1.88 4.69 -3.30 10.12 3.72 -0.56 -4.94 117.46 129.06 2skd n PHE 709 Ca -0.18 -3.88 -0.38 0.00 -0.05 0.00 0.00 57.45 52.96 2skd n PHE 709 Cb 0.55 -1.48 -0.06 0.00 -0.94 0.00 0.00 39.48 37.55 2skd n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2skd s ILE 710 N -1.48 4.89 0.32 4.37 1.09 -1.26 -1.30 121.20 127.84 2skd s ILE 710 Ca 0.30 1.13 -0.02 0.00 -1.10 0.00 0.00 60.65 60.96 2skd s ILE 710 Cb -0.07 -3.86 -0.00 0.00 -1.06 0.00 0.00 42.46 37.46 2skd s ILE 710 CO -0.08 0.50 0.43 0.72 -0.10 0.00 0.00 174.94 176.41 2skd s PHE 711 N -0.66 1.09 0.07 3.97 -0.71 -0.87 -4.97 117.98 115.89 2skd s PHE 711 Ca 0.28 -1.29 0.00 0.00 -1.04 0.00 0.00 56.93 54.88 2skd s PHE 711 Cb -0.18 -0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.46 2skd s PHE 711 CO 0.17 -1.06 0.00 0.41 -1.34 0.00 0.00 175.22 173.40 2skd n GLY 712 N -0.53 -1.86 3.76 1.99 0.00 -1.26 -4.40 105.19 102.88 2skd n GLY 712 Ca 0.02 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.36 2skd n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2skd s MET 713 N -0.73 3.24 0.54 1.61 -1.94 -1.26 -4.93 119.30 115.83 2skd s MET 713 Ca 0.00 1.85 0.09 0.00 -1.71 0.00 0.00 55.69 55.91 2skd s MET 713 Cb 0.00 -2.10 0.07 0.00 2.01 0.00 0.00 34.83 34.81 2skd s MET 713 CO 0.00 -1.00 0.74 1.03 -0.01 0.00 0.00 175.02 175.78 2skd s ARG 714 N -3.11 2.42 0.20 2.03 1.81 -1.26 -4.56 118.95 116.48 2skd s ARG 714 Ca 0.73 -1.49 -0.10 0.00 -1.72 0.00 0.00 55.73 53.14 2skd s ARG 714 Cb -0.31 -2.66 0.26 0.00 -0.45 0.00 0.00 34.95 31.80 2skd s ARG 714 CO 0.35 -0.73 1.73 0.28 -0.68 0.00 0.00 175.30 176.24 2skd h VAL 715 N 0.26 0.74 -0.82 3.52 2.07 -1.82 -2.31 116.25 117.89 2skd h VAL 715 Ca -0.33 -0.12 0.08 0.00 0.82 0.00 0.00 66.70 67.15 2skd h VAL 715 Cb 1.29 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 2skd h VAL 715 CO 0.42 0.06 0.49 1.05 0.02 0.00 0.00 177.57 179.61 2skd h GLU 716 N 0.34 0.83 -0.38 1.57 9.09 -1.95 -1.90 114.58 122.19 2skd h GLU 716 Ca 0.30 -0.05 -0.07 0.00 0.05 0.00 0.00 59.36 59.58 2skd h GLU 716 Cb 0.39 -0.19 -0.02 0.00 -1.65 0.00 0.00 28.75 27.28 2skd h GLU 716 CO -0.33 0.55 -0.07 -0.44 0.05 0.00 0.00 179.01 178.77 2skd h ASP 717 N 0.86 0.62 -0.24 3.06 3.32 -1.80 -0.97 116.42 121.27 2skd h ASP 717 Ca 0.37 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 2skd h ASP 717 Cb 0.25 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2skd h ASP 717 CO -0.20 0.74 0.09 0.58 -1.72 0.00 0.00 179.24 178.72 2skd h VAL 718 N 0.59 1.18 -0.74 -1.35 2.07 -0.99 -1.49 116.25 115.53 2skd h VAL 718 Ca 0.11 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 2skd h VAL 718 Cb 0.48 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2skd h VAL 718 CO 0.03 0.18 0.22 0.44 0.02 0.00 0.00 177.57 178.46 2skd h ASP 719 N 0.23 1.08 -0.43 0.57 3.32 -1.23 -1.19 116.42 118.78 2skd h ASP 719 Ca 0.08 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 56.94 2skd h ASP 719 Cb 0.19 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 2skd h ASP 719 CO -0.01 1.00 0.24 -0.09 -1.72 0.00 0.00 179.24 178.66 2skd h ARG 720 N 1.09 0.46 -0.62 3.56 2.43 -0.98 -0.90 114.38 119.44 2skd h ARG 720 Ca 0.24 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2skd h ARG 720 Cb 0.32 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 2skd h ARG 720 CO -0.01 0.31 0.25 1.25 -1.51 0.00 0.00 179.97 180.26 2skd h LEU 721 N 0.48 0.81 -0.68 3.80 6.46 -0.87 -1.91 115.31 123.40 2skd h LEU 721 Ca 0.17 -0.10 -0.13 0.00 -0.12 0.00 0.00 57.88 57.70 2skd h LEU 721 Cb 0.04 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.75 2skd h LEU 721 CO -0.10 0.72 -0.35 0.44 -0.62 0.00 0.00 178.44 178.53 2skd h ASP 722 N 0.88 0.66 0.07 1.25 3.32 -0.55 0.90 116.42 122.94 2skd h ASP 722 Ca 0.21 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2skd h ASP 722 Cb 0.16 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2skd h ASP 722 CO -0.02 0.95 -0.03 1.56 -1.72 0.00 0.00 179.24 179.98 2skd h GLN 723 N 0.53 -0.09 0.06 3.56 1.08 -0.78 -3.05 115.11 116.41 2skd h GLN 723 Ca 0.05 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2skd h GLN 723 Cb 0.86 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.31 2skd h GLN 723 CO 0.07 -0.02 -0.04 -0.09 -0.95 0.00 0.00 178.83 177.81 2skd h ARG 724 N -0.14 -0.09 0.00 1.46 2.43 -1.13 -3.49 114.38 113.42 2skd h ARG 724 Ca -0.01 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2skd h ARG 724 Cb 0.11 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2skd h ARG 724 CO 0.02 -0.06 0.00 0.41 -1.51 0.00 0.00 179.97 178.83 2skd n GLY 725 N -1.13 3.16 3.65 2.80 0.00 0.31 -5.05 105.19 108.92 2skd n GLY 725 Ca -0.07 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2skd n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2skd s TYR 726 N 0.00 3.33 -0.31 1.61 5.04 -1.23 -4.87 117.35 120.92 2skd s TYR 726 Ca 0.00 1.24 0.03 0.00 -2.44 0.00 0.00 57.07 55.90 2skd s TYR 726 Cb 0.00 -3.11 0.09 0.00 0.35 0.00 0.00 41.96 39.29 2skd s TYR 726 CO 0.00 -0.41 0.02 1.21 -1.34 0.00 0.00 175.55 175.04 2skd s ASN 727 N 1.28 4.54 0.44 4.32 3.84 -1.26 -4.99 114.94 123.11 2skd s ASN 727 Ca 0.38 -1.88 0.11 0.00 0.21 0.00 0.00 52.86 51.68 2skd s ASN 727 Cb -0.15 -1.47 0.97 0.00 -0.55 0.00 0.00 41.25 40.05 2skd s ASN 727 CO 0.08 -0.34 2.04 0.00 -2.79 0.00 0.00 177.10 176.08 2skd h ALA 728 N 7.73 1.74 -0.87 1.71 0.00 -1.88 -2.77 119.26 124.92 2skd h ALA 728 Ca -0.09 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 54.89 2skd h ALA 728 Cb 1.03 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 2skd h ALA 728 CO 0.49 0.21 0.56 0.37 0.00 0.00 0.00 179.25 180.88 2skd h GLN 729 N 0.25 0.60 -0.56 0.00 5.75 -1.92 -1.23 115.11 118.00 2skd h GLN 729 Ca 0.06 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.57 2skd h GLN 729 Cb 0.11 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 2skd h GLN 729 CO -0.00 0.40 0.30 1.49 -2.65 0.00 0.00 178.83 178.36 2skd h GLU 730 N 0.62 0.56 -0.36 1.69 4.81 -1.92 0.23 114.58 120.21 2skd h GLU 730 Ca 0.44 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.47 2skd h GLU 730 Cb 0.78 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 2skd h GLU 730 CO -0.19 0.37 -0.42 1.88 -0.73 0.00 0.00 179.01 179.92 2skd h TYR 731 N 0.58 1.09 -0.88 0.92 0.05 -1.41 -2.00 116.97 115.31 2skd h TYR 731 Ca 0.25 -0.34 -0.01 0.00 0.05 0.00 0.00 58.73 58.68 2skd h TYR 731 Cb 0.13 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 37.61 2skd h TYR 731 CO -0.09 1.16 0.52 -0.92 -1.05 0.00 0.00 178.16 177.78 2skd h TYR 732 N 0.73 1.18 -0.38 4.88 5.03 -0.79 -2.15 116.97 125.47 2skd h TYR 732 Ca 0.05 -0.01 -0.16 0.00 2.58 0.00 0.00 58.73 61.19 2skd h TYR 732 Cb 1.01 -0.38 -0.01 0.00 1.55 0.00 0.00 36.73 38.90 2skd h TYR 732 CO 0.06 0.80 -0.38 -0.44 -1.32 0.00 0.00 178.16 176.88 2skd h ASP 733 N 1.22 0.97 0.22 -2.11 3.32 -0.40 -3.33 116.42 116.31 2skd h ASP 733 Ca 0.32 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.93 2skd h ASP 733 Cb -0.03 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.25 2skd h ASP 733 CO -0.06 1.23 -0.39 0.54 -1.72 0.00 0.00 179.24 178.84 2skd n ARG 734 N -4.06 0.70 -3.98 3.56 1.74 -0.77 -4.75 116.66 109.10 2skd n ARG 734 Ca -0.02 -0.46 -0.31 0.00 -0.77 0.00 0.00 57.85 56.29 2skd n ARG 734 Cb 0.54 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.34 2skd n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2skd s ILE 735 N -2.62 1.93 0.25 0.55 1.01 -0.82 -5.00 121.20 116.50 2skd s ILE 735 Ca 0.20 -1.82 -0.05 0.00 0.00 0.00 0.00 60.65 58.98 2skd s ILE 735 Cb 0.18 -2.27 0.19 0.00 0.01 0.00 0.00 42.46 40.57 2skd s ILE 735 CO 0.59 -0.36 1.85 -0.65 0.00 0.00 0.00 174.94 176.36 2skd h PRO 736 N 7.78 1.12 -0.85 2.79 0.11 -1.85 -0.86 132.00 140.24 2skd h PRO 736 Ca -0.12 -0.16 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 2skd h PRO 736 Cb 1.04 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.90 2skd h PRO 736 CO 0.48 0.86 0.41 0.93 -0.21 0.00 0.00 178.00 180.46 2skd h GLU 737 N 1.11 1.22 -0.25 1.05 5.08 -1.95 0.14 114.58 120.98 2skd h GLU 737 Ca 0.27 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2skd h GLU 737 Cb 0.12 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2skd h GLU 737 CO -0.03 0.94 -0.07 1.25 -1.00 0.00 0.00 179.01 180.09 2skd h LEU 738 N 1.21 0.50 -0.39 1.33 5.85 -1.84 -2.61 115.31 119.35 2skd h LEU 738 Ca 0.29 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.68 2skd h LEU 738 Cb 0.12 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 2skd h LEU 738 CO -0.04 0.76 0.14 -0.09 -0.34 0.00 0.00 178.44 178.87 2skd h ARG 739 N 0.23 0.29 -0.93 1.25 2.43 -0.77 -2.03 114.38 114.85 2skd h ARG 739 Ca 0.06 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 2skd h ARG 739 Cb 0.55 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.97 2skd h ARG 739 CO 0.03 0.19 0.60 0.37 -1.51 0.00 0.00 179.97 179.65 2skd h GLN 740 N 0.29 0.98 -0.28 0.20 4.15 -0.63 -1.76 115.11 118.06 2skd h GLN 740 Ca 0.18 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.45 2skd h GLN 740 Cb 0.17 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 2skd h GLN 740 CO -0.19 0.65 -0.21 0.82 -1.93 0.00 0.00 178.83 177.97 2skd h ILE 741 N 1.01 1.30 -0.36 2.39 2.04 -1.00 -2.45 117.51 120.45 2skd h ILE 741 Ca 0.41 -1.35 -0.07 0.00 1.00 0.00 0.00 64.86 64.86 2skd h ILE 741 Cb 0.28 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 2skd h ILE 741 CO -0.17 0.43 -0.08 0.40 0.00 0.00 0.00 178.15 178.73 2skd h ILE 742 N 0.37 1.23 0.00 -0.67 5.03 -1.01 -1.95 117.51 120.51 2skd h ILE 742 Ca 0.05 -1.00 -0.04 0.00 -0.12 0.00 0.00 64.86 63.75 2skd h ILE 742 Cb 0.75 1.04 -0.01 0.00 -3.03 0.00 0.00 36.82 35.58 2skd h ILE 742 CO 0.06 0.34 -0.21 -0.33 -0.68 0.00 0.00 178.15 177.32 2skd h GLU 743 N 0.55 0.00 -0.19 2.37 5.08 -1.32 -1.13 114.58 119.95 2skd h GLU 743 Ca 0.11 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.31 2skd h GLU 743 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2skd h GLU 743 CO 0.02 0.21 -0.50 1.96 -1.00 0.00 0.00 179.01 179.71 2skd h GLN 744 N 0.00 0.66 -0.44 2.33 4.20 -0.90 -1.39 115.11 119.57 2skd h GLN 744 Ca -0.00 -0.47 -0.14 0.00 0.06 0.00 0.00 58.65 58.10 2skd h GLN 744 Cb 0.94 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 2skd h GLN 744 CO 0.03 1.09 -0.29 -0.07 -0.67 0.00 0.00 178.83 178.92 2skd h LEU 745 N 0.35 1.00 -0.72 1.46 3.38 -1.23 -1.48 115.31 118.08 2skd h LEU 745 Ca -0.01 -0.41 -0.11 0.00 0.09 0.00 0.00 57.88 57.43 2skd h LEU 745 Cb 1.11 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2skd h LEU 745 CO 0.11 1.21 -0.23 0.28 0.09 0.00 0.00 178.44 179.89 2skd h SER 746 N 0.81 0.74 0.11 -0.43 0.02 -1.19 -3.21 113.55 110.42 2skd h SER 746 Ca 0.09 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2skd h SER 746 Cb 0.87 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2skd h SER 746 CO 0.08 0.96 -0.09 -1.54 -1.14 0.00 0.00 176.83 175.10 2skd n SER 747 N -4.11 1.07 0.00 3.07 3.41 -0.53 -4.74 113.62 111.80 2skd n SER 747 Ca -0.00 -1.15 0.00 0.00 -0.26 0.00 0.00 58.87 57.46 2skd n SER 747 Cb 0.43 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2skd n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2skd n GLY 748 N 1.22 0.79 0.36 5.00 0.00 -1.15 -4.89 105.19 106.52 2skd n GLY 748 Ca 0.17 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.25 2skd n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2skd h PHE 749 N 0.00 0.44 -0.07 1.61 3.57 -1.54 -1.20 116.94 119.75 2skd h PHE 749 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2skd h PHE 749 Cb 0.00 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.60 2skd h PHE 749 CO 0.00 0.20 0.00 1.19 -2.23 0.00 0.00 178.31 177.47 2skd n PHE 750 N -4.47 0.06 -2.99 0.41 3.72 -1.26 -4.64 117.46 108.29 2skd n PHE 750 Ca 0.10 -0.03 -0.14 0.00 -0.05 0.00 0.00 57.45 57.33 2skd n PHE 750 Cb 0.40 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.91 2skd n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2skd n SER 751 N 1.34 -2.04 0.10 4.37 3.41 -0.49 -4.79 113.62 115.52 2skd n SER 751 Ca 0.14 -2.81 -0.12 0.00 -0.26 0.00 0.00 58.87 55.82 2skd n SER 751 Cb 0.59 0.80 -0.06 0.00 -0.26 0.00 0.00 64.21 65.28 2skd n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2skd h PRO 752 N 4.86 -0.32 0.00 4.33 0.11 -1.71 -2.39 132.00 136.88 2skd h PRO 752 Ca 0.08 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.15 2skd h PRO 752 Cb 1.01 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2skd h PRO 752 CO 0.23 -0.21 -0.29 0.87 -0.21 0.00 0.00 178.00 178.39 2skd h LYS 753 N -0.33 0.00 -2.83 1.05 1.57 -1.96 -3.32 116.57 110.74 2skd h LYS 753 Ca 0.02 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.19 2skd h LYS 753 Cb 0.34 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.25 2skd h LYS 753 CO -0.08 0.29 -0.74 -0.65 -0.57 0.00 0.00 179.45 177.70 2skd s GLN 754 N -4.36 1.68 0.56 3.15 -0.21 -1.12 -4.99 119.66 114.37 2skd s GLN 754 Ca -0.03 -2.63 0.25 0.00 0.02 0.00 0.00 55.36 52.97 2skd s GLN 754 Cb 0.15 -2.52 1.53 0.00 1.00 0.00 0.00 33.01 33.17 2skd s GLN 754 CO 0.71 -1.29 2.10 -1.35 -2.12 0.00 0.00 175.29 173.34 2skd h PRO 755 N 5.79 0.00 -0.60 2.91 0.11 -1.54 -2.11 132.00 136.57 2skd h PRO 755 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2skd h PRO 755 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2skd h PRO 755 CO 0.55 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 2skd n ASP 756 N -4.09 4.58 -0.36 -2.05 5.75 -1.26 -3.40 116.55 115.72 2skd n ASP 756 Ca 0.02 -2.46 0.07 0.00 -0.01 0.00 0.00 54.79 52.41 2skd n ASP 756 Cb 0.33 -0.55 0.24 0.00 -1.03 0.00 0.00 41.12 40.10 2skd n ASP 756 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2skd h LEU 757 N 3.75 0.91 -3.94 -2.12 5.85 -1.71 -2.71 115.31 115.34 2skd h LEU 757 Ca 0.00 0.05 -0.52 0.00 0.84 0.00 0.00 57.88 58.25 2skd h LEU 757 Cb 1.41 -0.13 -0.29 0.00 0.37 0.00 0.00 40.66 42.01 2skd h LEU 757 CO 0.22 0.48 0.61 0.49 -0.34 0.00 0.00 178.44 179.90 2skd n PHE 758 N -4.63 2.93 0.06 1.25 3.72 -1.26 -4.58 117.46 114.96 2skd n PHE 758 Ca 0.19 -2.01 -0.04 0.00 -0.05 0.00 0.00 57.45 55.54 2skd n PHE 758 Cb 0.36 -0.98 0.18 0.00 -0.94 0.00 0.00 39.48 38.10 2skd n PHE 758 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2skd h LYS 759 N 1.16 0.34 -0.58 -1.08 2.10 -1.81 -2.62 116.57 114.07 2skd h LYS 759 Ca 0.60 -0.16 -0.07 0.00 -2.00 0.00 0.00 60.65 59.01 2skd h LYS 759 Cb 2.46 -0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 33.77 2skd h LYS 759 CO 1.12 0.70 0.07 -0.44 -2.00 0.00 0.00 179.45 178.90 2skd h ASP 760 N 0.28 0.91 0.02 7.07 3.32 -1.85 0.85 116.42 127.03 2skd h ASP 760 Ca 0.02 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 2skd h ASP 760 Cb 0.85 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.16 2skd h ASP 760 CO 0.07 0.93 -0.01 0.40 -1.72 0.00 0.00 179.24 178.91 2skd h ILE 761 N 0.90 1.30 -0.44 0.35 2.04 -1.88 -1.31 117.51 118.48 2skd h ILE 761 Ca 0.18 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2skd h ILE 761 Cb 0.42 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 2skd h ILE 761 CO 0.01 0.26 0.29 0.58 0.00 0.00 0.00 178.15 179.29 2skd h VAL 762 N -0.48 1.12 -0.27 1.67 2.07 -1.41 -0.17 116.25 118.77 2skd h VAL 762 Ca -0.00 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.34 2skd h VAL 762 Cb 0.45 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2skd h VAL 762 CO 0.01 0.11 0.05 -1.13 0.02 0.00 0.00 177.57 176.63 2skd h ASN 763 N 0.60 0.01 0.15 0.57 -0.00 -0.85 -1.65 115.58 114.41 2skd h ASN 763 Ca 0.16 0.04 -0.01 0.00 -0.00 0.00 0.00 56.30 56.50 2skd h ASN 763 Cb -0.06 0.06 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 2skd h ASN 763 CO -0.03 0.04 -0.07 -0.03 -0.00 0.00 0.00 177.43 177.33 2skd h MET 764 N 0.15 -0.19 -0.57 6.67 4.05 -0.91 -0.37 114.93 123.76 2skd h MET 764 Ca 0.13 0.01 0.10 0.00 -0.28 0.00 0.00 59.70 59.66 2skd h MET 764 Cb 0.13 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.94 2skd h MET 764 CO -0.17 -0.09 0.38 -0.07 0.23 0.00 0.00 176.91 177.19 2skd h LEU 765 N -0.24 0.33 0.02 3.39 4.07 -0.82 0.17 115.31 122.22 2skd h LEU 765 Ca -0.02 0.01 -0.30 0.00 0.08 0.00 0.00 57.88 57.64 2skd h LEU 765 Cb 0.18 -0.06 -0.05 0.00 1.08 0.00 0.00 40.66 41.82 2skd h LEU 765 CO 0.03 0.20 -1.75 0.23 -1.08 0.00 0.00 178.44 176.07 2skd n MET 766 N -4.47 0.65 -0.00 1.13 2.81 -0.64 -4.58 117.12 112.03 2skd n MET 766 Ca 0.09 0.29 -0.00 0.00 -1.81 0.00 0.00 57.70 56.27 2skd n MET 766 Cb 0.38 -1.78 -0.00 0.00 -0.71 0.00 0.00 33.22 31.10 2skd n MET 766 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2skd n HIS 767 N -3.11 0.00 -2.64 2.03 8.25 -0.16 -4.39 115.22 115.20 2skd n HIS 767 Ca -0.19 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.16 2skd n HIS 767 Cb 1.05 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 32.17 2skd n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2skd n HIS 768 N -1.85 1.56 -2.71 4.41 8.25 0.50 -5.04 115.22 120.33 2skd n HIS 768 Ca -0.01 -2.71 -0.42 0.00 -0.26 0.00 0.00 57.72 54.33 2skd n HIS 768 Cb 0.35 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 31.12 2skd n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2skd s ASP 769 N -3.32 6.24 0.47 0.41 -1.08 -0.72 -4.84 116.67 113.83 2skd s ASP 769 Ca 0.31 -0.53 0.30 0.00 -0.52 0.00 0.00 52.55 52.11 2skd s ASP 769 Cb 0.43 -2.49 1.08 0.00 -1.46 0.00 0.00 42.92 40.48 2skd s ASP 769 CO -0.01 -1.54 1.86 0.03 0.52 0.00 0.00 175.17 176.04 2skd h ARG 770 N 9.67 0.00 -0.23 4.34 3.08 -1.96 -3.20 114.38 126.08 2skd h ARG 770 Ca -0.27 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.74 2skd h ARG 770 Cb 1.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 2skd h ARG 770 CO 1.20 0.00 -0.02 1.19 -1.07 0.00 0.00 179.97 181.26 2skd n PHE 771 N -2.92 0.78 -3.33 3.04 3.72 -1.26 -5.02 117.46 112.47 2skd n PHE 771 Ca 0.02 -1.06 -0.14 0.00 -0.05 0.00 0.00 57.45 56.22 2skd n PHE 771 Cb 0.34 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 2skd n PHE 771 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 2skd n LYS 772 N -0.83 -0.66 -0.07 -1.08 2.85 -1.21 -4.78 118.16 112.38 2skd n LYS 772 Ca 0.23 0.10 -0.09 0.00 -1.05 0.00 0.00 58.31 57.50 2skd n LYS 772 Cb 0.87 -0.75 -0.02 0.00 -0.65 0.00 0.00 35.03 34.49 2skd n LYS 772 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2skd h VAL 773 N 0.56 1.04 -0.22 0.58 2.07 -1.92 -2.92 116.25 115.44 2skd h VAL 773 Ca -0.28 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2skd h VAL 773 Cb 0.58 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2skd h VAL 773 CO 0.17 0.06 0.09 -0.26 0.02 0.00 0.00 177.57 177.65 2skd h PHE 774 N 0.34 0.29 0.00 1.57 0.04 -1.90 -2.83 116.94 114.44 2skd h PHE 774 Ca 0.11 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 2skd h PHE 774 Cb -0.01 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 2skd h PHE 774 CO -0.07 0.23 -0.08 0.00 -0.60 0.00 0.00 178.31 177.79 2skd h ALA 775 N 1.80 1.23 -0.00 2.45 0.00 -1.89 -2.92 119.26 119.93 2skd h ALA 775 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2skd h ALA 775 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2skd h ALA 775 CO -0.01 0.10 -0.64 -0.25 0.00 0.00 0.00 179.25 178.46 2skd n ASP 776 N -3.53 1.01 -0.01 0.00 8.00 -1.08 -4.71 116.55 116.23 2skd n ASP 776 Ca -0.02 -1.00 -0.15 0.00 0.71 0.00 0.00 54.79 54.33 2skd n ASP 776 Cb 0.21 0.85 -0.09 0.00 -0.02 0.00 0.00 41.12 42.08 2skd n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2skd h TYR 777 N 0.52 -1.53 -0.36 1.24 3.20 -1.41 -0.62 116.97 118.01 2skd h TYR 777 Ca 0.00 0.06 0.07 0.00 3.14 0.00 0.00 58.73 62.00 2skd h TYR 777 Cb 0.43 0.69 -0.06 0.00 1.54 0.00 0.00 36.73 39.32 2skd h TYR 777 CO 0.00 -0.53 -0.04 0.93 -1.64 0.00 0.00 178.16 176.87 2skd h GLU 778 N -0.57 0.05 0.00 1.82 5.08 -1.84 -1.80 114.58 117.32 2skd h GLU 778 Ca 0.04 -0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 2skd h GLU 778 Cb 0.67 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2skd h GLU 778 CO -0.43 0.03 -0.35 0.93 -1.00 0.00 0.00 179.01 178.19 2skd h GLU 779 N 0.05 0.00 -0.09 2.33 5.08 -1.83 -2.24 114.58 117.88 2skd h GLU 779 Ca 0.17 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 2skd h GLU 779 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2skd h GLU 779 CO -0.33 0.35 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.03 2skd h TYR 780 N 0.00 0.25 -0.10 4.33 3.20 -0.40 -0.94 116.97 123.30 2skd h TYR 780 Ca -0.00 -0.08 -0.14 0.00 3.14 0.00 0.00 58.73 61.65 2skd h TYR 780 Cb 0.68 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 2skd h TYR 780 CO 0.00 0.64 -0.56 -0.39 -1.64 0.00 0.00 178.16 176.21 2skd h VAL 781 N -0.21 1.36 -0.28 1.81 -1.51 -1.32 -0.24 116.25 115.86 2skd h VAL 781 Ca 0.01 -1.86 -0.00 0.00 -1.23 0.00 0.00 66.70 63.62 2skd h VAL 781 Cb 0.60 1.89 -0.01 0.00 -2.13 0.00 0.00 31.29 31.64 2skd h VAL 781 CO 0.02 0.56 0.16 0.11 -1.23 0.00 0.00 177.57 177.19 2skd h LYS 782 N 0.24 0.38 -0.35 5.19 6.56 -1.42 -1.79 116.57 125.39 2skd h LYS 782 Ca 0.00 -0.04 -0.07 0.00 -1.06 0.00 0.00 60.65 59.48 2skd h LYS 782 Cb 1.05 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 32.62 2skd h LYS 782 CO 0.09 0.32 -0.08 0.00 -2.06 0.00 0.00 179.45 177.73 2skd h GLN 784 N 0.54 0.00 -0.36 0.00 1.08 -0.56 -2.02 115.11 113.78 2skd h GLN 784 Ca 0.10 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.21 2skd h GLN 784 Cb 0.46 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 2skd h GLN 784 CO 0.02 0.31 -0.15 0.93 -0.95 0.00 0.00 178.83 179.00 2skd h GLU 785 N 0.00 0.64 -0.09 1.46 5.08 -0.83 -2.54 114.58 118.29 2skd h GLU 785 Ca -0.00 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 2skd h GLU 785 Cb 0.57 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2skd h GLU 785 CO 0.04 0.76 -0.34 0.00 -1.00 0.00 0.00 179.01 178.47 2skd h ARG 786 N 0.58 0.18 0.00 2.33 3.08 -1.27 -1.65 114.38 117.63 2skd h ARG 786 Ca 0.10 -0.07 -0.19 0.00 0.07 0.00 0.00 59.98 59.89 2skd h ARG 786 Cb 0.59 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 2skd h ARG 786 CO 0.04 0.51 -0.88 -0.39 -1.07 0.00 0.00 179.97 178.18 2skd h VAL 787 N 0.16 1.60 -0.53 2.04 -1.51 -1.30 -2.72 116.25 113.99 2skd h VAL 787 Ca 0.02 -2.93 -0.12 0.00 -1.23 0.00 0.00 66.70 62.44 2skd h VAL 787 Cb 0.69 2.59 -0.02 0.00 -2.13 0.00 0.00 31.29 32.42 2skd h VAL 787 CO 0.05 0.84 -0.13 0.28 -1.23 0.00 0.00 177.57 177.38 2skd h SER 788 N 0.01 1.04 -0.81 4.19 0.02 -1.16 -1.08 113.55 115.77 2skd h SER 788 Ca -0.02 -0.35 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 2skd h SER 788 Cb 1.54 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.76 2skd h SER 788 CO 0.12 1.15 0.44 0.00 -1.14 0.00 0.00 176.83 177.41 2skd h ALA 789 N 0.93 1.04 0.00 3.77 0.00 -1.25 -2.53 119.26 121.22 2skd h ALA 789 Ca 0.14 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2skd h ALA 789 Cb 0.70 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2skd h ALA 789 CO 0.05 0.55 -0.60 1.25 0.00 0.00 0.00 179.25 180.50 2skd h LEU 790 N 1.12 0.00 -1.15 0.00 6.46 -1.28 -3.03 115.31 117.43 2skd h LEU 790 Ca 0.28 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.99 2skd h LEU 790 Cb 0.03 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.95 2skd h LEU 790 CO -0.05 0.60 -0.27 0.22 -0.62 0.00 0.00 178.44 178.32 2skd h TYR 791 N 0.00 0.00 0.00 1.25 3.20 -0.79 -2.12 116.97 118.52 2skd h TYR 791 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2skd h TYR 791 Cb 1.21 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.48 2skd h TYR 791 CO 0.00 0.27 0.00 1.63 -1.64 0.00 0.00 178.16 178.42 2skd n LYS 792 N -3.50 0.09 -3.80 1.82 5.02 -1.02 -3.71 118.16 113.06 2skd n LYS 792 Ca -0.00 0.36 -0.28 0.00 -2.02 0.00 0.00 58.31 56.37 2skd n LYS 792 Cb 0.44 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.66 2skd n LYS 792 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2skd n ASN 793 N -1.84 3.25 -0.33 4.39 2.85 -0.79 -4.99 115.26 117.80 2skd n ASN 793 Ca 0.02 -3.26 0.21 0.00 -0.11 0.00 0.00 54.58 51.44 2skd n ASN 793 Cb 0.17 -0.76 0.40 0.00 1.24 0.00 0.00 39.78 40.83 2skd n ASN 793 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2skd h PRO 794 N 5.17 0.03 -0.55 1.20 0.11 -1.76 -1.16 132.00 135.04 2skd h PRO 794 Ca 0.16 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.20 2skd h PRO 794 Cb 0.73 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 2skd h PRO 794 CO 0.75 0.02 0.06 -0.09 -0.21 0.00 0.00 178.00 178.54 2skd h ARG 795 N 0.03 0.92 0.01 1.05 2.43 -1.94 -1.80 114.38 115.09 2skd h ARG 795 Ca 0.69 -0.26 -0.20 0.00 -0.81 0.00 0.00 59.98 59.39 2skd h ARG 795 Cb 1.59 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 2skd h ARG 795 CO -0.84 0.90 -0.92 0.93 -1.51 0.00 0.00 179.97 178.53 2skd h GLU 796 N 0.81 0.17 -0.30 0.20 4.39 -1.58 -2.15 114.58 116.12 2skd h GLU 796 Ca 0.16 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 2skd h GLU 796 Cb 0.45 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2skd h GLU 796 CO 0.02 0.97 0.09 2.35 -1.16 0.00 0.00 179.01 181.28 2skd h TRP 797 N 0.09 0.49 -0.16 4.33 2.91 -1.20 -1.69 115.95 120.71 2skd h TRP 797 Ca -0.05 -0.05 -0.10 0.00 1.13 0.00 0.00 58.89 59.83 2skd h TRP 797 Cb 1.57 -0.14 -0.01 0.00 -0.51 0.00 0.00 29.16 30.07 2skd h TRP 797 CO 0.03 0.50 -0.32 1.15 -1.03 0.00 0.00 178.44 178.77 2skd h THR 798 N 0.33 1.28 -0.28 2.65 2.02 -1.34 -0.48 112.91 117.08 2skd h THR 798 Ca 0.10 -1.34 -0.13 0.00 0.77 0.00 0.00 66.41 65.81 2skd h THR 798 Cb 0.25 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2skd h THR 798 CO -0.00 0.41 -0.35 0.03 0.37 0.00 0.00 175.52 175.98 2skd h ARG 799 N 0.28 0.62 -0.03 6.66 3.08 -1.19 -0.53 114.38 123.28 2skd h ARG 799 Ca 0.04 -0.29 -0.13 0.00 0.07 0.00 0.00 59.98 59.66 2skd h ARG 799 Cb 0.71 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 2skd h ARG 799 CO 0.05 0.88 -0.58 1.98 -1.07 0.00 0.00 179.97 181.23 2skd h MET 800 N 0.52 0.10 -0.53 0.04 4.05 -0.84 -2.54 114.93 115.73 2skd h MET 800 Ca 0.06 -0.07 -0.07 0.00 -0.28 0.00 0.00 59.70 59.34 2skd h MET 800 Cb 0.85 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.64 2skd h MET 800 CO 0.07 0.65 0.05 0.28 0.23 0.00 0.00 176.91 178.20 2skd h VAL 801 N 0.07 1.26 -0.14 -5.77 2.07 -0.59 -2.38 116.25 110.78 2skd h VAL 801 Ca -0.00 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 2skd h VAL 801 Cb 1.05 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2skd h VAL 801 CO 0.08 0.36 -0.07 0.40 0.02 0.00 0.00 177.57 178.37 2skd h ILE 802 N 0.78 1.13 0.00 4.57 2.04 -0.84 -1.13 117.51 124.06 2skd h ILE 802 Ca 0.16 -0.57 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 2skd h ILE 802 Cb 0.46 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2skd h ILE 802 CO 0.02 0.18 -0.51 -0.09 0.00 0.00 0.00 178.15 177.75 2skd h ARG 803 N 0.20 0.00 0.03 2.37 9.65 -1.03 -1.04 114.38 124.56 2skd h ARG 803 Ca 0.05 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2skd h ARG 803 Cb 0.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 2skd h ARG 803 CO 0.01 0.51 -0.01 -0.91 2.80 0.00 0.00 179.97 182.37 2skd h ASN 804 N 0.00 -0.03 -0.36 -3.80 2.35 -0.85 -3.16 115.58 109.74 2skd h ASN 804 Ca -0.01 -0.61 0.05 0.00 -0.55 0.00 0.00 56.30 55.19 2skd h ASN 804 Cb 0.94 0.01 -0.05 0.00 0.05 0.00 0.00 38.32 39.27 2skd h ASN 804 CO 0.07 0.74 0.06 0.40 -1.65 0.00 0.00 177.43 177.05 2skd h ILE 805 N -0.96 0.81 0.00 2.81 2.04 -1.27 -1.08 117.51 119.87 2skd h ILE 805 Ca -0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2skd h ILE 805 Cb 0.64 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2skd h ILE 805 CO 0.01 0.03 0.00 0.00 0.00 0.00 0.00 178.15 178.19 2skd h ALA 806 N 1.27 1.00 -0.16 1.87 0.00 -1.33 -2.79 119.26 119.12 2skd h ALA 806 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2skd h ALA 806 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2skd h ALA 806 CO -0.23 0.00 0.00 -2.37 0.00 0.00 0.00 179.25 176.65 2skd n THR 807 N -2.46 1.23 1.29 0.00 5.66 -0.48 -2.26 114.28 117.26 2skd n THR 807 Ca -0.00 -1.23 0.13 0.00 -3.05 0.00 0.00 64.05 59.90 2skd n THR 807 Cb 0.15 0.34 0.43 0.00 -1.55 0.00 0.00 70.33 69.70 2skd n THR 807 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2skd n SER 808 N -0.22 0.95 -0.35 1.09 3.41 -0.76 -4.47 113.62 113.27 2skd n SER 808 Ca 0.08 -0.87 0.28 0.00 -0.26 0.00 0.00 58.87 58.11 2skd n SER 808 Cb 0.43 0.09 0.58 0.00 -0.26 0.00 0.00 64.21 65.05 2skd n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2skd h GLY 809 N 4.93 1.01 2.00 5.00 0.00 -1.79 -1.14 103.07 113.09 2skd h GLY 809 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2skd h GLY 809 CO 0.00 -0.17 -0.03 1.70 0.00 0.00 0.00 176.54 178.04 2skd h LYS 810 N 0.26 0.00 -0.85 4.80 3.64 -1.88 -3.13 116.57 119.41 2skd h LYS 810 Ca 0.64 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.89 2skd h LYS 810 Cb 1.89 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.63 2skd h LYS 810 CO -0.27 0.03 0.17 1.19 -2.27 0.00 0.00 179.45 178.29 2skd n PHE 811 N -3.27 1.55 -3.15 1.91 3.72 -0.43 -4.81 117.46 112.97 2skd n PHE 811 Ca -0.02 -0.81 -0.38 0.00 -0.05 0.00 0.00 57.45 56.19 2skd n PHE 811 Cb 0.16 -0.49 -0.06 0.00 -0.94 0.00 0.00 39.48 38.15 2skd n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2skd s SER 812 N -0.46 7.13 0.00 4.37 0.15 -1.18 -0.25 113.70 123.45 2skd s SER 812 Ca 0.35 1.39 0.18 0.00 0.70 0.00 0.00 55.95 58.57 2skd s SER 812 Cb 0.28 -2.41 0.87 0.00 -1.71 0.00 0.00 66.02 63.05 2skd s SER 812 CO 0.09 0.17 1.54 -1.54 1.20 0.00 0.00 173.24 174.70 2skd n SER 813 N 1.30 0.00 -0.02 5.45 3.41 0.43 -2.02 113.62 122.17 2skd n SER 813 Ca -0.06 0.11 -0.14 0.00 -0.26 0.00 0.00 58.87 58.52 2skd n SER 813 Cb 0.50 -0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 2skd n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2skd h ASP 814 N 0.00 0.82 -0.35 4.04 3.32 -1.92 -0.33 116.42 121.99 2skd h ASP 814 Ca 0.00 -0.48 -0.11 0.00 0.02 0.00 0.00 57.03 56.45 2skd h ASP 814 Cb 0.19 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2skd h ASP 814 CO 0.00 1.26 -0.22 -0.09 -1.72 0.00 0.00 179.24 178.46 2skd h ARG 815 N 0.52 0.78 0.01 3.56 1.12 -1.74 -1.13 114.38 117.50 2skd h ARG 815 Ca -0.01 -0.36 -0.00 0.00 -1.11 0.00 0.00 59.98 58.49 2skd h ARG 815 Cb 1.24 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.19 2skd h ARG 815 CO 0.13 0.99 -0.00 1.15 -3.11 0.00 0.00 179.97 179.12 2skd h THR 816 N 0.56 1.01 -0.43 0.20 2.02 -1.46 -2.45 112.91 112.36 2skd h THR 816 Ca 0.07 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.13 2skd h THR 816 Cb 0.78 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 2skd h THR 816 CO 0.06 0.02 0.03 0.40 0.37 0.00 0.00 175.52 176.40 2skd h ILE 817 N -0.04 1.22 -0.46 3.11 1.08 -1.02 -1.65 117.51 119.75 2skd h ILE 817 Ca -0.00 -0.86 -0.05 0.00 -0.39 0.00 0.00 64.86 63.56 2skd h ILE 817 Cb 0.04 0.86 -0.02 0.00 -3.07 0.00 0.00 36.82 34.63 2skd h ILE 817 CO 0.00 0.30 0.07 0.00 -0.69 0.00 0.00 178.15 177.83 2skd h ALA 818 N 1.39 1.26 -0.16 1.87 0.00 -1.02 0.09 119.26 122.69 2skd h ALA 818 Ca 0.14 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 2skd h ALA 818 Cb 0.36 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2skd h ALA 818 CO 0.01 0.51 -0.71 1.96 0.00 0.00 0.00 179.25 181.02 2skd h GLN 819 N 0.68 0.70 -0.24 0.00 4.20 -0.94 -1.65 115.11 117.86 2skd h GLN 819 Ca 0.15 -0.54 -0.02 0.00 0.06 0.00 0.00 58.65 58.30 2skd h GLN 819 Cb 0.32 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2skd h GLN 819 CO 0.01 1.16 0.06 1.88 -0.67 0.00 0.00 178.83 181.26 2skd h TYR 820 N 0.50 0.40 -0.19 2.96 -1.99 -1.06 0.83 116.97 118.41 2skd h TYR 820 Ca -0.03 -0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.69 2skd h TYR 820 Cb 1.31 -0.11 -0.04 0.00 2.00 0.00 0.00 36.73 39.89 2skd h TYR 820 CO 0.07 0.47 -0.06 0.00 -0.00 0.00 0.00 178.16 178.63 2skd h ALA 821 N 0.88 0.11 0.02 3.88 0.00 -0.94 0.14 119.26 123.34 2skd h ALA 821 Ca 0.08 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2skd h ALA 821 Cb 0.27 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.24 2skd h ALA 821 CO -0.00 -0.49 -0.23 0.00 0.00 0.00 0.00 179.25 178.53 2skd h ARG 822 N -0.03 0.12 0.00 0.00 3.08 -1.25 0.49 114.38 116.80 2skd h ARG 822 Ca 0.10 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2skd h ARG 822 Cb 0.17 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2skd h ARG 822 CO -0.21 0.97 -0.45 0.39 -1.07 0.00 0.00 179.97 179.59 2skd n GLU 823 N -4.51 0.22 0.03 0.04 1.02 0.28 -4.13 120.64 113.58 2skd n GLU 823 Ca -0.10 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2skd n GLU 823 Cb 0.52 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2skd n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2skd n ILE 824 N -1.99 0.34 0.15 -3.67 5.41 -0.03 -4.87 119.36 114.70 2skd n ILE 824 Ca 0.04 0.11 0.03 0.00 1.00 0.00 0.00 62.75 63.94 2skd n ILE 824 Cb 0.41 -1.26 0.09 0.00 -0.71 0.00 0.00 39.64 38.17 2skd n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2skd h TRP 825 N 0.00 0.00 -2.84 1.39 6.55 -0.80 -3.48 115.95 116.76 2skd h TRP 825 Ca 0.00 0.00 -0.13 0.00 0.95 0.00 0.00 58.89 59.71 2skd h TRP 825 Cb 0.46 0.00 0.05 0.00 -0.86 0.00 0.00 29.16 28.82 2skd h TRP 825 CO 0.00 0.46 -0.24 0.41 -1.05 0.00 0.00 178.44 178.02 2skd n GLY 826 N 1.04 0.36 3.15 1.49 0.00 0.15 -4.98 105.19 106.40 2skd n GLY 826 Ca 0.02 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 2skd n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2skd s VAL 827 N -3.11 0.81 -0.20 1.61 -7.23 0.05 -5.01 120.40 107.32 2skd s VAL 827 Ca 0.14 -1.57 -0.06 0.00 -1.81 0.00 0.00 61.98 58.67 2skd s VAL 827 Cb -0.06 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 2skd s VAL 827 CO 0.25 -0.58 0.04 -1.61 -0.31 0.00 0.00 175.10 172.89 2skd s GLU 828 N -2.72 3.79 0.78 4.82 0.41 -1.26 -3.47 118.70 121.05 2skd s GLU 828 Ca 0.03 -0.44 -0.12 0.00 -0.41 0.00 0.00 54.97 54.04 2skd s GLU 828 Cb -0.03 -3.16 0.07 0.00 -1.78 0.00 0.00 34.13 29.23 2skd s GLU 828 CO -0.01 0.12 1.13 -1.25 -0.49 0.00 0.00 175.26 174.76 2skd s PRO 829 N 0.75 1.99 -0.18 0.39 0.04 -1.26 -4.95 135.00 131.78 2skd s PRO 829 Ca 0.02 1.41 -0.08 0.00 0.04 0.00 0.00 61.00 62.39 2skd s PRO 829 Cb -0.14 -1.85 0.08 0.00 0.04 0.00 0.00 34.50 32.63 2skd s PRO 829 CO 0.02 -1.88 0.41 0.45 0.04 0.00 0.00 177.00 176.04 2skd s SER 830 N -2.84 -0.34 -0.41 6.66 0.15 -0.37 -5.02 113.70 111.54 2skd s SER 830 Ca 0.66 0.93 -0.01 0.00 0.70 0.00 0.00 55.95 58.23 2skd s SER 830 Cb -0.21 1.07 0.33 0.00 -1.71 0.00 0.00 66.02 65.49 2skd s SER 830 CO 0.52 -0.22 1.94 0.54 1.20 0.00 0.00 173.24 177.23 2skd n ARG 831 N 4.90 2.06 -3.26 5.44 5.12 -1.26 -3.26 116.66 126.40 2skd n ARG 831 Ca -0.15 -2.13 -0.39 0.00 -1.93 0.00 0.00 57.85 53.25 2skd n ARG 831 Cb 0.52 -1.84 -0.07 0.00 -1.16 0.00 0.00 32.46 29.92 2skd n ARG 831 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2skd s GLN 832 N -2.45 4.20 0.10 5.56 -0.21 -1.26 -5.03 119.66 120.57 2skd s GLN 832 Ca 0.42 0.41 -0.31 0.00 0.02 0.00 0.00 55.36 55.89 2skd s GLN 832 Cb 0.33 -3.55 -0.09 0.00 1.00 0.00 0.00 33.01 30.70 2skd s GLN 832 CO 0.01 -0.11 1.68 1.03 -2.12 0.00 0.00 175.29 175.78 2skd s ARG 833 N 1.51 4.18 0.53 2.91 3.00 -1.26 -4.94 118.95 124.88 2skd s ARG 833 Ca 0.24 2.40 -0.21 0.00 0.00 0.00 0.00 55.73 58.17 2skd s ARG 833 Cb -0.15 -3.52 -0.06 0.00 0.00 0.00 0.00 34.95 31.23 2skd s ARG 833 CO 0.10 -0.74 1.20 -1.17 0.00 0.00 0.00 175.30 174.69 2skd s LEU 834 N 2.40 3.83 -0.30 2.53 2.96 0.10 -4.77 118.68 125.43 2skd s LEU 834 Ca 0.75 2.38 -0.17 0.00 -0.22 0.00 0.00 54.13 56.87 2skd s LEU 834 Cb -0.42 -4.42 -0.19 0.00 0.50 0.00 0.00 46.19 41.66 2skd s LEU 834 CO 0.33 -1.29 1.38 -0.81 -1.32 0.00 0.00 176.35 174.65 2skd n PRO 835 N -1.07 0.02 -0.71 0.98 -0.04 -1.26 -4.74 135.00 128.18 2skd n PRO 835 Ca 0.11 -0.79 0.06 0.00 -0.04 0.00 0.00 63.50 62.84 2skd n PRO 835 Cb 0.49 -2.29 -0.02 0.00 -0.04 0.00 0.00 33.50 31.64 2skd n PRO 835 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2skd n ALA 836 N 9.98 -2.60 0.03 0.55 0.00 -1.26 -4.65 120.51 122.56 2skd n ALA 836 Ca 0.26 0.21 0.09 0.00 0.00 0.00 0.00 53.44 54.00 2skd n ALA 836 Cb 0.41 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 2skd n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2skd n PRO 837 N -2.43 0.64 0.00 0.00 -0.04 -1.26 -4.95 135.00 126.96 2skd n PRO 837 Ca -0.01 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 2skd n PRO 837 Cb 0.56 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 2skd n PRO 837 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2skd n ASP 838 N -2.50 0.00 0.00 3.54 2.03 -1.26 -4.55 116.55 113.81 2skd n ASP 838 Ca -0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.26 2skd n ASP 838 Cb 0.63 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 2skd n ASP 838 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2skd n GLU 839 N 0.00 0.00 -1.71 -0.67 0.00 -1.26 -4.96 120.64 112.05 2skd n GLU 839 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2skd n GLU 839 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2skd n GLU 839 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2skd n LYS 840 N 0.00 -3.80 -3.22 5.31 -0.00 -1.26 -5.03 118.16 110.17 2skd n LYS 840 Ca 0.00 2.78 -0.10 0.00 -0.00 0.00 0.00 58.31 60.99 2skd n LYS 840 Cb 0.00 -3.23 -0.04 0.00 -0.00 0.00 0.00 35.03 31.76 2skd n LYS 840 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 2skd s ILE 841 N -2.45 -0.61 -2.00 0.58 -1.16 -1.26 -5.15 121.20 109.16 2skd s ILE 841 Ca 0.00 -0.80 0.31 0.00 -0.51 0.00 0.00 60.65 59.65 2skd s ILE 841 Cb 0.00 -0.38 0.88 0.00 0.61 0.00 0.00 42.46 43.57 2skd s ILE 841 CO 0.00 -0.35 2.18 -2.65 -2.81 0.00 0.00 174.94 171.31