#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ksc h GLU 9 N 0.00 0.00 -0.50 -3.83 3.07 -1.97 -2.62 114.58 108.73 3ksc h GLU 9 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 3ksc h GLU 9 Cb 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 3ksc h GLU 9 CO 0.00 0.00 0.05 0.00 -1.40 0.00 0.00 179.01 177.66 3ksc n GLN 11 N 0.06 4.43 -2.94 0.00 7.27 -0.99 -4.96 117.38 120.25 3ksc n GLN 11 Ca 0.28 -3.46 -0.41 0.00 0.07 0.00 0.00 57.00 53.48 3ksc n GLN 11 Cb 1.14 -2.56 -0.04 0.00 2.41 0.00 0.00 30.24 31.19 3ksc n GLN 11 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 3ksc s LEU 12 N -2.38 4.14 0.01 1.69 1.43 -1.26 -4.90 118.68 117.40 3ksc s LEU 12 Ca 0.53 1.07 0.22 0.00 -1.03 0.00 0.00 54.13 54.92 3ksc s LEU 12 Cb 0.21 -3.15 -0.10 0.00 0.03 0.00 0.00 46.19 43.18 3ksc s LEU 12 CO -0.12 -0.41 0.92 -0.62 0.23 0.00 0.00 176.35 176.36 3ksc n GLU 13 N 5.41 0.17 -3.77 1.70 -0.58 -1.26 -4.92 120.64 117.39 3ksc n GLU 13 Ca 0.04 -0.03 -0.13 0.00 -0.42 0.00 0.00 57.16 56.61 3ksc n GLU 13 Cb 0.49 -1.53 -0.14 0.00 -0.57 0.00 0.00 31.44 29.69 3ksc n GLU 13 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 3ksc s ARG 14 N -3.13 0.08 0.26 3.49 3.00 -1.26 -4.43 118.95 116.95 3ksc s ARG 14 Ca 0.05 0.29 0.11 0.00 -1.00 0.00 0.00 55.73 55.18 3ksc s ARG 14 Cb 0.15 -0.13 -0.05 0.00 0.00 0.00 0.00 34.95 34.92 3ksc s ARG 14 CO 0.84 -0.13 -0.16 -0.51 0.00 0.00 0.00 175.30 175.34 3ksc s LEU 15 N 0.88 2.71 0.08 -0.88 1.43 0.68 -4.97 118.68 118.62 3ksc s LEU 15 Ca -0.07 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 52.18 3ksc s LEU 15 Cb -0.09 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.82 3ksc s LEU 15 CO -0.04 0.05 -0.12 -1.81 0.23 0.00 0.00 176.35 174.66 3ksc s ASP 16 N -3.36 1.50 -0.53 2.29 1.11 -1.26 -4.73 116.67 111.69 3ksc s ASP 16 Ca 0.28 -0.69 -0.28 0.00 0.18 0.00 0.00 52.55 52.05 3ksc s ASP 16 Cb -0.06 -0.02 0.03 0.00 1.07 0.00 0.00 42.92 43.94 3ksc s ASP 16 CO 0.15 -0.16 1.13 0.00 1.18 0.00 0.00 175.17 177.46 3ksc s ALA 17 N -1.75 3.09 -0.09 5.23 0.00 -1.26 -4.59 121.76 122.39 3ksc s ALA 17 Ca 0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 3ksc s ALA 17 Cb -0.07 -3.92 -0.05 0.00 0.00 0.00 0.00 23.12 19.08 3ksc s ALA 17 CO 0.01 -2.43 0.25 -0.51 0.00 0.00 0.00 175.76 173.09 3ksc s LEU 18 N 4.57 4.40 0.21 0.00 1.43 -0.13 -4.82 118.68 124.33 3ksc s LEU 18 Ca 0.43 0.64 0.05 0.00 -1.03 0.00 0.00 54.13 54.22 3ksc s LEU 18 Cb -0.08 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 3ksc s LEU 18 CO 0.28 0.33 0.30 -1.61 0.23 0.00 0.00 176.35 175.87 3ksc s GLU 19 N -0.81 3.32 0.64 1.70 2.02 -1.26 -1.43 118.70 122.88 3ksc s GLU 19 Ca 0.18 -0.76 -0.17 0.00 0.02 0.00 0.00 54.97 54.23 3ksc s GLU 19 Cb -0.14 -2.85 -0.04 0.00 0.10 0.00 0.00 34.13 31.20 3ksc s GLU 19 CO 0.07 0.46 0.81 -2.30 0.02 0.00 0.00 175.26 174.32 3ksc n PRO 20 N -1.04 0.65 -0.14 0.39 -0.02 -1.26 -4.78 135.00 128.80 3ksc n PRO 20 Ca -0.08 0.26 0.05 0.00 -2.02 0.00 0.00 63.50 61.71 3ksc n PRO 20 Cb 0.56 -2.04 0.12 0.00 -0.02 0.00 0.00 33.50 32.13 3ksc n PRO 20 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3ksc n ASP 21 N -0.65 2.75 -3.67 2.55 3.85 -0.79 -4.95 116.55 115.64 3ksc n ASP 21 Ca 0.13 -2.02 -0.09 0.00 -0.71 0.00 0.00 54.79 52.10 3ksc n ASP 21 Cb 0.48 -0.19 -0.09 0.00 -1.35 0.00 0.00 41.12 39.97 3ksc n ASP 21 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 3ksc s ASN 22 N -1.02 -0.69 -0.06 -1.12 2.47 -1.20 -5.04 114.94 108.29 3ksc s ASN 22 Ca 0.19 1.15 0.00 0.00 0.42 0.00 0.00 52.86 54.62 3ksc s ASN 22 Cb 0.10 1.05 0.02 0.00 -1.45 0.00 0.00 41.25 40.97 3ksc s ASN 22 CO 0.12 -0.21 -0.04 0.00 -3.72 0.00 0.00 177.10 173.25 3ksc s ARG 23 N 1.55 0.87 -0.15 0.43 1.70 -1.26 -1.82 118.95 120.27 3ksc s ARG 23 Ca -0.09 -0.08 0.01 0.00 -0.47 0.00 0.00 55.73 55.09 3ksc s ARG 23 Cb -0.07 -0.96 0.02 0.00 -0.57 0.00 0.00 34.95 33.37 3ksc s ARG 23 CO -0.16 -0.14 -0.16 0.42 -1.08 0.00 0.00 175.30 174.18 3ksc s ILE 24 N 1.22 1.69 -0.08 4.99 1.01 0.26 -4.99 121.20 125.31 3ksc s ILE 24 Ca -0.06 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 59.75 3ksc s ILE 24 Cb -0.14 -1.56 -0.05 0.00 0.01 0.00 0.00 42.46 40.72 3ksc s ILE 24 CO -0.02 0.48 0.29 -1.61 0.00 0.00 0.00 174.94 174.08 3ksc s GLU 25 N 1.30 3.85 0.34 2.79 2.02 -1.26 -1.20 118.70 126.54 3ksc s GLU 25 Ca 0.02 0.15 0.04 0.00 0.02 0.00 0.00 54.97 55.20 3ksc s GLU 25 Cb -0.13 -3.27 -0.06 0.00 0.10 0.00 0.00 34.13 30.77 3ksc s GLU 25 CO -0.09 0.60 0.06 -1.54 0.02 0.00 0.00 175.26 174.31 3ksc s SER 26 N -0.65 2.58 0.49 -0.19 1.04 0.31 -4.84 113.70 112.44 3ksc s SER 26 Ca 0.19 -1.41 0.14 0.00 0.48 0.00 0.00 55.95 55.35 3ksc s SER 26 Cb -0.14 -0.04 1.16 0.00 0.10 0.00 0.00 66.02 67.09 3ksc s SER 26 CO 0.08 -0.63 2.12 1.05 0.98 0.00 0.00 173.24 176.84 3ksc h GLU 27 N 2.04 0.15 -0.14 4.02 4.11 -0.41 -2.35 114.58 122.00 3ksc h GLU 27 Ca -0.41 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.01 3ksc h GLU 27 Cb 1.25 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3ksc h GLU 27 CO 0.70 0.10 0.00 0.41 0.07 0.00 0.00 179.01 180.29 3ksc n GLY 28 N -1.52 0.79 0.00 1.06 0.00 0.38 -4.68 105.19 101.21 3ksc n GLY 28 Ca -0.01 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.55 3ksc n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ksc n GLY 29 N 0.88 -0.57 3.05 -0.02 0.00 -0.89 -0.66 105.19 106.98 3ksc n GLY 29 Ca 0.11 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 3ksc n GLY 29 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ksc s LEU 30 N 0.00 1.38 -0.10 0.99 2.96 -0.20 -0.53 118.68 123.19 3ksc s LEU 30 Ca 0.00 0.31 0.03 0.00 -0.22 0.00 0.00 54.13 54.26 3ksc s LEU 30 Cb 0.00 0.57 0.01 0.00 0.50 0.00 0.00 46.19 47.27 3ksc s LEU 30 CO 0.00 -0.07 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.13 3ksc s ILE 31 N 0.04 1.78 -0.05 6.68 1.01 -0.35 -0.32 121.20 129.99 3ksc s ILE 31 Ca -0.01 -0.85 0.06 0.00 0.00 0.00 0.00 60.65 59.86 3ksc s ILE 31 Cb -0.01 -1.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.88 3ksc s ILE 31 CO 0.00 0.50 -0.25 -1.61 0.00 0.00 0.00 174.94 173.58 3ksc s GLU 32 N 0.51 2.50 -0.00 2.79 2.02 0.38 -0.57 118.70 126.33 3ksc s GLU 32 Ca -0.16 -0.91 0.07 0.00 0.02 0.00 0.00 54.97 54.00 3ksc s GLU 32 Cb -0.17 -2.15 -0.02 0.00 0.10 0.00 0.00 34.13 31.89 3ksc s GLU 32 CO 0.06 0.41 -0.23 0.95 0.02 0.00 0.00 175.26 176.46 3ksc s THR 33 N -0.23 1.84 0.43 3.63 -4.23 -0.76 -0.65 115.64 115.67 3ksc s THR 33 Ca -0.02 -1.06 -0.09 0.00 -1.18 0.00 0.00 61.69 59.34 3ksc s THR 33 Cb -0.13 -1.54 -0.06 0.00 1.34 0.00 0.00 72.50 72.11 3ksc s THR 33 CO 0.03 0.45 0.78 0.26 -0.54 0.00 0.00 174.62 175.61 3ksc s TRP 34 N -0.61 3.50 -0.45 3.99 0.51 -0.61 -1.89 118.94 123.38 3ksc s TRP 34 Ca 0.09 1.00 -0.28 0.00 -2.12 0.00 0.00 56.10 54.80 3ksc s TRP 34 Cb -0.09 -2.42 -0.02 0.00 -0.81 0.00 0.00 33.47 30.13 3ksc s TRP 34 CO -0.00 -0.17 1.83 1.21 -0.51 0.00 0.00 176.95 179.31 3ksc s ASN 35 N -3.40 5.60 0.25 2.95 2.47 -1.26 -4.62 114.94 116.93 3ksc s ASN 35 Ca 0.51 0.88 0.21 0.00 0.42 0.00 0.00 52.86 54.88 3ksc s ASN 35 Cb -0.10 -2.53 0.97 0.00 -1.45 0.00 0.00 41.25 38.14 3ksc s ASN 35 CO 0.35 -2.01 1.65 -0.81 -3.72 0.00 0.00 177.10 172.56 3ksc n PRO 36 N 8.74 0.16 0.00 0.43 -0.04 -1.26 -1.93 135.00 141.09 3ksc n PRO 36 Ca 0.22 0.48 0.12 0.00 -0.04 0.00 0.00 63.50 64.28 3ksc n PRO 36 Cb 0.49 -1.86 0.27 0.00 -0.04 0.00 0.00 33.50 32.36 3ksc n PRO 36 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ksc n ASN 37 N -2.16 0.53 -4.71 3.54 5.03 -1.26 -4.06 115.26 112.16 3ksc n ASN 37 Ca 0.01 -0.28 -0.42 0.00 0.87 0.00 0.00 54.58 54.76 3ksc n ASN 37 Cb 0.16 0.23 -0.03 0.00 -1.02 0.00 0.00 39.78 39.12 3ksc n ASN 37 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 3ksc s ASN 38 N -2.96 6.39 0.20 6.41 3.84 -0.81 -4.79 114.94 123.22 3ksc s ASN 38 Ca 0.12 2.83 -0.08 0.00 0.21 0.00 0.00 52.86 55.93 3ksc s ASN 38 Cb 0.18 -2.58 0.30 0.00 -0.55 0.00 0.00 41.25 38.59 3ksc s ASN 38 CO 0.68 -1.00 1.18 0.29 -2.79 0.00 0.00 177.10 175.47 3ksc n LYS 39 N 4.87 -0.10 -0.34 0.43 4.76 -1.26 -0.09 118.16 126.43 3ksc n LYS 39 Ca 0.17 1.18 -0.00 0.00 -2.87 0.00 0.00 58.31 56.79 3ksc n LYS 39 Cb 0.37 -1.76 0.13 0.00 -1.84 0.00 0.00 35.03 31.93 3ksc n LYS 39 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 3ksc h GLN 40 N 0.00 1.11 0.04 1.97 4.20 -1.90 -1.05 115.11 119.48 3ksc h GLN 40 Ca 0.33 -0.07 -0.24 0.00 0.06 0.00 0.00 58.65 58.74 3ksc h GLN 40 Cb 0.52 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3ksc h GLN 40 CO -0.77 0.73 -1.03 0.74 -0.67 0.00 0.00 178.83 177.83 3ksc h PHE 41 N 1.14 0.56 -0.45 2.96 0.04 -0.78 -2.70 116.94 117.71 3ksc h PHE 41 Ca 0.38 -0.33 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 3ksc h PHE 41 Cb 0.04 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 3ksc h PHE 41 CO -0.01 1.18 0.28 0.00 -0.60 0.00 0.00 178.31 179.16 3ksc h ARG 42 N 0.17 0.60 -0.10 1.51 3.08 -0.71 0.19 114.38 119.12 3ksc h ARG 42 Ca -0.10 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.92 3ksc h ARG 42 Cb 1.70 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.60 3ksc h ARG 42 CO 0.17 0.43 0.02 0.00 -1.07 0.00 0.00 179.97 179.52 3ksc h ALA 44 N 1.07 1.93 -0.56 0.00 0.00 -1.12 -3.46 119.26 117.12 3ksc h ALA 44 Ca 0.04 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3ksc h ALA 44 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ksc h ALA 44 CO -0.06 0.05 -0.11 0.41 0.00 0.00 0.00 179.25 179.54 3ksc n GLY 45 N -1.43 0.30 3.44 0.00 0.00 0.64 -4.84 105.19 103.30 3ksc n GLY 45 Ca -0.03 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 3ksc n GLY 45 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ksc s VAL 46 N -2.22 0.46 0.05 1.61 -7.23 -0.98 -1.25 120.40 110.84 3ksc s VAL 46 Ca 0.00 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.19 3ksc s VAL 46 Cb 0.00 -2.42 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 3ksc s VAL 46 CO 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 175.10 174.71 3ksc s ALA 47 N -3.33 0.63 -0.00 1.32 0.00 -0.32 -4.63 121.76 115.43 3ksc s ALA 47 Ca 0.29 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.50 3ksc s ALA 47 Cb 0.03 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 3ksc s ALA 47 CO 0.17 -0.02 -0.18 -1.17 0.00 0.00 0.00 175.76 174.56 3ksc s LEU 48 N -1.67 2.07 0.18 0.00 0.20 -1.26 -0.59 118.68 117.60 3ksc s LEU 48 Ca -0.08 -0.37 -0.10 0.00 0.69 0.00 0.00 54.13 54.26 3ksc s LEU 48 Cb -0.09 -0.93 -0.01 0.00 -0.43 0.00 0.00 46.19 44.73 3ksc s LEU 48 CO 0.00 0.20 0.32 -0.94 -0.29 0.00 0.00 176.35 175.65 3ksc s SER 49 N -0.61 0.00 -0.06 3.68 1.04 -0.56 -1.57 113.70 115.61 3ksc s SER 49 Ca 0.07 -0.85 -0.03 0.00 0.48 0.00 0.00 55.95 55.62 3ksc s SER 49 Cb -0.07 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.55 3ksc s SER 49 CO -0.00 -0.93 0.12 -0.60 0.98 0.00 0.00 173.24 172.81 3ksc s ARG 50 N -3.97 0.00 -0.13 4.02 3.52 0.17 -0.61 118.95 121.96 3ksc s ARG 50 Ca 0.17 0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 56.22 3ksc s ARG 50 Cb 0.03 -0.33 -0.02 0.00 -1.56 0.00 0.00 34.95 33.07 3ksc s ARG 50 CO 0.01 -0.28 -0.11 0.00 -0.81 0.00 0.00 175.30 174.11 3ksc s ALA 51 N 2.02 2.72 -0.26 6.12 0.00 0.53 -0.47 121.76 132.42 3ksc s ALA 51 Ca 0.01 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 3ksc s ALA 51 Cb -0.12 -1.27 0.02 0.00 0.00 0.00 0.00 23.12 21.75 3ksc s ALA 51 CO -0.05 0.28 -0.04 0.99 0.00 0.00 0.00 175.76 176.94 3ksc s THR 52 N 0.24 3.03 -0.25 0.00 2.01 0.57 -1.14 115.64 120.09 3ksc s THR 52 Ca -0.07 -0.99 -0.08 0.00 0.31 0.00 0.00 61.69 60.85 3ksc s THR 52 Cb -0.15 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 3ksc s THR 52 CO 0.05 0.17 0.11 -0.76 -0.69 0.00 0.00 174.62 173.50 3ksc s LEU 53 N 1.35 3.65 0.00 4.42 1.43 -0.20 -1.03 118.68 128.30 3ksc s LEU 53 Ca 0.00 -0.12 -0.21 0.00 -1.03 0.00 0.00 54.13 52.77 3ksc s LEU 53 Cb -0.17 -1.99 0.31 0.00 0.03 0.00 0.00 46.19 44.37 3ksc s LEU 53 CO -0.03 -0.02 1.07 0.00 0.23 0.00 0.00 176.35 177.59 3ksc n GLN 54 N 4.86 -3.23 -1.96 1.70 1.13 0.16 -0.91 117.38 119.14 3ksc n GLN 54 Ca -0.15 -1.71 -0.40 0.00 -1.94 0.00 0.00 57.00 52.80 3ksc n GLN 54 Cb 0.52 -1.63 -0.00 0.00 0.11 0.00 0.00 30.24 29.23 3ksc n GLN 54 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3ksc s ARG 55 N -5.43 4.00 -1.33 -1.09 1.70 -1.26 -3.15 118.95 112.39 3ksc s ARG 55 Ca 0.70 2.30 -0.04 0.00 -0.47 0.00 0.00 55.73 58.22 3ksc s ARG 55 Cb -0.07 -2.83 0.02 0.00 -0.57 0.00 0.00 34.95 31.50 3ksc s ARG 55 CO 0.54 -0.52 0.89 0.09 -1.08 0.00 0.00 175.30 175.22 3ksc n ASN 56 N 0.23 -2.72 -4.35 -2.89 5.03 -0.21 -4.80 115.26 105.55 3ksc n ASN 56 Ca 0.03 -0.72 -0.29 0.00 0.87 0.00 0.00 54.58 54.46 3ksc n ASN 56 Cb 0.42 -4.44 -0.14 0.00 -1.02 0.00 0.00 39.78 34.60 3ksc n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3ksc s ALA 57 N -3.48 2.24 -0.23 5.41 0.00 -1.04 0.15 121.76 124.81 3ksc s ALA 57 Ca 0.19 -1.33 0.01 0.00 0.00 0.00 0.00 51.96 50.84 3ksc s ALA 57 Cb -0.09 -0.42 0.03 0.00 0.00 0.00 0.00 23.12 22.64 3ksc s ALA 57 CO 0.78 0.52 -0.13 -1.17 0.00 0.00 0.00 175.76 175.76 3ksc s LEU 58 N -1.56 2.89 -0.71 0.00 0.20 0.11 -0.90 118.68 118.71 3ksc s LEU 58 Ca 0.12 -0.96 -0.26 0.00 0.69 0.00 0.00 54.13 53.72 3ksc s LEU 58 Cb -0.10 -1.56 0.00 0.00 -0.43 0.00 0.00 46.19 44.10 3ksc s LEU 58 CO 0.04 -0.10 1.60 -0.60 -0.29 0.00 0.00 176.35 177.00 3ksc s ARG 59 N 1.24 2.91 0.66 1.98 6.06 0.13 -1.11 118.95 130.82 3ksc s ARG 59 Ca -0.01 0.09 -0.16 0.00 -2.50 0.00 0.00 55.73 53.15 3ksc s ARG 59 Cb -0.16 -4.41 0.00 0.00 0.06 0.00 0.00 34.95 30.44 3ksc s ARG 59 CO -0.08 -2.50 1.19 1.03 -2.50 0.00 0.00 175.30 172.43 3ksc s ARG 60 N 6.38 2.61 0.17 5.12 0.52 -0.70 -2.41 118.95 130.64 3ksc s ARG 60 Ca 0.53 1.70 -0.33 0.00 -0.52 0.00 0.00 55.73 57.11 3ksc s ARG 60 Cb -0.10 -1.90 -0.15 0.00 0.52 0.00 0.00 34.95 33.33 3ksc s ARG 60 CO 0.15 -1.46 1.34 -2.30 0.02 0.00 0.00 175.30 173.05 3ksc n PRO 61 N -2.21 1.60 -3.62 3.54 -0.02 -1.26 -4.78 135.00 128.25 3ksc n PRO 61 Ca 0.13 0.57 -0.12 0.00 -2.02 0.00 0.00 63.50 62.06 3ksc n PRO 61 Cb 0.50 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 3ksc n PRO 61 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3ksc s TYR 62 N 0.17 -0.28 0.09 6.00 1.13 -0.77 -2.74 117.35 120.94 3ksc s TYR 62 Ca 0.75 0.12 0.00 0.00 -1.41 0.00 0.00 57.07 56.53 3ksc s TYR 62 Cb -0.78 0.28 -0.04 0.00 -1.10 0.00 0.00 41.96 40.32 3ksc s TYR 62 CO 0.48 -0.66 -0.03 1.52 -2.51 0.00 0.00 175.55 174.35 3ksc s TYR 63 N -3.18 0.77 0.08 -3.49 -0.85 -0.23 -0.67 117.35 109.79 3ksc s TYR 63 Ca -0.01 -1.03 0.03 0.00 -0.52 0.00 0.00 57.07 55.54 3ksc s TYR 63 Cb 0.00 -0.48 -0.03 0.00 0.38 0.00 0.00 41.96 41.83 3ksc s TYR 63 CO -0.07 -0.30 -0.09 0.45 -1.52 0.00 0.00 175.55 174.01 3ksc s SER 64 N -3.01 1.25 -0.04 -0.18 0.15 -1.26 -0.60 113.70 110.01 3ksc s SER 64 Ca 0.13 -0.76 0.04 0.00 0.70 0.00 0.00 55.95 56.06 3ksc s SER 64 Cb 0.07 0.03 0.18 0.00 -1.71 0.00 0.00 66.02 64.58 3ksc s SER 64 CO -0.05 -0.27 0.92 -0.46 1.20 0.00 0.00 173.24 174.58 3ksc n ASN 65 N 0.75 1.69 -3.69 5.45 6.94 -1.25 0.00 115.26 125.15 3ksc n ASN 65 Ca -0.18 -2.14 -0.11 0.00 -0.02 0.00 0.00 54.58 52.13 3ksc n ASN 65 Cb 0.57 -0.39 -0.06 0.00 -2.36 0.00 0.00 39.78 37.54 3ksc n ASN 65 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ksc s ALA 66 N -1.54 -0.86 0.44 -2.53 0.00 -1.26 -3.97 121.76 112.03 3ksc s ALA 66 Ca 0.12 0.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.89 3ksc s ALA 66 Cb 0.08 0.47 -0.08 0.00 0.00 0.00 0.00 23.12 23.60 3ksc s ALA 66 CO 0.05 -0.52 1.31 -1.25 0.00 0.00 0.00 175.76 175.36 3ksc s PRO 67 N -3.06 3.76 -0.02 0.00 0.04 -1.26 -4.45 135.00 130.01 3ksc s PRO 67 Ca -0.02 2.16 0.08 0.00 0.04 0.00 0.00 61.00 63.26 3ksc s PRO 67 Cb 0.01 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.91 3ksc s PRO 67 CO -0.07 -0.67 -0.25 -0.65 0.04 0.00 0.00 177.00 175.41 3ksc s GLN 68 N -2.44 2.12 -0.14 4.56 -0.21 -0.34 -0.46 119.66 122.74 3ksc s GLN 68 Ca 0.61 -0.92 -0.01 0.00 0.02 0.00 0.00 55.36 55.06 3ksc s GLN 68 Cb -0.38 -2.07 -0.01 0.00 1.00 0.00 0.00 33.01 31.55 3ksc s GLN 68 CO 0.48 0.56 -0.12 -2.00 -2.12 0.00 0.00 175.29 172.09 3ksc s GLU 69 N -0.67 3.37 -0.17 2.91 2.12 -0.23 -1.28 118.70 124.75 3ksc s GLU 69 Ca 0.10 -0.68 0.01 0.00 0.36 0.00 0.00 54.97 54.76 3ksc s GLU 69 Cb -0.10 -2.68 0.02 0.00 0.26 0.00 0.00 34.13 31.63 3ksc s GLU 69 CO -0.01 0.14 -0.18 0.42 -0.54 0.00 0.00 175.26 175.10 3ksc s ILE 70 N 0.54 1.85 -0.20 -3.70 1.01 -0.14 0.13 121.20 120.69 3ksc s ILE 70 Ca -0.08 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.67 3ksc s ILE 70 Cb -0.16 -1.70 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 3ksc s ILE 70 CO 0.04 0.51 0.11 0.12 0.00 0.00 0.00 174.94 175.71 3ksc s PHE 71 N 1.36 3.32 -0.93 3.97 5.36 0.59 -0.42 117.98 131.23 3ksc s PHE 71 Ca 0.05 0.18 -0.20 0.00 -0.96 0.00 0.00 56.93 56.00 3ksc s PHE 71 Cb -0.13 -2.16 0.11 0.00 -0.34 0.00 0.00 43.02 40.50 3ksc s PHE 71 CO -0.12 0.17 1.19 0.42 -1.46 0.00 0.00 175.22 175.42 3ksc s ILE 72 N 0.57 4.50 0.43 3.12 -1.09 -0.34 -0.30 121.20 128.09 3ksc s ILE 72 Ca 0.06 -1.29 0.27 0.00 -2.23 0.00 0.00 60.65 57.46 3ksc s ILE 72 Cb -0.12 -4.84 0.30 0.00 -1.58 0.00 0.00 42.46 36.21 3ksc s ILE 72 CO 0.00 -1.61 2.08 -0.61 -1.23 0.00 0.00 174.94 173.58 3ksc h GLN 73 N 9.12 0.00 -1.77 2.79 4.15 -1.10 0.12 115.11 128.43 3ksc h GLN 73 Ca 0.13 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.57 3ksc h GLN 73 Cb 1.02 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 28.48 3ksc h GLN 73 CO 1.19 0.11 0.34 -1.14 -1.93 0.00 0.00 178.83 177.40 3ksc s GLN 74 N -4.24 0.70 0.01 1.69 0.74 -0.93 -4.80 119.66 112.84 3ksc s GLN 74 Ca -0.03 0.56 0.00 0.00 0.05 0.00 0.00 55.36 55.94 3ksc s GLN 74 Cb 0.13 0.34 0.00 0.00 1.10 0.00 0.00 33.01 34.58 3ksc s GLN 74 CO 0.58 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.59 3ksc n GLY 75 N 1.84 -3.76 3.30 2.59 0.00 -1.26 -1.34 105.19 106.56 3ksc n GLY 75 Ca -0.14 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.69 3ksc n GLY 75 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ksc s ASN 76 N -0.94 -0.20 0.00 1.61 -0.87 -1.26 -1.33 114.94 111.95 3ksc s ASN 76 Ca 0.00 -0.28 0.00 0.00 -1.57 0.00 0.00 52.86 51.01 3ksc s ASN 76 Cb 0.00 0.44 0.00 0.00 -0.02 0.00 0.00 41.25 41.67 3ksc s ASN 76 CO 0.00 -0.79 0.00 0.61 -2.57 0.00 0.00 177.10 174.35 3ksc n GLY 77 N -0.01 -0.56 3.39 0.66 0.00 -1.03 -4.45 105.19 103.19 3ksc n GLY 77 Ca -0.17 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 3ksc n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ksc s TYR 78 N -3.50 2.07 0.02 1.61 2.02 -0.43 -1.43 117.35 117.71 3ksc s TYR 78 Ca 0.00 -0.41 -0.07 0.00 -0.37 0.00 0.00 57.07 56.21 3ksc s TYR 78 Cb 0.00 -0.99 -0.00 0.00 -0.40 0.00 0.00 41.96 40.57 3ksc s TYR 78 CO 0.00 0.48 0.14 -0.59 -1.57 0.00 0.00 175.55 174.01 3ksc s PHE 79 N -2.12 0.07 0.08 2.71 -0.71 -0.18 -0.27 117.98 117.56 3ksc s PHE 79 Ca 0.21 -0.23 0.07 0.00 -1.04 0.00 0.00 56.93 55.94 3ksc s PHE 79 Cb -0.06 -0.06 -0.03 0.00 -1.21 0.00 0.00 43.02 41.66 3ksc s PHE 79 CO 0.10 -0.33 -0.19 0.20 -1.34 0.00 0.00 175.22 173.65 3ksc s GLY 80 N -1.65 1.12 0.12 1.99 0.00 -0.49 -0.65 107.32 107.76 3ksc s GLY 80 Ca -0.11 -1.13 0.09 0.00 0.00 0.00 0.00 44.72 43.57 3ksc s GLY 80 CO -0.00 -1.11 -0.23 1.06 0.00 0.00 0.00 173.10 172.82 3ksc s MET 81 N -1.61 1.23 -0.27 2.90 -1.94 -1.20 -2.19 119.30 116.22 3ksc s MET 81 Ca 0.05 -1.25 -0.00 0.00 -1.71 0.00 0.00 55.69 52.79 3ksc s MET 81 Cb -0.09 -1.54 0.04 0.00 2.01 0.00 0.00 34.83 35.25 3ksc s MET 81 CO 0.03 0.36 -0.06 0.08 -0.01 0.00 0.00 175.02 175.42 3ksc s VAL 82 N -1.22 2.66 -0.24 -6.03 1.01 -0.86 -4.28 120.40 111.45 3ksc s VAL 82 Ca 0.10 -1.33 -0.10 0.00 0.00 0.00 0.00 61.98 60.64 3ksc s VAL 82 Cb -0.10 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 3ksc s VAL 82 CO 0.05 0.04 0.16 -0.36 0.00 0.00 0.00 175.10 174.99 3ksc s PHE 83 N 1.23 3.31 0.42 5.22 0.08 -1.26 -3.91 117.98 123.07 3ksc s PHE 83 Ca -0.04 0.20 -0.25 0.00 0.12 0.00 0.00 56.93 56.96 3ksc s PHE 83 Cb -0.19 -2.27 -0.10 0.00 -0.57 0.00 0.00 43.02 39.90 3ksc s PHE 83 CO -0.04 0.05 1.23 -2.30 -0.10 0.00 0.00 175.22 174.07 3ksc n PRO 84 N 4.30 1.83 -1.91 0.24 -0.02 -1.26 -2.44 135.00 135.75 3ksc n PRO 84 Ca -0.15 0.65 -0.19 0.00 -2.02 0.00 0.00 63.50 61.79 3ksc n PRO 84 Cb 0.52 -2.33 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 3ksc n PRO 84 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ksc n GLY 85 N 0.87 0.85 3.82 -1.23 0.00 -1.26 -4.96 105.19 103.29 3ksc n GLY 85 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3ksc n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ksc n PRO 87 N 2.01 1.61 -1.62 0.00 -0.02 -1.26 -5.00 135.00 130.72 3ksc n PRO 87 Ca -0.19 0.57 -0.02 0.00 -2.02 0.00 0.00 63.50 61.83 3ksc n PRO 87 Cb 0.55 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 3ksc n PRO 87 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3ksc n GLU 88 N 0.97 1.33 0.00 -0.52 1.02 -1.26 -4.85 120.64 117.33 3ksc n GLU 88 Ca 0.09 -0.33 -0.00 0.00 -0.02 0.00 0.00 57.16 56.90 3ksc n GLU 88 Cb 0.32 0.02 -0.00 0.00 -0.02 0.00 0.00 31.44 31.76 3ksc n GLU 88 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3ksc n THR 89 N -0.73 0.01 0.00 2.62 -2.24 0.15 -4.97 114.28 109.13 3ksc n THR 89 Ca 0.00 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3ksc n THR 89 Cb 0.06 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.21 3ksc n THR 89 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3ksc n ASP 106 N -2.51 0.00 -4.84 3.42 2.03 -1.26 -3.69 116.55 109.70 3ksc n ASP 106 Ca -0.00 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 54.94 3ksc n ASP 106 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.34 3ksc n ASP 106 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ksc s ARG 107 N 0.00 3.60 0.20 -0.67 3.03 -1.26 -5.09 118.95 118.75 3ksc s ARG 107 Ca 0.00 -0.16 -0.23 0.00 2.03 0.00 0.00 55.73 57.37 3ksc s ARG 107 Cb 0.00 -3.23 0.06 0.00 -1.03 0.00 0.00 34.95 30.75 3ksc s ARG 107 CO 0.00 0.67 0.92 -3.38 -1.13 0.00 0.00 175.30 172.38 3ksc s HIS 108 N -0.71 -0.09 0.00 5.89 -3.43 -1.24 -5.16 115.29 110.54 3ksc s HIS 108 Ca 0.13 -0.29 0.00 0.00 -0.80 0.00 0.00 55.06 54.10 3ksc s HIS 108 Cb -0.12 0.68 0.00 0.00 -1.43 0.00 0.00 32.58 31.71 3ksc s HIS 108 CO 0.03 -0.97 0.00 1.04 -2.00 0.00 0.00 174.74 172.84 3ksc n GLN 109 N -0.51 2.63 -1.57 -0.38 6.02 -1.26 -0.67 117.38 121.64 3ksc n GLN 109 Ca -0.05 0.00 -0.46 0.00 -0.01 0.00 0.00 57.00 56.48 3ksc n GLN 109 Cb 0.60 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.82 3ksc n GLN 109 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 3ksc n LYS 110 N -0.21 1.81 -4.00 -1.09 2.85 -1.26 -4.87 118.16 111.39 3ksc n LYS 110 Ca 0.00 0.53 -0.35 0.00 -1.05 0.00 0.00 58.31 57.44 3ksc n LYS 110 Cb 0.00 -2.96 -0.11 0.00 -0.65 0.00 0.00 35.03 31.31 3ksc n LYS 110 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3ksc s VAL 111 N 7.38 4.48 0.22 0.58 0.11 -1.26 -3.26 120.40 128.66 3ksc s VAL 111 Ca 1.02 -0.13 0.11 0.00 -2.93 0.00 0.00 61.98 60.04 3ksc s VAL 111 Cb -0.52 -3.04 -0.05 0.00 -1.53 0.00 0.00 36.38 31.25 3ksc s VAL 111 CO 0.41 0.42 -0.20 0.20 -3.33 0.00 0.00 175.10 172.60 3ksc s ASN 112 N 0.79 3.23 -0.06 3.54 -0.87 0.18 -4.97 114.94 116.78 3ksc s ASN 112 Ca 0.03 -0.95 -0.16 0.00 -1.57 0.00 0.00 52.86 50.21 3ksc s ASN 112 Cb -0.14 -0.24 -0.05 0.00 -0.02 0.00 0.00 41.25 40.81 3ksc s ASN 112 CO 0.02 0.02 0.42 -0.13 -2.57 0.00 0.00 177.10 174.86 3ksc s ARG 113 N -3.16 4.12 0.24 -0.60 0.52 -1.26 -1.02 118.95 117.79 3ksc s ARG 113 Ca 0.24 0.39 0.09 0.00 -0.52 0.00 0.00 55.73 55.93 3ksc s ARG 113 Cb -0.05 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 32.05 3ksc s ARG 113 CO 0.11 0.44 0.01 -0.59 0.02 0.00 0.00 175.30 175.29 3ksc s PHE 114 N -0.28 2.76 0.09 -0.53 -0.12 -0.51 -4.93 117.98 114.46 3ksc s PHE 114 Ca 0.24 -0.19 -0.04 0.00 -0.05 0.00 0.00 56.93 56.88 3ksc s PHE 114 Cb -0.16 -1.26 -0.02 0.00 -0.63 0.00 0.00 43.02 40.95 3ksc s PHE 114 CO 0.11 0.58 0.09 -0.98 -0.05 0.00 0.00 175.22 174.97 3ksc s ARG 115 N -3.47 0.80 0.06 1.99 1.70 -1.26 -2.47 118.95 116.30 3ksc s ARG 115 Ca 0.30 -1.17 -0.37 0.00 -0.47 0.00 0.00 55.73 54.01 3ksc s ARG 115 Cb -0.07 0.28 -0.18 0.00 -0.57 0.00 0.00 34.95 34.40 3ksc s ARG 115 CO 0.20 -0.22 1.17 -1.91 -1.08 0.00 0.00 175.30 173.46 3ksc n GLU 116 N -0.02 0.60 -0.29 3.89 2.13 -0.45 -1.17 120.64 125.34 3ksc n GLU 116 Ca -0.12 0.22 0.00 0.00 0.66 0.00 0.00 57.16 57.92 3ksc n GLU 116 Cb 0.62 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 30.57 3ksc n GLU 116 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ksc n GLY 117 N 2.01 1.08 3.77 8.31 0.00 0.42 -4.64 105.19 116.13 3ksc n GLY 117 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3ksc n GLY 117 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ksc s ASP 118 N -3.00 6.68 -0.19 1.61 1.11 -0.32 -1.11 116.67 121.45 3ksc s ASP 118 Ca 0.00 2.38 -0.08 0.00 0.18 0.00 0.00 52.55 55.03 3ksc s ASP 118 Cb 0.00 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.33 3ksc s ASP 118 CO 0.00 -0.57 0.07 -0.63 1.18 0.00 0.00 175.17 175.22 3ksc s ILE 119 N -1.34 4.83 -0.14 0.77 -1.09 -0.12 -1.20 121.20 122.92 3ksc s ILE 119 Ca 0.54 -0.02 -0.01 0.00 -2.23 0.00 0.00 60.65 58.93 3ksc s ILE 119 Cb -0.32 -3.19 -0.02 0.00 -1.58 0.00 0.00 42.46 37.36 3ksc s ILE 119 CO 0.41 0.45 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.83 3ksc s ILE 120 N 0.44 3.21 -0.27 2.92 1.01 0.44 -1.57 121.20 127.37 3ksc s ILE 120 Ca 0.04 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 59.97 3ksc s ILE 120 Cb -0.12 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 3ksc s ILE 120 CO 0.00 0.51 0.20 0.00 0.00 0.00 0.00 174.94 175.66 3ksc s ALA 121 N 0.44 3.55 -0.32 9.38 0.00 -0.19 -0.96 121.76 133.66 3ksc s ALA 121 Ca -0.08 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 3ksc s ALA 121 Cb -0.15 -2.47 0.07 0.00 0.00 0.00 0.00 23.12 20.56 3ksc s ALA 121 CO 0.04 -0.48 0.03 0.08 0.00 0.00 0.00 175.76 175.43 3ksc s VAL 122 N 1.63 2.87 0.77 0.00 1.01 -0.40 -4.89 120.40 121.39 3ksc s VAL 122 Ca 0.08 -1.63 -0.12 0.00 0.00 0.00 0.00 61.98 60.30 3ksc s VAL 122 Cb -0.15 -2.76 0.06 0.00 0.00 0.00 0.00 36.38 33.53 3ksc s VAL 122 CO 0.10 -0.25 1.13 -2.84 0.00 0.00 0.00 175.10 173.24 3ksc s PRO 123 N 1.18 2.07 0.01 2.72 0.02 -1.26 -1.20 135.00 138.53 3ksc s PRO 123 Ca -0.02 1.43 -0.38 0.00 0.02 0.00 0.00 61.00 62.06 3ksc s PRO 123 Cb -0.20 -1.86 -0.17 0.00 0.02 0.00 0.00 34.50 32.29 3ksc s PRO 123 CO -0.03 -1.82 1.34 2.41 -0.33 0.00 0.00 177.00 178.57 3ksc n THR 124 N -3.26 0.04 -0.81 0.99 -1.04 -1.26 -2.18 114.28 106.75 3ksc n THR 124 Ca 0.11 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 3ksc n THR 124 Cb 0.52 -0.70 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 3ksc n THR 124 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ksc n GLY 125 N 2.57 0.86 3.70 3.41 0.00 0.10 -4.97 105.19 110.85 3ksc n GLY 125 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3ksc n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ksc s ILE 126 N -3.18 4.50 0.28 -0.61 -1.09 -0.93 -4.74 121.20 115.43 3ksc s ILE 126 Ca 0.00 1.80 -0.29 0.00 -2.23 0.00 0.00 60.65 59.92 3ksc s ILE 126 Cb 0.00 -4.15 -0.10 0.00 -1.58 0.00 0.00 42.46 36.63 3ksc s ILE 126 CO 0.00 0.07 1.36 -0.69 -1.23 0.00 0.00 174.94 174.45 3ksc s VAL 127 N 1.60 2.76 0.01 2.92 1.01 -1.25 -4.50 120.40 122.95 3ksc s VAL 127 Ca 0.54 0.69 0.01 0.00 0.00 0.00 0.00 61.98 63.21 3ksc s VAL 127 Cb -0.23 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 3ksc s VAL 127 CO 0.24 0.13 -0.03 0.12 0.00 0.00 0.00 175.10 175.57 3ksc s PHE 128 N -0.50 0.23 -0.03 5.22 5.36 0.16 -2.02 117.98 126.40 3ksc s PHE 128 Ca 0.54 -0.15 -0.10 0.00 -0.96 0.00 0.00 56.93 56.26 3ksc s PHE 128 Cb -0.40 -0.15 0.02 0.00 -0.34 0.00 0.00 43.02 42.14 3ksc s PHE 128 CO 0.47 -0.04 0.23 1.67 -1.46 0.00 0.00 175.22 176.09 3ksc s TRP 129 N -0.37 -0.13 0.07 10.12 1.48 -0.93 -1.84 118.94 127.34 3ksc s TRP 129 Ca -0.03 0.25 0.08 0.00 -1.06 0.00 0.00 56.10 55.34 3ksc s TRP 129 Cb -0.03 0.04 -0.03 0.00 -1.16 0.00 0.00 33.47 32.29 3ksc s TRP 129 CO -0.00 -0.27 -0.23 -1.64 -4.06 0.00 0.00 176.95 170.75 3ksc s MET 130 N -0.90 1.42 -0.15 3.25 -1.94 -1.01 -1.40 119.30 118.57 3ksc s MET 130 Ca -0.10 -1.07 -0.02 0.00 -1.71 0.00 0.00 55.69 52.79 3ksc s MET 130 Cb -0.05 -1.63 0.04 0.00 2.01 0.00 0.00 34.83 35.21 3ksc s MET 130 CO 0.02 0.41 0.00 -0.47 -0.01 0.00 0.00 175.02 174.97 3ksc s TYR 131 N -0.91 1.09 -0.73 -0.03 5.04 0.63 0.17 117.35 122.61 3ksc s TYR 131 Ca 0.09 -0.70 -0.22 0.00 -2.44 0.00 0.00 57.07 53.80 3ksc s TYR 131 Cb -0.09 -1.03 0.08 0.00 0.35 0.00 0.00 41.96 41.26 3ksc s TYR 131 CO 0.03 -0.52 1.02 1.21 -1.34 0.00 0.00 175.55 175.95 3ksc s ASN 132 N 1.84 6.28 0.00 4.32 2.47 -0.08 -1.31 114.94 128.45 3ksc s ASN 132 Ca 0.01 -1.21 0.20 0.00 0.42 0.00 0.00 52.86 52.29 3ksc s ASN 132 Cb -0.15 -2.42 0.73 0.00 -1.45 0.00 0.00 41.25 37.96 3ksc s ASN 132 CO -0.07 -1.38 1.53 -0.90 -3.72 0.00 0.00 177.10 172.56 3ksc n ASP 133 N 7.57 1.56 -2.55 -4.21 3.85 -1.26 -1.04 116.55 120.47 3ksc n ASP 133 Ca 0.03 -1.71 -0.05 0.00 -0.71 0.00 0.00 54.79 52.35 3ksc n ASP 133 Cb 0.46 -0.11 -0.00 0.00 -1.35 0.00 0.00 41.12 40.13 3ksc n ASP 133 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ksc n GLN 134 N 0.26 1.36 -0.00 0.11 6.02 -1.26 -4.76 117.38 119.10 3ksc n GLN 134 Ca 0.16 -0.67 0.10 0.00 -0.01 0.00 0.00 57.00 56.58 3ksc n GLN 134 Cb 0.31 0.08 -0.14 0.00 1.02 0.00 0.00 30.24 31.51 3ksc n GLN 134 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3ksc n ASP 135 N -1.92 0.60 -4.84 1.08 8.00 -1.26 -3.50 116.55 114.71 3ksc n ASP 135 Ca -0.01 -0.58 -0.38 0.00 0.71 0.00 0.00 54.79 54.54 3ksc n ASP 135 Cb 0.12 1.41 -0.06 0.00 -0.02 0.00 0.00 41.12 42.57 3ksc n ASP 135 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ksc s THR 136 N -3.19 5.13 0.49 -3.53 2.01 -1.26 -4.68 115.64 110.61 3ksc s THR 136 Ca 0.01 0.71 -0.22 0.00 0.31 0.00 0.00 61.69 62.50 3ksc s THR 136 Cb 0.15 -3.65 -0.07 0.00 0.01 0.00 0.00 72.50 68.94 3ksc s THR 136 CO 0.87 0.58 1.22 -2.84 -0.69 0.00 0.00 174.62 173.76 3ksc s PRO 137 N -1.01 3.56 -0.15 4.92 0.02 -1.26 -4.72 135.00 136.37 3ksc s PRO 137 Ca 0.22 1.89 -0.18 0.00 0.02 0.00 0.00 61.00 62.96 3ksc s PRO 137 Cb -0.16 -2.34 -0.04 0.00 0.02 0.00 0.00 34.50 31.98 3ksc s PRO 137 CO 0.11 -0.75 0.46 0.08 -0.33 0.00 0.00 177.00 176.57 3ksc s VAL 138 N -1.49 5.19 -0.29 3.83 1.01 -0.08 -4.11 120.40 124.46 3ksc s VAL 138 Ca 0.66 0.88 -0.01 0.00 0.00 0.00 0.00 61.98 63.51 3ksc s VAL 138 Cb -0.32 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.32 3ksc s VAL 138 CO 0.38 0.30 -0.02 -0.63 0.00 0.00 0.00 175.10 175.12 3ksc s ILE 139 N 0.87 2.90 -0.16 2.22 1.01 -0.45 -1.04 121.20 126.55 3ksc s ILE 139 Ca 0.24 -1.34 -0.02 0.00 0.00 0.00 0.00 60.65 59.53 3ksc s ILE 139 Cb -0.15 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.67 3ksc s ILE 139 CO 0.09 -0.04 -0.08 0.00 0.00 0.00 0.00 174.94 174.91 3ksc s ALA 140 N 1.25 2.80 -0.20 9.38 0.00 -0.29 -0.47 121.76 134.23 3ksc s ALA 140 Ca -0.05 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 3ksc s ALA 140 Cb -0.19 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.49 3ksc s ALA 140 CO -0.02 0.09 -0.10 0.54 0.00 0.00 0.00 175.76 176.27 3ksc s VAL 141 N 0.59 2.91 -0.06 0.00 0.11 0.59 -0.35 120.40 124.19 3ksc s VAL 141 Ca -0.05 -0.65 0.03 0.00 -2.93 0.00 0.00 61.98 58.38 3ksc s VAL 141 Cb -0.15 -2.29 -0.02 0.00 -1.53 0.00 0.00 36.38 32.38 3ksc s VAL 141 CO 0.03 0.47 -0.14 -0.94 -3.33 0.00 0.00 175.10 171.19 3ksc s SER 142 N 1.38 4.04 -0.27 3.54 1.04 0.22 -0.30 113.70 123.35 3ksc s SER 142 Ca 0.05 -0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.15 3ksc s SER 142 Cb -0.14 -0.96 -0.05 0.00 0.10 0.00 0.00 66.02 64.97 3ksc s SER 142 CO -0.06 0.32 0.22 -0.22 0.98 0.00 0.00 173.24 174.48 3ksc s LEU 143 N -0.59 4.04 -0.29 2.42 0.20 0.12 -1.50 118.68 123.09 3ksc s LEU 143 Ca 0.08 0.08 -0.13 0.00 0.69 0.00 0.00 54.13 54.85 3ksc s LEU 143 Cb -0.11 -2.18 -0.04 0.00 -0.43 0.00 0.00 46.19 43.43 3ksc s LEU 143 CO 0.01 -0.05 0.29 -0.89 -0.29 0.00 0.00 176.35 175.42 3ksc s THR 144 N 1.68 5.24 -1.24 3.68 2.01 0.24 -1.07 115.64 126.17 3ksc s THR 144 Ca 0.09 0.24 -0.12 0.00 0.31 0.00 0.00 61.69 62.21 3ksc s THR 144 Cb -0.15 -3.66 0.17 0.00 0.01 0.00 0.00 72.50 68.86 3ksc s THR 144 CO 0.10 0.13 1.59 -0.67 -0.69 0.00 0.00 174.62 175.07 3ksc n ASP 145 N 5.22 5.18 -0.20 3.53 2.03 0.40 -1.18 116.55 131.53 3ksc n ASP 145 Ca -0.11 -3.02 0.19 0.00 0.52 0.00 0.00 54.79 52.36 3ksc n ASP 145 Cb 0.51 -1.54 0.54 0.00 -0.72 0.00 0.00 41.12 39.90 3ksc n ASP 145 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3ksc h ILE 146 N 4.35 0.71 0.00 5.18 2.04 -1.82 -2.24 117.51 125.73 3ksc h ILE 146 Ca 0.35 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 66.08 3ksc h ILE 146 Cb 0.79 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3ksc h ILE 146 CO 1.37 0.06 0.00 0.08 0.00 0.00 0.00 178.15 179.67 3ksc h ARG 147 N 0.35 0.00 -6.25 2.37 0.11 -1.49 -3.44 114.38 106.03 3ksc h ARG 147 Ca 0.42 0.00 -0.63 0.00 0.10 0.00 0.00 59.98 59.87 3ksc h ARG 147 Cb 1.10 0.00 0.11 0.00 1.11 0.00 0.00 29.97 32.29 3ksc h ARG 147 CO -0.13 0.00 -0.22 0.45 0.10 0.00 0.00 179.97 180.17 3ksc n SER 148 N -2.62 -0.05 0.13 0.08 2.88 -0.84 -4.81 113.62 108.38 3ksc n SER 148 Ca 0.04 1.13 0.11 0.00 -1.33 0.00 0.00 58.87 58.82 3ksc n SER 148 Cb 0.41 -1.12 0.50 0.00 -0.75 0.00 0.00 64.21 63.25 3ksc n SER 148 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3ksc n SER 149 N 1.58 0.61 0.13 -3.46 3.41 -1.26 -1.86 113.62 112.78 3ksc n SER 149 Ca 0.13 0.68 0.13 0.00 -0.26 0.00 0.00 58.87 59.56 3ksc n SER 149 Cb 0.30 -0.80 0.43 0.00 -0.26 0.00 0.00 64.21 63.88 3ksc n SER 149 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3ksc h ASN 150 N 0.00 0.00 -3.26 4.04 2.35 -1.93 -3.41 115.58 113.36 3ksc h ASN 150 Ca 0.00 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.14 3ksc h ASN 150 Cb 0.26 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.51 3ksc h ASN 150 CO 0.00 0.00 0.56 0.21 -1.65 0.00 0.00 177.43 176.55 3ksc s ASN 151 N -4.63 6.36 0.00 5.81 2.47 -0.77 -4.84 114.94 119.33 3ksc s ASN 151 Ca 0.08 -0.30 0.22 0.00 0.42 0.00 0.00 52.86 53.27 3ksc s ASN 151 Cb 0.11 -2.43 0.54 0.00 -1.45 0.00 0.00 41.25 38.01 3ksc s ASN 151 CO 0.53 -1.20 1.45 0.00 -3.72 0.00 0.00 177.10 174.16 3ksc n GLN 152 N 7.40 2.19 0.00 0.43 1.13 -1.26 -4.85 117.38 122.42 3ksc n GLN 152 Ca 0.02 -1.80 0.00 0.00 -1.94 0.00 0.00 57.00 53.28 3ksc n GLN 152 Cb 0.48 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 29.36 3ksc n GLN 152 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3ksc n LEU 153 N 1.02 0.00 0.00 1.08 4.77 -1.26 -5.14 117.00 117.47 3ksc n LEU 153 Ca 0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 3ksc n LEU 153 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3ksc n LEU 153 CO 0.15 0.00 0.00 -0.90 -1.33 0.00 0.00 177.39 175.31 3ksc n ASP 154 N 0.00 0.43 0.00 -1.43 5.68 -1.26 -5.01 116.55 114.96 3ksc n ASP 154 Ca 0.00 -0.06 0.15 0.00 -0.50 0.00 0.00 54.79 54.38 3ksc n ASP 154 Cb 0.00 0.00 0.85 0.00 -1.14 0.00 0.00 41.12 40.83 3ksc n ASP 154 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ksc n GLN 155 N -0.04 0.74 -3.09 0.11 6.02 -1.26 -4.82 117.38 115.04 3ksc n GLN 155 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.59 3ksc n GLN 155 Cb 0.00 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.70 3ksc n GLN 155 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3ksc s MET 156 N -2.23 4.16 0.35 -1.09 -1.94 -1.26 -4.97 119.30 112.31 3ksc s MET 156 Ca 0.39 0.61 -0.29 0.00 -1.71 0.00 0.00 55.69 54.69 3ksc s MET 156 Cb 0.21 -3.62 -0.11 0.00 2.01 0.00 0.00 34.83 33.31 3ksc s MET 156 CO 0.39 -0.35 1.54 -0.35 -0.01 0.00 0.00 175.02 176.24 3ksc n PRO 157 N 5.48 2.71 -4.37 2.03 -0.04 -1.26 -5.01 135.00 134.54 3ksc n PRO 157 Ca -0.00 0.96 -0.19 0.00 -0.04 0.00 0.00 63.50 64.22 3ksc n PRO 157 Cb 0.49 -2.71 -0.14 0.00 -0.04 0.00 0.00 33.50 31.10 3ksc n PRO 157 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3ksc s ARG 158 N -1.52 0.89 -0.05 0.54 0.52 -1.26 -4.80 118.95 113.26 3ksc s ARG 158 Ca 0.57 -0.65 0.03 0.00 -0.52 0.00 0.00 55.73 55.16 3ksc s ARG 158 Cb -0.48 -0.87 0.00 0.00 0.52 0.00 0.00 34.95 34.13 3ksc s ARG 158 CO 0.58 0.22 -0.14 1.03 0.02 0.00 0.00 175.30 177.01 3ksc s ARG 159 N -0.90 1.67 -0.21 3.54 0.52 -1.26 -3.94 118.95 118.36 3ksc s ARG 159 Ca 0.02 -0.49 -0.05 0.00 -0.52 0.00 0.00 55.73 54.68 3ksc s ARG 159 Cb -0.07 -1.42 -0.02 0.00 0.52 0.00 0.00 34.95 33.96 3ksc s ARG 159 CO 0.01 0.13 0.01 -0.06 0.02 0.00 0.00 175.30 175.41 3ksc s PHE 160 N 0.32 3.04 -0.15 -0.53 0.40 0.23 -4.79 117.98 116.49 3ksc s PHE 160 Ca -0.09 -0.49 -0.05 0.00 -0.60 0.00 0.00 56.93 55.70 3ksc s PHE 160 Cb -0.13 -2.11 -0.03 0.00 0.51 0.00 0.00 43.02 41.26 3ksc s PHE 160 CO 0.03 -0.28 0.01 0.71 0.70 0.00 0.00 175.22 176.39 3ksc s TYR 161 N 1.12 3.14 0.17 0.36 2.02 -1.26 -1.07 117.35 121.83 3ksc s TYR 161 Ca 0.03 -0.06 -0.09 0.00 -0.37 0.00 0.00 57.07 56.57 3ksc s TYR 161 Cb -0.14 -1.98 0.04 0.00 -0.40 0.00 0.00 41.96 39.47 3ksc s TYR 161 CO 0.01 0.13 1.57 -0.07 -1.57 0.00 0.00 175.55 175.63 3ksc h LEU 162 N 6.43 1.02 -9.76 -1.29 3.38 -1.88 -2.54 115.31 110.66 3ksc h LEU 162 Ca -0.37 -0.37 -0.63 0.00 0.09 0.00 0.00 57.88 56.61 3ksc h LEU 162 Cb 1.18 -0.28 -0.13 0.00 0.09 0.00 0.00 40.66 41.52 3ksc h LEU 162 CO 0.65 1.16 -0.50 0.00 0.09 0.00 0.00 178.44 179.83 3ksc s ALA 163 N -4.73 3.57 0.00 1.53 0.00 -1.26 -4.39 121.76 116.48 3ksc s ALA 163 Ca -0.11 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.14 3ksc s ALA 163 Cb 0.13 0.41 0.00 0.00 0.00 0.00 0.00 23.12 23.65 3ksc s ALA 163 CO 0.87 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.85 3ksc n GLY 164 N -1.11 -2.69 2.19 0.00 0.00 -1.26 -4.64 105.19 97.68 3ksc n GLY 164 Ca -0.13 -1.72 -0.20 0.00 0.00 0.00 0.00 46.02 43.97 3ksc n GLY 164 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ksc n ASN 165 N -0.21 0.67 -3.90 1.61 5.15 -1.26 -4.04 115.26 113.27 3ksc n ASN 165 Ca 0.00 -2.92 -0.10 0.00 -0.60 0.00 0.00 54.58 50.96 3ksc n ASN 165 Cb 0.00 -0.63 -0.09 0.00 -0.53 0.00 0.00 39.78 38.53 3ksc n ASN 165 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 3ksc s HIS 166 N -2.08 0.15 0.26 1.20 -3.43 -1.26 -3.48 115.29 106.65 3ksc s HIS 166 Ca 0.39 -0.42 -0.29 0.00 -0.80 0.00 0.00 55.06 53.93 3ksc s HIS 166 Cb 0.30 -0.11 -0.09 0.00 -1.43 0.00 0.00 32.58 31.25 3ksc s HIS 166 CO -0.09 -0.37 1.13 -1.21 -2.00 0.00 0.00 174.74 172.20 3ksc s GLU 167 N -2.46 4.60 0.61 -0.38 2.02 -1.26 -4.74 118.70 117.08 3ksc s GLU 167 Ca -0.06 1.84 -0.17 0.00 0.02 0.00 0.00 54.97 56.60 3ksc s GLU 167 Cb -0.02 -3.19 -0.02 0.00 0.10 0.00 0.00 34.13 30.99 3ksc s GLU 167 CO -0.04 0.13 1.13 -1.14 0.02 0.00 0.00 175.26 175.36 3ksc s GLN 168 N -1.21 2.99 0.57 1.61 -0.44 -1.26 -4.93 119.66 116.98 3ksc s GLN 168 Ca 0.46 1.52 0.26 0.00 -2.50 0.00 0.00 55.36 55.10 3ksc s GLN 168 Cb -0.32 -1.96 1.55 0.00 -1.64 0.00 0.00 33.01 30.63 3ksc s GLN 168 CO 0.41 -1.12 2.10 0.93 0.50 0.00 0.00 175.29 178.11 3ksc h GLU 169 N 0.51 0.00 -0.40 1.67 3.07 -1.96 -2.43 114.58 115.05 3ksc h GLU 169 Ca -0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 3ksc h GLU 169 Cb 1.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 3ksc h GLU 169 CO 0.55 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 179.35 3ksc n PHE 170 N -4.05 0.51 -0.28 4.33 3.72 -1.26 -4.43 117.46 116.01 3ksc n PHE 170 Ca 0.02 -0.26 -0.05 0.00 -0.05 0.00 0.00 57.45 57.11 3ksc n PHE 170 Cb 0.32 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.92 3ksc n PHE 170 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3ksc h LEU 171 N 4.28 0.97 -1.06 4.37 7.12 -1.76 -2.76 115.31 126.48 3ksc h LEU 171 Ca 0.00 -0.11 0.00 0.00 0.13 0.00 0.00 57.88 57.90 3ksc h LEU 171 Cb 0.95 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 40.83 3ksc h LEU 171 CO 0.00 0.80 0.00 0.00 -0.13 0.00 0.00 178.44 179.11 3ksc n GLN 172 N -4.42 0.15 0.06 1.25 10.64 -1.26 -1.66 117.38 122.14 3ksc n GLN 172 Ca 0.07 0.54 0.12 0.00 -1.83 0.00 0.00 57.00 55.90 3ksc n GLN 172 Cb 0.10 -1.89 0.13 0.00 -0.86 0.00 0.00 30.24 27.72 3ksc n GLN 172 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.06 177.11 3ksc h TYR 173 N 0.00 0.00 -3.41 2.61 0.05 -1.82 -3.45 116.97 110.95 3ksc h TYR 173 Ca 0.00 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.26 3ksc h TYR 173 Cb 0.14 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.90 3ksc h TYR 173 CO 0.00 0.00 0.58 -0.65 -1.05 0.00 0.00 178.16 177.04 3ksc s GLN 174 N -3.20 4.46 -0.96 4.88 -0.21 -0.66 -5.00 119.66 118.95 3ksc s GLN 174 Ca 0.05 1.91 -0.02 0.00 0.02 0.00 0.00 55.36 57.32 3ksc s GLN 174 Cb 0.13 -3.24 0.30 0.00 1.00 0.00 0.00 33.01 31.20 3ksc s GLN 174 CO 0.74 -0.15 1.99 1.58 -2.12 0.00 0.00 175.29 177.33 3ksc n HIS 175 N 2.74 2.76 0.00 0.91 -0.00 -1.26 -5.08 115.22 115.29 3ksc n HIS 175 Ca 0.05 -2.47 0.00 0.00 0.46 0.00 0.00 57.72 55.76 3ksc n HIS 175 Cb 0.44 -1.26 0.00 0.00 -0.12 0.00 0.00 29.99 29.06 3ksc n HIS 175 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 3ksc n GLU 186 N -0.02 0.00 -0.46 1.57 0.28 -1.26 -5.20 120.64 115.54 3ksc n GLU 186 Ca 0.51 0.00 -0.22 0.00 -0.16 0.00 0.00 57.16 57.28 3ksc n GLU 186 Cb 0.26 0.00 0.19 0.00 1.43 0.00 0.00 31.44 33.32 3ksc n GLU 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3ksc n GLY 187 N 0.00 -2.81 0.00 -1.84 0.00 -1.26 -5.01 105.19 94.27 3ksc n GLY 187 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 3ksc n GLY 187 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ksc n ASN 188 N -2.51 0.35 -4.98 1.61 3.02 -1.26 -4.89 115.26 106.60 3ksc n ASN 188 Ca 0.07 -0.66 -0.20 0.00 -0.03 0.00 0.00 54.58 53.76 3ksc n ASN 188 Cb 0.44 0.46 0.03 0.00 -0.61 0.00 0.00 39.78 40.10 3ksc n ASN 188 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3ksc s ASN 189 N -0.46 5.34 0.13 6.41 4.22 -1.26 -4.78 114.94 124.54 3ksc s ASN 189 Ca 0.00 -0.12 -0.19 0.00 -2.14 0.00 0.00 52.86 50.41 3ksc s ASN 189 Cb 0.00 -0.80 -0.01 0.00 1.28 0.00 0.00 41.25 41.72 3ksc s ASN 189 CO 0.00 -1.07 1.74 0.16 -2.04 0.00 0.00 177.10 175.89 3ksc h ILE 190 N 0.19 0.91 -0.49 0.54 3.07 -1.66 -2.42 117.51 117.65 3ksc h ILE 190 Ca -0.41 -0.05 0.11 0.00 1.55 0.00 0.00 64.86 66.05 3ksc h ILE 190 Cb 1.29 0.73 -0.02 0.00 -0.27 0.00 0.00 36.82 38.55 3ksc h ILE 190 CO 0.50 0.03 0.34 -0.26 -1.05 0.00 0.00 178.15 177.71 3ksc h PHE 191 N 0.16 0.17 0.00 0.16 0.04 -1.85 -1.31 116.94 114.30 3ksc h PHE 191 Ca 0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.88 3ksc h PHE 191 Cb 0.10 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.19 3ksc h PHE 191 CO -0.14 0.08 0.00 -1.13 -0.60 0.00 0.00 178.31 176.52 3ksc n SER 192 N -4.44 0.11 0.08 2.17 3.41 -0.91 -1.88 113.62 112.16 3ksc n SER 192 Ca 0.08 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.34 3ksc n SER 192 Cb 0.45 -0.55 0.24 0.00 -0.26 0.00 0.00 64.21 64.09 3ksc n SER 192 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3ksc h GLY 193 N 3.15 0.00 -3.67 5.00 0.00 -1.31 -3.43 103.07 102.81 3ksc h GLY 193 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 3ksc h GLY 193 CO 0.00 0.00 -0.15 -1.36 0.00 0.00 0.00 176.54 175.03 3ksc s PHE 194 N -3.15 3.44 0.45 5.60 0.08 -0.78 -5.06 117.98 118.54 3ksc s PHE 194 Ca 0.07 0.79 -0.25 0.00 0.12 0.00 0.00 56.93 57.66 3ksc s PHE 194 Cb 0.13 -2.19 -0.08 0.00 -0.57 0.00 0.00 43.02 40.30 3ksc s PHE 194 CO 0.68 0.29 1.40 0.15 -0.10 0.00 0.00 175.22 177.64 3ksc s LYS 195 N -2.88 3.72 0.55 0.44 1.02 -1.26 -4.90 119.74 116.42 3ksc s LYS 195 Ca 0.46 2.36 0.23 0.00 0.02 0.00 0.00 55.97 59.04 3ksc s LYS 195 Cb -0.11 -2.66 1.44 0.00 -0.52 0.00 0.00 37.83 35.98 3ksc s LYS 195 CO 0.23 -0.77 2.09 -0.09 -0.92 0.00 0.00 175.35 175.89 3ksc h ARG 196 N 2.36 0.00 0.11 1.68 2.43 -1.97 -2.28 114.38 116.72 3ksc h ARG 196 Ca -0.51 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.40 3ksc h ARG 196 Cb 1.26 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.82 3ksc h ARG 196 CO 0.61 0.00 -1.20 -0.44 -1.51 0.00 0.00 179.97 177.43 3ksc h ASP 197 N 0.00 0.47 -0.50 -3.80 3.32 -1.99 -2.31 116.42 111.61 3ksc h ASP 197 Ca 0.11 -0.48 0.09 0.00 0.02 0.00 0.00 57.03 56.77 3ksc h ASP 197 Cb 0.46 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 39.79 3ksc h ASP 197 CO -0.00 1.35 0.06 -0.26 -1.72 0.00 0.00 179.24 178.67 3ksc h PHE 198 N 0.11 0.09 -0.16 4.55 -1.00 -1.79 0.37 116.94 119.11 3ksc h PHE 198 Ca -0.13 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 60.65 3ksc h PHE 198 Cb 1.91 0.04 -0.01 0.00 3.61 0.00 0.00 35.95 41.50 3ksc h PHE 198 CO 0.07 -0.05 -0.01 -0.07 -1.61 0.00 0.00 178.31 176.64 3ksc h LEU 199 N 0.19 0.28 -0.39 1.54 4.07 -1.55 0.38 115.31 119.83 3ksc h LEU 199 Ca 0.25 -0.33 0.07 0.00 0.08 0.00 0.00 57.88 57.96 3ksc h LEU 199 Cb 0.36 -0.08 -0.07 0.00 1.08 0.00 0.00 40.66 41.95 3ksc h LEU 199 CO -0.36 0.54 -0.05 -0.33 -1.08 0.00 0.00 178.44 177.16 3ksc h GLU 200 N 0.02 0.04 -0.37 1.13 5.08 -1.11 0.42 114.58 119.79 3ksc h GLU 200 Ca 0.04 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3ksc h GLU 200 Cb 0.40 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3ksc h GLU 200 CO 0.01 0.03 -0.22 -0.44 -1.00 0.00 0.00 179.01 177.38 3ksc h ASP 201 N 0.05 0.83 -0.62 1.42 3.32 -0.88 0.74 116.42 121.28 3ksc h ASP 201 Ca 0.19 -0.42 -0.04 0.00 0.02 0.00 0.00 57.03 56.77 3ksc h ASP 201 Cb 0.28 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3ksc h ASP 201 CO -0.36 1.08 0.23 0.00 -1.72 0.00 0.00 179.24 178.47 3ksc h ALA 202 N 0.78 1.17 0.00 3.45 0.00 0.29 -3.17 119.26 121.79 3ksc h ALA 202 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ksc h ALA 202 Cb 0.79 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3ksc h ALA 202 CO 0.06 0.59 -1.59 1.19 0.00 0.00 0.00 179.25 179.50 3ksc n PHE 203 N -4.29 0.00 -3.43 0.00 3.72 0.14 -5.00 117.46 108.60 3ksc n PHE 203 Ca 0.05 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.28 3ksc n PHE 203 Cb 0.20 -0.30 0.08 0.00 -0.94 0.00 0.00 39.48 38.52 3ksc n PHE 203 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3ksc n ASN 204 N -1.95 -2.61 -4.21 4.37 5.15 0.25 -5.03 115.26 111.24 3ksc n ASN 204 Ca -0.01 -0.65 -0.12 0.00 -0.60 0.00 0.00 54.58 53.20 3ksc n ASN 204 Cb 0.46 -5.02 -0.10 0.00 -0.53 0.00 0.00 39.78 34.59 3ksc n ASN 204 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3ksc s VAL 205 N -3.39 0.39 0.74 3.44 -7.23 -1.03 -5.05 120.40 108.27 3ksc s VAL 205 Ca 0.07 -1.95 -0.13 0.00 -1.81 0.00 0.00 61.98 58.16 3ksc s VAL 205 Cb -0.01 -2.15 0.17 0.00 0.56 0.00 0.00 36.38 34.95 3ksc s VAL 205 CO 0.74 -0.41 0.98 -0.46 -0.31 0.00 0.00 175.10 175.64 3ksc n ASN 206 N -0.20 -0.06 -0.06 4.85 0.23 -1.26 -4.58 115.26 114.19 3ksc n ASN 206 Ca -0.05 -1.33 -0.09 0.00 -0.53 0.00 0.00 54.58 52.58 3ksc n ASN 206 Cb 0.64 -0.76 0.08 0.00 -2.08 0.00 0.00 39.78 37.66 3ksc n ASN 206 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 3ksc h ARG 207 N 0.00 0.71 0.32 -3.83 9.65 -1.99 -2.83 114.38 116.41 3ksc h ARG 207 Ca -0.32 -0.34 -0.02 0.00 -1.10 0.00 0.00 59.98 58.21 3ksc h ARG 207 Cb 0.89 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.46 3ksc h ARG 207 CO 0.22 0.94 -0.15 1.25 2.80 0.00 0.00 179.97 185.03 3ksc h HIS 208 N 0.60 -0.40 -0.91 2.20 2.76 -1.99 0.03 115.15 117.44 3ksc h HIS 208 Ca 0.06 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.31 3ksc h HIS 208 Cb 0.86 0.13 -0.06 0.00 1.55 0.00 0.00 27.41 29.88 3ksc h HIS 208 CO 0.04 -0.22 0.59 0.82 -1.30 0.00 0.00 177.93 177.86 3ksc h ILE 209 N -0.47 1.01 -0.10 6.26 2.04 -1.94 -0.52 117.51 123.80 3ksc h ILE 209 Ca -0.04 -0.33 -0.12 0.00 1.00 0.00 0.00 64.86 65.37 3ksc h ILE 209 Cb 0.36 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 3ksc h ILE 209 CO 0.07 0.18 -0.45 0.58 0.00 0.00 0.00 178.15 178.52 3ksc h VAL 210 N 0.97 1.33 -0.50 1.67 2.07 -1.22 -1.35 116.25 119.22 3ksc h VAL 210 Ca 0.41 -1.63 -0.08 0.00 0.82 0.00 0.00 66.70 66.22 3ksc h VAL 210 Cb 0.31 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 3ksc h VAL 210 CO -0.17 0.48 -0.01 0.44 0.02 0.00 0.00 177.57 178.34 3ksc h ASP 211 N 0.19 0.82 -0.25 0.57 5.19 0.57 -1.64 116.42 121.87 3ksc h ASP 211 Ca 0.01 -0.21 -0.08 0.00 -0.62 0.00 0.00 57.03 56.13 3ksc h ASP 211 Cb 0.88 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 40.17 3ksc h ASP 211 CO 0.07 0.89 -0.16 0.03 -3.12 0.00 0.00 179.24 176.95 3ksc h ARG 212 N 0.79 0.55 -0.58 3.56 2.47 -1.10 -2.16 114.38 117.89 3ksc h ARG 212 Ca 0.15 -0.26 0.11 0.00 -1.26 0.00 0.00 59.98 58.72 3ksc h ARG 212 Cb 0.48 -0.01 -0.11 0.00 -1.65 0.00 0.00 29.97 28.68 3ksc h ARG 212 CO 0.02 0.83 -0.26 1.25 0.56 0.00 0.00 179.97 182.37 3ksc h LEU 213 N 0.27 -0.90 0.00 3.04 5.85 -0.92 0.26 115.31 122.90 3ksc h LEU 213 Ca 0.05 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3ksc h LEU 213 Cb 0.68 0.49 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3ksc h LEU 213 CO 0.04 -0.27 0.00 0.00 -0.34 0.00 0.00 178.44 177.88 3ksc n GLN 214 N -5.44 1.00 -3.59 1.25 6.02 -0.65 -4.68 117.38 111.29 3ksc n GLN 214 Ca 0.05 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.80 3ksc n GLN 214 Cb 0.34 -1.30 0.07 0.00 1.02 0.00 0.00 30.24 30.38 3ksc n GLN 214 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ksc n GLY 215 N 0.79 -0.54 0.23 1.08 0.00 0.08 -4.63 105.19 102.19 3ksc n GLY 215 Ca 0.14 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 3ksc n GLY 215 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3ksc h ARG 216 N -2.52 0.72 -1.47 1.61 3.08 -1.63 -3.13 114.38 111.03 3ksc h ARG 216 Ca -0.57 -0.48 -0.71 0.00 0.07 0.00 0.00 59.98 58.29 3ksc h ARG 216 Cb 1.37 0.07 -0.28 0.00 0.08 0.00 0.00 29.97 31.21 3ksc h ARG 216 CO 0.57 1.10 0.95 0.09 -1.07 0.00 0.00 179.97 181.62 3ksc n ASN 217 N -3.97 7.61 -3.91 7.04 3.02 -1.26 -4.90 115.26 118.89 3ksc n ASN 217 Ca -0.04 -3.80 -0.18 0.00 -0.03 0.00 0.00 54.58 50.54 3ksc n ASN 217 Cb 0.64 -1.02 -0.15 0.00 -0.61 0.00 0.00 39.78 38.63 3ksc n ASN 217 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ksc s GLU 218 N -3.89 0.56 0.42 3.52 2.12 -1.18 -5.14 118.70 115.11 3ksc s GLU 218 Ca 0.59 -0.11 -0.10 0.00 0.36 0.00 0.00 54.97 55.70 3ksc s GLU 218 Cb 0.47 -0.59 -0.06 0.00 0.26 0.00 0.00 34.13 34.21 3ksc s GLU 218 CO -0.20 0.00 0.78 0.16 -0.54 0.00 0.00 175.26 175.46 3ksc s ASP 219 N 0.46 6.48 0.00 -1.70 -4.77 -1.26 -4.71 116.67 111.17 3ksc s ASP 219 Ca -0.05 1.11 0.06 0.00 -3.30 0.00 0.00 52.55 50.37 3ksc s ASP 219 Cb -0.09 -2.32 0.26 0.00 -1.09 0.00 0.00 42.92 39.69 3ksc s ASP 219 CO -0.00 -0.43 1.17 -0.62 0.70 0.00 0.00 175.17 175.98 3ksc n GLU 220 N -1.45 0.02 0.17 2.11 1.02 -1.23 -2.04 120.64 119.23 3ksc n GLU 220 Ca 0.02 0.37 0.12 0.00 -0.02 0.00 0.00 57.16 57.65 3ksc n GLU 220 Cb 0.54 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.55 3ksc n GLU 220 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3ksc h GLU 221 N 0.00 0.00 0.58 3.49 3.07 -1.92 -3.34 114.58 116.46 3ksc h GLU 221 Ca 0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 3ksc h GLU 221 Cb 0.09 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.01 3ksc h GLU 221 CO 0.00 0.00 -0.28 -0.22 -1.40 0.00 0.00 179.01 177.11 3ksc h LYS 222 N 0.00 -0.75 0.00 2.33 3.64 -1.76 -3.23 116.57 116.79 3ksc h LYS 222 Ca -0.00 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3ksc h LYS 222 Cb 1.01 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3ksc h LYS 222 CO 0.00 -0.46 0.00 0.41 -2.27 0.00 0.00 179.45 177.13 3ksc n GLY 223 N -1.12 -2.06 0.17 5.01 0.00 -1.25 -0.12 105.19 105.82 3ksc n GLY 223 Ca -0.12 -1.67 -0.03 0.00 0.00 0.00 0.00 46.02 44.20 3ksc n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ksc h ALA 224 N 0.00 0.99 -3.04 4.61 0.00 -1.92 -3.41 119.26 116.48 3ksc h ALA 224 Ca 0.00 -0.49 -0.66 0.00 0.00 0.00 0.00 54.91 53.76 3ksc h ALA 224 Cb 0.00 -0.09 -0.28 0.00 0.00 0.00 0.00 17.79 17.43 3ksc h ALA 224 CO 0.00 0.68 -0.70 0.42 0.00 0.00 0.00 179.25 179.64 3ksc s ILE 225 N -3.88 3.47 0.01 0.00 1.01 -1.26 -1.71 121.20 118.83 3ksc s ILE 225 Ca -0.04 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.07 3ksc s ILE 225 Cb 0.13 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 3ksc s ILE 225 CO 0.78 0.32 -0.09 -0.69 0.00 0.00 0.00 174.94 175.26 3ksc s VAL 226 N 1.47 3.44 0.03 2.92 1.01 -0.27 -0.47 120.40 128.53 3ksc s VAL 226 Ca 0.04 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 3ksc s VAL 226 Cb -0.15 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 3ksc s VAL 226 CO -0.02 0.39 1.20 -0.54 0.00 0.00 0.00 175.10 176.13 3ksc s LYS 227 N -1.39 4.41 -0.10 2.72 -0.14 -1.26 0.09 119.74 124.06 3ksc s LYS 227 Ca 0.16 1.74 -0.17 0.00 -1.36 0.00 0.00 55.97 56.34 3ksc s LYS 227 Cb -0.11 -3.42 -0.04 0.00 -1.68 0.00 0.00 37.83 32.58 3ksc s LYS 227 CO 0.07 -0.32 0.45 0.08 -0.76 0.00 0.00 175.35 174.88 3ksc s VAL 228 N 1.43 5.17 -0.07 3.17 1.01 0.39 -4.90 120.40 126.59 3ksc s VAL 228 Ca 0.58 0.91 -0.03 0.00 0.00 0.00 0.00 61.98 63.44 3ksc s VAL 228 Cb -0.28 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 3ksc s VAL 228 CO 0.27 0.37 -0.06 0.11 0.00 0.00 0.00 175.10 175.79 3ksc h LYS 229 N 6.42 0.00 -0.68 2.72 1.79 -1.96 -3.41 116.57 121.45 3ksc h LYS 229 Ca -0.42 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.76 3ksc h LYS 229 Cb 1.18 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.66 3ksc h LYS 229 CO 0.74 0.00 0.29 0.41 -1.08 0.00 0.00 179.45 179.80 3ksc n GLY 230 N 1.76 4.29 0.48 3.86 0.00 -1.26 -5.05 105.19 109.28 3ksc n GLY 230 Ca -0.02 -1.09 0.06 0.00 0.00 0.00 0.00 46.02 44.96 3ksc n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ksc n GLY 231 N -0.77 -2.63 3.29 -0.02 0.00 -1.26 -4.88 105.19 98.92 3ksc n GLY 231 Ca 0.44 -1.33 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 3ksc n GLY 231 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ksc s LEU 232 N -5.34 3.20 -0.68 0.99 1.43 -1.26 -5.07 118.68 111.95 3ksc s LEU 232 Ca 0.00 -0.59 -0.27 0.00 -1.03 0.00 0.00 54.13 52.24 3ksc s LEU 232 Cb 0.00 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.48 3ksc s LEU 232 CO 0.00 -0.09 1.48 -0.44 0.23 0.00 0.00 176.35 177.54 3ksc s SER 233 N 1.44 5.86 -0.45 2.29 0.01 -1.26 -4.93 113.70 116.67 3ksc s SER 233 Ca 0.04 -0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.19 3ksc s SER 233 Cb -0.16 -2.55 0.13 0.00 0.21 0.00 0.00 66.02 63.65 3ksc s SER 233 CO -0.02 -2.01 0.21 -0.63 0.41 0.00 0.00 173.24 171.20 3ksc s ILE 234 N 6.89 1.88 -2.12 1.44 1.01 -1.26 -5.24 121.20 123.80 3ksc s ILE 234 Ca 0.47 -2.70 0.18 0.00 0.00 0.00 0.00 60.65 58.59 3ksc s ILE 234 Cb -0.10 -2.32 0.44 0.00 0.01 0.00 0.00 42.46 40.49 3ksc s ILE 234 CO 0.18 -0.81 1.41 -0.38 0.00 0.00 0.00 174.94 175.33 3ksc n ILE 235 N 3.58 0.57 -0.16 2.92 5.41 -1.26 -5.15 119.36 125.27 3ksc n ILE 235 Ca 0.06 -0.62 0.15 0.00 1.00 0.00 0.00 62.75 63.33 3ksc n ILE 235 Cb 0.35 0.43 0.28 0.00 -0.71 0.00 0.00 39.64 39.99 3ksc n ILE 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 3ksc n THR 316 N 0.93 -0.21 -3.49 1.39 -1.04 -1.26 -5.03 114.28 105.57 3ksc n THR 316 Ca 0.17 1.00 -0.27 0.00 -2.04 0.00 0.00 64.05 62.92 3ksc n THR 316 Cb 0.43 -1.62 -0.09 0.00 -1.82 0.00 0.00 70.33 67.24 3ksc n THR 316 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 3ksc n VAL 317 N -4.14 1.56 -0.61 12.58 3.14 -1.26 -4.77 118.33 124.83 3ksc n VAL 317 Ca 0.18 -4.87 0.00 0.00 -2.96 0.00 0.00 64.34 56.69 3ksc n VAL 317 Cb 0.61 -2.07 0.29 0.00 -1.06 0.00 0.00 33.84 31.61 3ksc n VAL 317 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3ksc n THR 319 N 0.21 0.00 -0.92 0.00 5.66 -1.26 -5.02 114.28 112.95 3ksc n THR 319 Ca 0.28 -0.41 -0.30 0.00 -3.05 0.00 0.00 64.05 60.58 3ksc n THR 319 Cb 1.12 1.10 0.16 0.00 -1.55 0.00 0.00 70.33 71.16 3ksc n THR 319 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ksc s ALA 320 N -1.27 1.38 -0.06 1.79 0.00 -1.24 -4.99 121.76 117.37 3ksc s ALA 320 Ca 0.07 0.26 -0.27 0.00 0.00 0.00 0.00 51.96 52.03 3ksc s ALA 320 Cb 0.07 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 3ksc s ALA 320 CO 0.23 -2.60 0.85 0.21 0.00 0.00 0.00 175.76 174.45 3ksc s LYS 321 N -4.75 4.46 -0.05 0.00 2.20 -1.26 -4.95 119.74 115.40 3ksc s LYS 321 Ca 0.65 1.14 0.16 0.00 -0.36 0.00 0.00 55.97 57.56 3ksc s LYS 321 Cb -0.21 -3.48 0.53 0.00 -1.51 0.00 0.00 37.83 33.16 3ksc s LYS 321 CO 0.58 -0.07 1.45 1.28 -0.36 0.00 0.00 175.35 178.23 3ksc n LEU 322 N 4.15 3.79 -3.63 5.43 4.32 -1.26 -4.59 117.00 125.20 3ksc n LEU 322 Ca 0.03 -2.23 -0.13 0.00 -0.02 0.00 0.00 56.01 53.66 3ksc n LEU 322 Cb 0.51 -0.42 -0.07 0.00 -1.62 0.00 0.00 43.42 41.81 3ksc n LEU 322 CO 0.49 0.81 0.47 -0.60 -1.22 0.00 0.00 177.39 177.35 3ksc s ARG 323 N -1.43 0.79 -0.20 3.23 3.52 -1.26 -1.02 118.95 122.59 3ksc s ARG 323 Ca 0.39 0.94 -0.13 0.00 -0.13 0.00 0.00 55.73 56.80 3ksc s ARG 323 Cb 0.24 0.39 0.06 0.00 -1.56 0.00 0.00 34.95 34.07 3ksc s ARG 323 CO 0.22 -0.09 0.50 -1.17 -0.81 0.00 0.00 175.30 173.94 3ksc s LEU 324 N 0.36 -0.23 -0.15 -0.88 0.20 -0.61 -4.99 118.68 112.38 3ksc s LEU 324 Ca 0.00 1.07 -0.20 0.00 0.69 0.00 0.00 54.13 55.69 3ksc s LEU 324 Cb -0.05 1.69 -0.03 0.00 -0.43 0.00 0.00 46.19 47.36 3ksc s LEU 324 CO -0.00 -0.20 0.58 0.21 -0.29 0.00 0.00 176.35 176.65 3ksc s ASN 325 N 1.12 6.72 -0.26 3.68 3.84 -1.26 -0.95 114.94 127.84 3ksc s ASN 325 Ca -0.07 0.87 0.10 0.00 0.21 0.00 0.00 52.86 53.97 3ksc s ASN 325 Cb -0.06 -2.33 0.47 0.00 -0.55 0.00 0.00 41.25 38.77 3ksc s ASN 325 CO -0.10 -0.15 1.36 2.30 -2.79 0.00 0.00 177.10 177.71 3ksc n ILE 326 N 4.21 2.40 -0.86 -5.21 -5.35 -0.27 -4.68 119.36 109.60 3ksc n ILE 326 Ca -0.03 -2.97 0.00 0.00 -0.27 0.00 0.00 62.75 59.47 3ksc n ILE 326 Cb 0.51 -0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.12 3ksc n ILE 326 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ksc n GLY 327 N -1.12 -1.24 0.28 3.28 0.00 -1.24 -4.86 105.19 100.29 3ksc n GLY 327 Ca 0.27 -1.64 0.17 0.00 0.00 0.00 0.00 46.02 44.81 3ksc n GLY 327 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ksc h PRO 328 N 0.00 0.00 -0.00 1.61 0.11 -1.95 -2.12 132.00 129.65 3ksc h PRO 328 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3ksc h PRO 328 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3ksc h PRO 328 CO 0.00 0.06 -0.18 -1.13 -0.21 0.00 0.00 178.00 176.53 3ksc n SER 329 N -3.28 0.50 -4.89 -2.05 3.41 -1.26 -4.86 113.62 101.19 3ksc n SER 329 Ca -0.01 -0.43 -0.29 0.00 -0.26 0.00 0.00 58.87 57.88 3ksc n SER 329 Cb 0.24 -0.04 -0.00 0.00 -0.26 0.00 0.00 64.21 64.15 3ksc n SER 329 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3ksc s SER 330 N -2.63 6.28 -0.30 4.04 1.04 -0.80 -5.02 113.70 116.31 3ksc s SER 330 Ca 0.23 1.08 -0.28 0.00 0.48 0.00 0.00 55.95 57.46 3ksc s SER 330 Cb 0.19 -2.31 0.01 0.00 0.10 0.00 0.00 66.02 64.01 3ksc s SER 330 CO 0.53 -0.64 1.04 -0.55 0.98 0.00 0.00 173.24 174.60 3ksc s SER 331 N -4.03 6.94 0.57 7.02 0.15 -1.26 -4.96 113.70 118.13 3ksc s SER 331 Ca 0.50 1.08 -0.19 0.00 0.70 0.00 0.00 55.95 58.04 3ksc s SER 331 Cb -0.10 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.63 3ksc s SER 331 CO 0.46 -0.81 1.17 -2.84 1.20 0.00 0.00 173.24 172.42 3ksc s PRO 332 N 3.49 3.14 0.09 5.44 0.02 -1.26 -4.96 135.00 140.95 3ksc s PRO 332 Ca 0.44 1.73 0.00 0.00 0.02 0.00 0.00 61.00 63.19 3ksc s PRO 332 Cb -0.13 -1.96 -0.25 0.00 0.02 0.00 0.00 34.50 32.17 3ksc s PRO 332 CO 0.13 -1.05 1.17 -0.44 -0.33 0.00 0.00 177.00 176.48 3ksc h ASP 333 N 1.01 0.26 -3.39 2.53 3.32 -1.55 -3.44 116.42 115.15 3ksc h ASP 333 Ca -0.50 -0.28 -0.37 0.00 0.02 0.00 0.00 57.03 55.90 3ksc h ASP 333 Cb 1.28 -0.08 -0.36 0.00 0.22 0.00 0.00 39.33 40.39 3ksc h ASP 333 CO 0.56 1.22 -0.75 -0.63 -1.72 0.00 0.00 179.24 177.92 3ksc s ILE 334 N -2.67 0.12 -0.06 0.35 1.01 -1.12 -4.99 121.20 113.83 3ksc s ILE 334 Ca -0.02 0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.84 3ksc s ILE 334 Cb 0.08 -0.28 0.02 0.00 0.01 0.00 0.00 42.46 42.29 3ksc s ILE 334 CO 0.86 0.18 -0.08 -0.47 0.00 0.00 0.00 174.94 175.42 3ksc s TYR 335 N 1.56 1.15 -0.22 3.97 5.04 -1.26 -0.56 117.35 127.03 3ksc s TYR 335 Ca -0.02 -0.42 -0.03 0.00 -2.44 0.00 0.00 57.07 54.16 3ksc s TYR 335 Cb -0.13 -0.93 0.07 0.00 0.35 0.00 0.00 41.96 41.33 3ksc s TYR 335 CO -0.03 -0.28 0.05 1.21 -1.34 0.00 0.00 175.55 175.16 3ksc s ASN 336 N 0.99 3.11 0.02 4.32 3.84 0.52 -5.01 114.94 122.72 3ksc s ASN 336 Ca -0.09 -0.98 0.01 0.00 0.21 0.00 0.00 52.86 52.01 3ksc s ASN 336 Cb -0.15 -0.61 0.05 0.00 -0.55 0.00 0.00 41.25 40.00 3ksc s ASN 336 CO 0.00 -0.33 0.96 -0.81 -2.79 0.00 0.00 177.10 174.13 3ksc n PRO 337 N 5.04 0.01 -0.08 0.43 -0.04 -1.26 -0.30 135.00 138.80 3ksc n PRO 337 Ca -0.08 0.44 0.03 0.00 -0.04 0.00 0.00 63.50 63.85 3ksc n PRO 337 Cb 0.46 -1.59 0.07 0.00 -0.04 0.00 0.00 33.50 32.40 3ksc n PRO 337 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3ksc n GLU 338 N -1.47 2.94 0.00 0.54 -0.58 -1.26 -4.82 120.64 115.99 3ksc n GLU 338 Ca -0.00 -1.75 0.00 0.00 -0.42 0.00 0.00 57.16 54.98 3ksc n GLU 338 Cb 0.07 -1.13 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3ksc n GLU 338 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3ksc n ALA 339 N -0.03 2.00 0.00 0.62 0.00 0.60 -4.10 120.51 119.60 3ksc n ALA 339 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3ksc n ALA 339 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 3ksc n ALA 339 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ksc n GLY 340 N 0.90 0.17 3.10 0.00 0.00 0.22 -0.77 105.19 108.82 3ksc n GLY 340 Ca 0.00 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.49 3ksc n GLY 340 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ksc s ARG 341 N -2.00 0.61 0.01 1.61 1.70 -0.84 -0.36 118.95 119.68 3ksc s ARG 341 Ca 0.00 -0.95 0.05 0.00 -0.47 0.00 0.00 55.73 54.36 3ksc s ARG 341 Cb 0.00 0.23 -0.02 0.00 -0.57 0.00 0.00 34.95 34.59 3ksc s ARG 341 CO 0.00 -0.14 -0.15 0.42 -1.08 0.00 0.00 175.30 174.35 3ksc s ILE 342 N -3.19 1.18 -0.16 4.99 -1.09 0.28 -1.83 121.20 121.39 3ksc s ILE 342 Ca 0.00 -0.79 -0.04 0.00 -2.23 0.00 0.00 60.65 57.59 3ksc s ILE 342 Cb 0.02 -1.02 0.07 0.00 -1.58 0.00 0.00 42.46 39.96 3ksc s ILE 342 CO -0.07 0.21 0.14 -0.75 -1.23 0.00 0.00 174.94 173.25 3ksc s LYS 343 N -0.67 0.09 0.19 2.79 2.36 -0.07 -1.20 119.74 123.22 3ksc s LYS 343 Ca 0.05 0.16 0.04 0.00 -2.55 0.00 0.00 55.97 53.67 3ksc s LYS 343 Cb -0.07 -1.25 -0.03 0.00 -1.05 0.00 0.00 37.83 35.43 3ksc s LYS 343 CO 0.00 -0.58 0.28 0.95 1.55 0.00 0.00 175.35 177.56 3ksc s THR 344 N 2.23 5.12 -0.07 3.43 -4.23 -1.26 0.79 115.64 121.65 3ksc s THR 344 Ca 0.04 -0.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.69 3ksc s THR 344 Cb -0.15 -3.69 0.01 0.00 1.34 0.00 0.00 72.50 70.01 3ksc s THR 344 CO -0.09 -0.18 -0.15 0.54 -0.54 0.00 0.00 174.62 174.20 3ksc s VAL 345 N -1.84 1.32 0.31 2.29 0.11 0.11 -4.97 120.40 117.72 3ksc s VAL 345 Ca 0.34 -0.59 0.05 0.00 -2.93 0.00 0.00 61.98 58.86 3ksc s VAL 345 Cb -0.10 -1.18 -0.02 0.00 -1.53 0.00 0.00 36.38 33.55 3ksc s VAL 345 CO 0.28 0.39 0.20 0.35 -3.33 0.00 0.00 175.10 172.99 3ksc n THR 346 N 3.74 0.00 0.36 5.04 -2.24 -1.26 -2.35 114.28 117.58 3ksc n THR 346 Ca -0.22 -2.06 0.07 0.00 -2.27 0.00 0.00 64.05 59.57 3ksc n THR 346 Cb 0.52 0.92 0.32 0.00 -2.10 0.00 0.00 70.33 70.00 3ksc n THR 346 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ksc n SER 347 N -1.78 0.21 0.15 3.42 3.41 -0.83 -0.46 113.62 117.73 3ksc n SER 347 Ca 0.02 0.56 0.02 0.00 -0.26 0.00 0.00 58.87 59.22 3ksc n SER 347 Cb 0.52 -0.60 0.16 0.00 -0.26 0.00 0.00 64.21 64.03 3ksc n SER 347 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ksc h LEU 348 N 0.00 0.00 0.04 1.04 3.38 -1.94 -3.20 115.31 114.63 3ksc h LEU 348 Ca 0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 3ksc h LEU 348 Cb 0.22 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3ksc h LEU 348 CO 0.00 0.53 -2.21 0.47 0.09 0.00 0.00 178.44 177.32 3ksc n ASP 349 N -3.45 1.52 -3.56 -0.43 9.92 -0.07 -4.81 116.55 115.67 3ksc n ASP 349 Ca 0.00 0.07 -0.29 0.00 -0.53 0.00 0.00 54.79 54.04 3ksc n ASP 349 Cb 0.65 -0.25 -0.12 0.00 -0.64 0.00 0.00 41.12 40.75 3ksc n ASP 349 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 3ksc s LEU 350 N -6.44 1.63 0.37 0.64 2.96 0.39 -4.98 118.68 113.26 3ksc s LEU 350 Ca -0.23 -2.33 0.14 0.00 -0.22 0.00 0.00 54.13 51.50 3ksc s LEU 350 Cb 0.08 -0.64 0.99 0.00 0.50 0.00 0.00 46.19 47.11 3ksc s LEU 350 CO 0.72 -0.30 1.80 -0.65 -1.32 0.00 0.00 176.35 176.60 3ksc h PRO 351 N 6.95 0.50 -0.19 0.98 0.11 -1.80 -0.33 132.00 138.22 3ksc h PRO 351 Ca 0.03 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 66.16 3ksc h PRO 351 Cb 0.96 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 3ksc h PRO 351 CO 0.35 0.33 0.18 -0.24 -0.21 0.00 0.00 178.00 178.41 3ksc h VAL 352 N 0.51 0.58 -0.23 3.15 3.04 -1.88 -1.21 116.25 120.22 3ksc h VAL 352 Ca 0.55 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 66.31 3ksc h VAL 352 Cb 1.22 0.86 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 3ksc h VAL 352 CO -0.29 0.00 0.22 -0.07 -1.01 0.00 0.00 177.57 176.42 3ksc h LEU 353 N 0.00 0.00 -1.30 3.16 4.07 -1.38 -1.09 115.31 118.77 3ksc h LEU 353 Ca 0.09 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.98 3ksc h LEU 353 Cb 0.46 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 3ksc h LEU 353 CO -0.00 0.00 -0.35 0.08 -1.08 0.00 0.00 178.44 177.09 3ksc h ARG 354 N 0.00 0.00 -0.11 1.13 0.11 -1.41 0.68 114.38 114.77 3ksc h ARG 354 Ca 0.11 -0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.16 3ksc h ARG 354 Cb 0.54 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.62 3ksc h ARG 354 CO -0.00 0.35 -0.04 -1.49 0.10 0.00 0.00 179.97 178.89 3ksc h TRP 355 N 0.00 0.24 0.00 4.08 4.06 -1.37 -3.19 115.95 119.77 3ksc h TRP 355 Ca -0.00 -0.06 -0.04 0.00 2.06 0.00 0.00 58.89 60.85 3ksc h TRP 355 Cb 0.62 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.72 3ksc h TRP 355 CO 0.00 0.54 -0.19 -0.07 -3.56 0.00 0.00 178.44 175.16 3ksc h LEU 356 N -0.12 0.00 -1.78 -4.49 3.38 -1.29 -3.48 115.31 107.54 3ksc h LEU 356 Ca 0.03 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.57 3ksc h LEU 356 Cb 0.47 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.26 3ksc h LEU 356 CO 0.01 0.19 -0.83 0.29 0.09 0.00 0.00 178.44 178.19 3ksc n LYS 357 N -3.32 -4.80 -4.14 1.13 4.76 0.23 -4.95 118.16 107.06 3ksc n LYS 357 Ca 0.00 0.60 -0.11 0.00 -2.87 0.00 0.00 58.31 55.94 3ksc n LYS 357 Cb 0.43 -5.14 -0.10 0.00 -1.84 0.00 0.00 35.03 28.38 3ksc n LYS 357 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3ksc s LEU 358 N -6.71 2.44 0.00 -0.35 1.43 -1.16 -2.69 118.68 111.65 3ksc s LEU 358 Ca 0.01 -0.89 -0.08 0.00 -1.03 0.00 0.00 54.13 52.15 3ksc s LEU 358 Cb -0.01 -0.10 0.03 0.00 0.03 0.00 0.00 46.19 46.14 3ksc s LEU 358 CO 0.82 -0.40 0.64 -1.54 0.23 0.00 0.00 176.35 176.11 3ksc n SER 359 N 0.35 -1.84 -3.63 2.29 3.41 -0.64 -3.89 113.62 109.66 3ksc n SER 359 Ca -0.15 -2.79 -0.15 0.00 -0.26 0.00 0.00 58.87 55.51 3ksc n SER 359 Cb 0.59 3.22 -0.07 0.00 -0.26 0.00 0.00 64.21 67.69 3ksc n SER 359 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ksc s ALA 360 N -2.48 -1.27 -0.06 7.33 0.00 -0.99 -1.17 121.76 123.12 3ksc s ALA 360 Ca 0.23 0.79 0.02 0.00 0.00 0.00 0.00 51.96 53.00 3ksc s ALA 360 Cb -0.03 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.19 3ksc s ALA 360 CO 0.17 -0.34 -0.09 -2.00 0.00 0.00 0.00 175.76 173.50 3ksc s GLU 361 N -1.40 1.40 -0.22 0.00 2.12 -0.15 0.08 118.70 120.52 3ksc s GLU 361 Ca -0.11 -0.30 -0.06 0.00 0.36 0.00 0.00 54.97 54.85 3ksc s GLU 361 Cb -0.02 -1.23 -0.03 0.00 0.26 0.00 0.00 34.13 33.11 3ksc s GLU 361 CO 0.06 -0.03 0.04 -1.58 -0.54 0.00 0.00 175.26 173.22 3ksc s HIS 362 N 0.81 3.09 0.16 5.30 5.65 0.24 0.88 115.29 131.42 3ksc s HIS 362 Ca -0.12 -0.38 0.11 0.00 0.25 0.00 0.00 55.06 54.92 3ksc s HIS 362 Cb -0.15 -2.16 -0.04 0.00 -1.18 0.00 0.00 32.58 29.04 3ksc s HIS 362 CO 0.02 -0.25 -0.24 0.20 -0.65 0.00 0.00 174.74 173.82 3ksc s GLY 363 N 1.24 1.59 -0.12 1.59 0.00 0.61 -0.90 107.32 111.33 3ksc s GLY 363 Ca 0.04 -1.54 -0.05 0.00 0.00 0.00 0.00 44.72 43.17 3ksc s GLY 363 CO 0.03 -1.56 0.26 -0.45 0.00 0.00 0.00 173.10 171.38 3ksc s SER 364 N -2.45 0.00 -0.05 1.64 0.15 -0.76 -0.86 113.70 111.38 3ksc s SER 364 Ca 0.17 0.57 0.05 0.00 0.70 0.00 0.00 55.95 57.44 3ksc s SER 364 Cb -0.08 0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 64.78 3ksc s SER 364 CO 0.08 -0.20 -0.20 -0.76 1.20 0.00 0.00 173.24 173.36 3ksc s LEU 365 N 1.79 1.97 0.80 3.45 1.43 0.19 -1.99 118.68 126.32 3ksc s LEU 365 Ca -0.05 -0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 52.53 3ksc s LEU 365 Cb -0.11 -1.10 0.07 0.00 0.03 0.00 0.00 46.19 45.08 3ksc s LEU 365 CO -0.09 0.18 1.14 -1.00 0.23 0.00 0.00 176.35 176.82 3ksc s HIS 366 N -0.03 2.95 -0.01 0.29 3.76 0.05 -0.75 115.29 121.54 3ksc s HIS 366 Ca -0.04 0.90 -0.33 0.00 -0.15 0.00 0.00 55.06 55.44 3ksc s HIS 366 Cb -0.12 -3.32 -0.12 0.00 1.11 0.00 0.00 32.58 30.13 3ksc s HIS 366 CO 0.03 -1.74 1.84 1.17 -0.85 0.00 0.00 174.74 175.19 3ksc n LYS 367 N -3.34 2.32 -0.76 1.40 4.81 -1.13 -1.27 118.16 120.20 3ksc n LYS 367 Ca 0.07 0.85 0.00 0.00 -0.87 0.00 0.00 58.31 58.36 3ksc n LYS 367 Cb 0.59 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 32.94 3ksc n LYS 367 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3ksc n ASN 368 N 6.15 0.00 -4.80 3.14 5.03 -0.19 -4.61 115.26 119.99 3ksc n ASN 368 Ca 0.21 0.00 -0.32 0.00 0.87 0.00 0.00 54.58 55.34 3ksc n ASN 368 Cb 0.32 -0.66 0.03 0.00 -1.02 0.00 0.00 39.78 38.45 3ksc n ASN 368 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3ksc s ALA 369 N -3.08 2.63 0.17 5.41 0.00 -0.39 -4.12 121.76 122.37 3ksc s ALA 369 Ca 0.00 0.36 0.01 0.00 0.00 0.00 0.00 51.96 52.33 3ksc s ALA 369 Cb 0.00 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 3ksc s ALA 369 CO 0.00 -1.08 0.01 0.00 0.00 0.00 0.00 175.76 174.69 3ksc s MET 370 N -4.34 1.09 -0.07 0.00 0.23 -0.85 -0.96 119.30 114.40 3ksc s MET 370 Ca 0.63 -1.53 -0.11 0.00 -1.03 0.00 0.00 55.69 53.66 3ksc s MET 370 Cb -0.17 -0.20 -0.05 0.00 -1.53 0.00 0.00 34.83 32.88 3ksc s MET 370 CO 0.43 -0.15 0.26 -0.59 -2.03 0.00 0.00 175.02 172.94 3ksc s PHE 371 N -3.71 3.64 0.83 3.16 -0.12 -0.78 -0.99 117.98 120.01 3ksc s PHE 371 Ca 0.24 0.72 -0.12 0.00 -0.05 0.00 0.00 56.93 57.72 3ksc s PHE 371 Cb 0.06 -2.11 0.10 0.00 -0.63 0.00 0.00 43.02 40.44 3ksc s PHE 371 CO 0.04 0.67 1.18 0.14 -0.05 0.00 0.00 175.22 177.20 3ksc s VAL 372 N -0.94 2.13 0.09 -2.49 -7.23 -0.70 -3.20 120.40 108.06 3ksc s VAL 372 Ca 0.18 0.05 -0.34 0.00 -1.81 0.00 0.00 61.98 60.07 3ksc s VAL 372 Cb -0.14 -2.36 -0.14 0.00 0.56 0.00 0.00 36.38 34.30 3ksc s VAL 372 CO 0.08 -0.05 1.63 -2.65 -0.31 0.00 0.00 175.10 173.80 3ksc n PRO 373 N -3.52 2.07 -3.81 4.82 -0.02 -1.26 -4.64 135.00 128.64 3ksc n PRO 373 Ca 0.13 0.75 -0.10 0.00 -2.02 0.00 0.00 63.50 62.26 3ksc n PRO 373 Cb 0.51 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 3ksc n PRO 373 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3ksc s HIS 374 N 1.63 0.09 0.13 6.00 -3.43 -0.23 -0.59 115.29 118.90 3ksc s HIS 374 Ca 0.83 -0.45 0.05 0.00 -0.80 0.00 0.00 55.06 54.68 3ksc s HIS 374 Cb -0.71 0.14 -0.04 0.00 -1.43 0.00 0.00 32.58 30.54 3ksc s HIS 374 CO 0.42 -0.75 -0.11 1.52 -2.00 0.00 0.00 174.74 173.82 3ksc s TYR 375 N -3.89 1.23 -0.21 0.38 -0.85 -0.43 -0.23 117.35 113.35 3ksc s TYR 375 Ca 0.10 -0.69 -0.17 0.00 -0.52 0.00 0.00 57.07 55.79 3ksc s TYR 375 Cb 0.02 -0.64 -0.03 0.00 0.38 0.00 0.00 41.96 41.68 3ksc s TYR 375 CO -0.05 0.07 0.46 -0.80 -1.52 0.00 0.00 175.55 173.72 3ksc s ASN 376 N -2.81 6.48 0.18 -0.18 0.01 -1.26 0.22 114.94 117.56 3ksc s ASN 376 Ca 0.12 0.57 -0.12 0.00 -0.71 0.00 0.00 52.86 52.72 3ksc s ASN 376 Cb -0.01 -2.26 0.08 0.00 0.41 0.00 0.00 41.25 39.47 3ksc s ASN 376 CO 0.01 -0.15 1.74 -0.07 -1.51 0.00 0.00 177.10 177.11 3ksc h LEU 377 N 7.98 0.84 -4.41 0.60 4.07 -1.61 -1.17 115.31 121.61 3ksc h LEU 377 Ca -0.34 -0.17 -0.21 0.00 0.08 0.00 0.00 57.88 57.24 3ksc h LEU 377 Cb 1.16 -0.22 -0.38 0.00 1.08 0.00 0.00 40.66 42.30 3ksc h LEU 377 CO 0.72 0.78 -1.03 -0.46 -1.08 0.00 0.00 178.44 177.36 3ksc n ASN 378 N -4.46 1.17 -3.54 -0.43 6.94 -1.26 -4.72 115.26 108.97 3ksc n ASN 378 Ca 0.04 -2.02 -0.15 0.00 -0.02 0.00 0.00 54.58 52.42 3ksc n ASN 378 Cb 0.16 -0.35 -0.06 0.00 -2.36 0.00 0.00 39.78 37.18 3ksc n ASN 378 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ksc s ALA 379 N -2.12 -1.82 0.26 -2.53 0.00 -1.26 -4.61 121.76 109.67 3ksc s ALA 379 Ca 0.28 1.39 -0.18 0.00 0.00 0.00 0.00 51.96 53.45 3ksc s ALA 379 Cb 0.34 -0.22 -0.09 0.00 0.00 0.00 0.00 23.12 23.16 3ksc s ALA 379 CO -0.09 -0.36 0.74 -0.80 0.00 0.00 0.00 175.76 175.25 3ksc s ASN 380 N -1.20 6.98 -0.05 0.00 0.01 -1.26 -3.29 114.94 116.12 3ksc s ASN 380 Ca -0.08 1.39 0.06 0.00 -0.71 0.00 0.00 52.86 53.53 3ksc s ASN 380 Cb -0.00 -2.41 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 3ksc s ASN 380 CO 0.07 -0.05 -0.24 -0.44 -1.51 0.00 0.00 177.10 174.93 3ksc s SER 381 N -1.85 3.22 -0.30 -1.22 0.01 0.45 -1.79 113.70 112.22 3ksc s SER 381 Ca 0.47 -0.45 -0.02 0.00 1.31 0.00 0.00 55.95 57.25 3ksc s SER 381 Cb -0.15 -0.70 0.05 0.00 0.21 0.00 0.00 66.02 65.43 3ksc s SER 381 CO 0.20 0.28 0.01 -0.63 0.41 0.00 0.00 173.24 173.51 3ksc s ILE 382 N -0.36 3.08 -0.30 1.44 -1.09 0.03 0.18 121.20 124.18 3ksc s ILE 382 Ca 0.03 -1.34 -0.18 0.00 -2.23 0.00 0.00 60.65 56.92 3ksc s ILE 382 Cb -0.12 -2.76 -0.02 0.00 -1.58 0.00 0.00 42.46 37.98 3ksc s ILE 382 CO 0.02 -0.10 0.53 -0.63 -1.23 0.00 0.00 174.94 173.53 3ksc s ILE 383 N 1.27 5.02 -0.27 2.92 1.01 0.34 -0.90 121.20 130.60 3ksc s ILE 383 Ca -0.05 0.68 -0.05 0.00 0.00 0.00 0.00 60.65 61.23 3ksc s ILE 383 Cb -0.20 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.38 3ksc s ILE 383 CO -0.01 -0.07 0.03 -0.47 0.00 0.00 0.00 174.94 174.43 3ksc s TYR 384 N 2.40 3.11 0.04 3.97 5.04 -0.20 -0.28 117.35 131.42 3ksc s TYR 384 Ca 0.21 -1.11 -0.30 0.00 -2.44 0.00 0.00 57.07 53.42 3ksc s TYR 384 Cb -0.15 -2.18 -0.06 0.00 0.35 0.00 0.00 41.96 39.91 3ksc s TYR 384 CO 0.11 -0.61 1.41 0.00 -1.34 0.00 0.00 175.55 175.13 3ksc s ALA 385 N 1.45 3.58 -0.22 3.97 0.00 -0.61 -1.69 121.76 128.25 3ksc s ALA 385 Ca 0.02 0.97 -0.14 0.00 0.00 0.00 0.00 51.96 52.81 3ksc s ALA 385 Cb -0.17 -3.58 -0.18 0.00 0.00 0.00 0.00 23.12 19.19 3ksc s ALA 385 CO 0.00 -0.83 0.02 1.28 0.00 0.00 0.00 175.76 176.23 3ksc n LEU 386 N 4.97 2.14 -3.83 0.00 4.77 0.13 -0.54 117.00 124.65 3ksc n LEU 386 Ca 0.13 0.30 -0.12 0.00 -0.03 0.00 0.00 56.01 56.29 3ksc n LEU 386 Cb 0.43 -0.94 -0.13 0.00 -2.33 0.00 0.00 43.42 40.45 3ksc n LEU 386 CO 0.59 0.53 -0.22 -0.54 -1.33 0.00 0.00 177.39 176.42 3ksc s LYS 387 N -2.46 0.15 2.34 3.23 1.02 -1.01 -4.58 119.74 118.44 3ksc s LYS 387 Ca -0.31 0.18 0.00 0.00 0.02 0.00 0.00 55.97 55.85 3ksc s LYS 387 Cb 0.09 0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.47 3ksc s LYS 387 CO 0.59 -0.02 0.00 0.41 -0.92 0.00 0.00 175.35 175.41 3ksc n GLY 388 N 3.02 -0.82 2.93 -3.33 0.00 -1.25 -1.29 105.19 104.44 3ksc n GLY 388 Ca -0.12 -1.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.60 3ksc n GLY 388 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ksc s ARG 389 N 0.00 0.19 0.04 1.61 0.52 -1.26 -1.10 118.95 118.94 3ksc s ARG 389 Ca 0.00 -0.24 0.01 0.00 -0.52 0.00 0.00 55.73 54.98 3ksc s ARG 389 Cb 0.00 -0.07 -0.03 0.00 0.52 0.00 0.00 34.95 35.38 3ksc s ARG 389 CO 0.00 0.01 -0.05 0.00 0.02 0.00 0.00 175.30 175.28 3ksc s ALA 390 N -0.48 0.37 -0.26 2.13 0.00 -0.73 -0.46 121.76 122.33 3ksc s ALA 390 Ca -0.04 -0.78 -0.16 0.00 0.00 0.00 0.00 51.96 50.98 3ksc s ALA 390 Cb -0.04 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 3ksc s ALA 390 CO -0.00 -0.15 0.45 0.50 0.00 0.00 0.00 175.76 176.56 3ksc s ARG 391 N -1.97 4.04 -0.03 0.00 3.52 0.12 0.01 118.95 124.66 3ksc s ARG 391 Ca -0.09 0.19 0.06 0.00 -0.13 0.00 0.00 55.73 55.75 3ksc s ARG 391 Cb -0.07 -3.65 -0.02 0.00 -1.56 0.00 0.00 34.95 29.64 3ksc s ARG 391 CO -0.02 -0.32 -0.19 -0.51 -0.81 0.00 0.00 175.30 173.45 3ksc s LEU 392 N 2.19 2.46 -0.07 -0.88 1.02 0.55 -1.14 118.68 122.82 3ksc s LEU 392 Ca 0.18 -0.33 0.04 0.00 0.02 0.00 0.00 54.13 54.04 3ksc s LEU 392 Cb -0.16 -1.47 -0.00 0.00 0.02 0.00 0.00 46.19 44.59 3ksc s LEU 392 CO 0.09 0.32 -0.21 -1.10 0.02 0.00 0.00 176.35 175.48 3ksc s GLN 393 N -0.79 2.37 -0.04 1.70 -0.21 -0.77 -1.65 119.66 120.28 3ksc s GLN 393 Ca 0.11 -0.74 0.04 0.00 0.02 0.00 0.00 55.36 54.79 3ksc s GLN 393 Cb -0.10 -1.92 -0.00 0.00 1.00 0.00 0.00 33.01 31.98 3ksc s GLN 393 CO 0.01 0.23 -0.14 0.14 -2.12 0.00 0.00 175.29 173.40 3ksc s VAL 394 N 0.18 1.21 0.13 1.09 -7.23 -0.24 -1.55 120.40 113.99 3ksc s VAL 394 Ca -0.10 -0.60 0.11 0.00 -1.81 0.00 0.00 61.98 59.58 3ksc s VAL 394 Cb -0.15 -1.05 -0.04 0.00 0.56 0.00 0.00 36.38 35.70 3ksc s VAL 394 CO 0.05 0.36 -0.26 0.68 -0.31 0.00 0.00 175.10 175.62 3ksc s VAL 395 N 0.06 2.32 0.00 1.32 -7.23 0.21 -1.57 120.40 115.51 3ksc s VAL 395 Ca -0.03 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 3ksc s VAL 395 Cb -0.10 -2.04 0.00 0.00 0.56 0.00 0.00 36.38 34.80 3ksc s VAL 395 CO 0.01 0.08 0.00 -0.46 -0.31 0.00 0.00 175.10 174.42 3ksc n ASN 396 N 0.86 0.01 0.04 4.85 0.23 -1.04 -1.21 115.26 118.99 3ksc n ASN 396 Ca -0.17 -0.44 0.10 0.00 -0.53 0.00 0.00 54.58 53.53 3ksc n ASN 396 Cb 0.53 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.66 3ksc n ASN 396 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ksc n ASN 398 N -1.75 3.21 0.00 0.00 4.13 -1.26 -4.98 115.26 114.62 3ksc n ASN 398 Ca 0.04 -2.58 0.00 0.00 1.68 0.00 0.00 54.58 53.72 3ksc n ASN 398 Cb 0.25 -0.37 0.00 0.00 -1.54 0.00 0.00 39.78 38.11 3ksc n ASN 398 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ksc n GLY 399 N -0.25 0.39 3.82 7.41 0.00 -1.15 -5.01 105.19 110.40 3ksc n GLY 399 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 3ksc n GLY 399 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ksc s ASN 400 N -2.01 6.98 -0.53 1.61 0.02 -1.26 -4.88 114.94 114.87 3ksc s ASN 400 Ca 0.00 1.44 -0.22 0.00 -1.02 0.00 0.00 52.86 53.07 3ksc s ASN 400 Cb 0.00 -2.43 0.05 0.00 0.02 0.00 0.00 41.25 38.89 3ksc s ASN 400 CO 0.00 -0.10 0.78 -0.89 0.02 0.00 0.00 177.10 176.91 3ksc s THR 401 N -1.76 4.64 -0.37 1.60 2.01 -1.26 -2.51 115.64 118.00 3ksc s THR 401 Ca 0.49 -0.10 0.23 0.00 0.31 0.00 0.00 61.69 62.62 3ksc s THR 401 Cb -0.14 -4.41 0.20 0.00 0.01 0.00 0.00 72.50 68.16 3ksc s THR 401 CO 0.19 -0.95 1.39 -0.37 -0.69 0.00 0.00 174.62 174.19 3ksc h VAL 402 N 5.94 0.00 -3.41 3.82 -1.51 -1.50 -3.44 116.25 116.15 3ksc h VAL 402 Ca -0.27 -0.98 -0.21 0.00 -1.23 0.00 0.00 66.70 64.01 3ksc h VAL 402 Cb 1.08 1.78 -0.28 0.00 -2.13 0.00 0.00 31.29 31.75 3ksc h VAL 402 CO 1.02 0.00 -0.58 0.12 -1.23 0.00 0.00 177.57 176.90 3ksc s PHE 403 N -3.27 -0.14 -0.51 5.19 5.36 -1.17 -0.23 117.98 123.22 3ksc s PHE 403 Ca 0.04 0.35 0.07 0.00 -0.96 0.00 0.00 56.93 56.43 3ksc s PHE 403 Cb 0.07 0.02 0.19 0.00 -0.34 0.00 0.00 43.02 42.96 3ksc s PHE 403 CO 0.72 -0.08 0.69 0.34 -1.46 0.00 0.00 175.22 175.42 3ksc s ASP 404 N 0.26 -1.14 0.00 6.13 2.15 -1.24 -1.08 116.67 121.76 3ksc s ASP 404 Ca -0.02 -1.88 0.00 0.00 0.43 0.00 0.00 52.55 51.08 3ksc s ASP 404 Cb -0.03 1.65 0.00 0.00 -0.30 0.00 0.00 42.92 44.24 3ksc s ASP 404 CO -0.01 -0.06 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 3ksc n GLY 405 N 2.94 1.89 3.79 2.66 0.00 -0.66 -4.98 105.19 110.84 3ksc n GLY 405 Ca 0.19 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 3ksc n GLY 405 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ksc s GLU 406 N 1.09 3.91 -0.32 1.61 2.12 -1.26 -0.33 118.70 125.52 3ksc s GLU 406 Ca 0.00 -0.06 -0.00 0.00 0.36 0.00 0.00 54.97 55.27 3ksc s GLU 406 Cb 0.00 -3.32 0.07 0.00 0.26 0.00 0.00 34.13 31.14 3ksc s GLU 406 CO 0.00 0.50 0.03 -1.17 -0.54 0.00 0.00 175.26 174.08 3ksc s LEU 407 N -0.26 4.21 0.27 2.70 2.96 0.10 -4.80 118.68 123.85 3ksc s LEU 407 Ca 0.14 -1.57 0.05 0.00 -0.22 0.00 0.00 54.13 52.53 3ksc s LEU 407 Cb -0.12 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 3ksc s LEU 407 CO 0.03 -0.32 0.39 -1.83 -1.32 0.00 0.00 176.35 173.30 3ksc s GLU 408 N 1.15 3.38 0.18 1.98 -1.05 -1.26 -1.77 118.70 121.31 3ksc s GLU 408 Ca -0.01 -0.77 -0.33 0.00 -0.15 0.00 0.00 54.97 53.70 3ksc s GLU 408 Cb -0.20 -2.86 -0.15 0.00 -0.44 0.00 0.00 34.13 30.48 3ksc s GLU 408 CO -0.03 0.34 1.32 0.00 0.95 0.00 0.00 175.26 177.84 3ksc n ALA 409 N -1.48 0.02 0.00 -0.84 0.00 -0.26 -2.53 120.51 115.43 3ksc n ALA 409 Ca -0.07 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3ksc n ALA 409 Cb 0.57 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.87 3ksc n ALA 409 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ksc n GLY 410 N 2.32 0.21 3.73 0.00 0.00 0.30 -4.97 105.19 106.78 3ksc n GLY 410 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 3ksc n GLY 410 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ksc s ARG 411 N -0.99 2.45 0.02 1.61 0.52 -1.05 -4.81 118.95 116.70 3ksc s ARG 411 Ca 0.00 -1.43 0.07 0.00 -0.52 0.00 0.00 55.73 53.85 3ksc s ARG 411 Cb 0.00 -2.25 -0.02 0.00 0.52 0.00 0.00 34.95 33.20 3ksc s ARG 411 CO 0.00 0.21 -0.21 0.00 0.02 0.00 0.00 175.30 175.31 3ksc s ALA 412 N -2.35 1.81 -0.08 2.13 0.00 -0.52 -1.58 121.76 121.16 3ksc s ALA 412 Ca 0.36 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.31 3ksc s ALA 412 Cb -0.04 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.69 3ksc s ALA 412 CO 0.23 0.42 -0.09 -1.17 0.00 0.00 0.00 175.76 175.15 3ksc s LEU 413 N -0.89 1.38 -0.11 0.00 2.96 0.61 -0.96 118.68 121.67 3ksc s LEU 413 Ca 0.08 -0.27 -0.27 0.00 -0.22 0.00 0.00 54.13 53.45 3ksc s LEU 413 Cb -0.09 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.81 3ksc s LEU 413 CO 0.01 -0.05 0.88 -0.89 -1.32 0.00 0.00 176.35 174.98 3ksc s THR 414 N 1.18 4.88 -0.33 3.68 2.01 -1.26 -0.50 115.64 125.29 3ksc s THR 414 Ca -0.05 1.77 0.01 0.00 0.31 0.00 0.00 61.69 63.73 3ksc s THR 414 Cb -0.14 -4.19 0.08 0.00 0.01 0.00 0.00 72.50 68.26 3ksc s THR 414 CO -0.02 0.07 0.05 -0.69 -0.69 0.00 0.00 174.62 173.34 3ksc s VAL 415 N 1.76 2.64 0.81 3.82 1.01 0.13 -4.99 120.40 125.57 3ksc s VAL 415 Ca 0.43 -1.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.33 3ksc s VAL 415 Cb -0.18 -2.75 0.08 0.00 0.00 0.00 0.00 36.38 33.53 3ksc s VAL 415 CO 0.17 -0.42 1.16 -2.84 0.00 0.00 0.00 175.10 173.17 3ksc s PRO 416 N 1.06 1.75 0.14 2.72 0.02 -1.26 -0.41 135.00 139.02 3ksc s PRO 416 Ca 0.03 1.56 -0.35 0.00 0.02 0.00 0.00 61.00 62.26 3ksc s PRO 416 Cb -0.20 -1.81 -0.15 0.00 0.02 0.00 0.00 34.50 32.36 3ksc s PRO 416 CO -0.05 -2.09 1.47 0.94 -0.33 0.00 0.00 177.00 176.94 3ksc n GLN 417 N -3.44 1.77 0.00 5.54 7.27 -1.21 -2.32 117.38 124.99 3ksc n GLN 417 Ca 0.12 0.64 0.00 0.00 0.07 0.00 0.00 57.00 57.83 3ksc n GLN 417 Cb 0.52 -2.35 0.00 0.00 2.41 0.00 0.00 30.24 30.82 3ksc n GLN 417 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 3ksc n ASN 418 N 2.99 0.00 -4.77 1.69 5.03 -0.44 -4.98 115.26 114.78 3ksc n ASN 418 Ca 0.17 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.21 3ksc n ASN 418 Cb 0.25 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.00 3ksc n ASN 418 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3ksc s TYR 419 N -1.67 2.99 0.20 3.10 1.51 -0.98 -4.81 117.35 117.69 3ksc s TYR 419 Ca 0.00 1.36 -0.12 0.00 -1.01 0.00 0.00 57.07 57.30 3ksc s TYR 419 Cb 0.00 -3.73 -0.07 0.00 -0.11 0.00 0.00 41.96 38.05 3ksc s TYR 419 CO 0.00 -2.04 0.56 0.00 -1.11 0.00 0.00 175.55 172.96 3ksc s ALA 420 N -1.06 3.56 -0.04 3.71 0.00 -0.35 -4.34 121.76 123.24 3ksc s ALA 420 Ca 0.50 -0.20 -0.06 0.00 0.00 0.00 0.00 51.96 52.21 3ksc s ALA 420 Cb -0.41 -2.49 0.01 0.00 0.00 0.00 0.00 23.12 20.24 3ksc s ALA 420 CO 0.54 0.48 0.14 0.54 0.00 0.00 0.00 175.76 177.46 3ksc s VAL 421 N -1.67 0.02 0.09 0.00 0.11 0.68 -0.62 120.40 119.02 3ksc s VAL 421 Ca 0.43 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.30 3ksc s VAL 421 Cb -0.13 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 3ksc s VAL 421 CO 0.20 -0.11 -0.07 0.00 -3.33 0.00 0.00 175.10 171.80 3ksc s ALA 422 N -0.33 0.89 -0.03 1.54 0.00 -0.60 -1.06 121.76 122.18 3ksc s ALA 422 Ca -0.04 -1.25 -0.05 0.00 0.00 0.00 0.00 51.96 50.62 3ksc s ALA 422 Cb -0.03 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.24 3ksc s ALA 422 CO 0.01 -0.21 0.12 0.00 0.00 0.00 0.00 175.76 175.68 3ksc s ALA 423 N -3.29 -0.30 -0.09 0.00 0.00 -1.19 -1.85 121.76 115.03 3ksc s ALA 423 Ca 0.08 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.22 3ksc s ALA 423 Cb 0.03 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.07 3ksc s ALA 423 CO -0.04 -0.11 -0.11 0.21 0.00 0.00 0.00 175.76 175.71 3ksc s LYS 424 N -0.46 1.69 0.18 0.00 2.20 -0.29 -1.87 119.74 121.20 3ksc s LYS 424 Ca -0.05 -0.36 -0.31 0.00 -0.36 0.00 0.00 55.97 54.89 3ksc s LYS 424 Cb -0.04 -1.55 -0.09 0.00 -1.51 0.00 0.00 37.83 34.64 3ksc s LYS 424 CO 0.01 -0.12 1.41 0.45 -0.36 0.00 0.00 175.35 176.74 3ksc s SER 425 N 1.18 6.76 0.00 1.43 0.15 -0.13 -0.70 113.70 122.38 3ksc s SER 425 Ca -0.05 2.49 0.18 0.00 0.70 0.00 0.00 55.95 59.28 3ksc s SER 425 Cb -0.14 -2.60 0.27 0.00 -1.71 0.00 0.00 66.02 61.84 3ksc s SER 425 CO -0.03 -0.66 1.21 0.18 1.20 0.00 0.00 173.24 175.14 3ksc n LEU 426 N 3.12 2.90 -4.40 3.45 4.77 0.39 -1.02 117.00 126.20 3ksc n LEU 426 Ca 0.09 -1.35 -0.20 0.00 -0.03 0.00 0.00 56.01 54.52 3ksc n LEU 426 Cb 0.41 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 3ksc n LEU 426 CO 0.59 0.60 -0.41 -0.44 -1.33 0.00 0.00 177.39 176.41 3ksc s SER 427 N -1.36 2.79 0.41 -1.43 0.01 -1.21 -4.90 113.70 108.01 3ksc s SER 427 Ca 0.28 -1.11 0.19 0.00 1.31 0.00 0.00 55.95 56.62 3ksc s SER 427 Cb 0.17 -0.17 1.11 0.00 0.21 0.00 0.00 66.02 67.34 3ksc s SER 427 CO 0.24 -0.24 1.80 -0.78 0.41 0.00 0.00 173.24 174.67 3ksc h ASP 428 N 2.38 0.42 -2.67 2.44 -0.00 -1.93 -2.99 116.42 114.08 3ksc h ASP 428 Ca -0.39 0.07 -0.24 0.00 -0.00 0.00 0.00 57.03 56.46 3ksc h ASP 428 Cb 1.23 -0.00 -0.33 0.00 -0.00 0.00 0.00 39.33 40.22 3ksc h ASP 428 CO 0.65 0.11 -0.56 -0.13 -0.00 0.00 0.00 179.24 179.31 3ksc s ARG 429 N -5.46 0.18 -0.18 0.28 1.81 -1.26 -3.05 118.95 111.27 3ksc s ARG 429 Ca -0.08 0.56 -0.07 0.00 -1.72 0.00 0.00 55.73 54.42 3ksc s ARG 429 Cb 0.24 -0.44 -0.04 0.00 -0.45 0.00 0.00 34.95 34.27 3ksc s ARG 429 CO 0.79 -0.43 0.04 0.12 -0.68 0.00 0.00 175.30 175.14 3ksc s PHE 430 N 2.40 3.19 0.07 -0.53 5.36 0.07 -3.87 117.98 124.67 3ksc s PHE 430 Ca 0.04 -0.03 0.01 0.00 -0.96 0.00 0.00 56.93 55.99 3ksc s PHE 430 Cb -0.13 -2.06 -0.04 0.00 -0.34 0.00 0.00 43.02 40.45 3ksc s PHE 430 CO -0.10 0.09 -0.06 -1.54 -1.46 0.00 0.00 175.22 172.15 3ksc s SER 431 N 0.41 0.94 0.17 6.13 1.04 -0.41 0.57 113.70 122.54 3ksc s SER 431 Ca 0.01 -0.86 -0.23 0.00 0.48 0.00 0.00 55.95 55.35 3ksc s SER 431 Cb -0.13 0.09 0.07 0.00 0.10 0.00 0.00 66.02 66.15 3ksc s SER 431 CO 0.01 -0.40 0.63 -0.72 0.98 0.00 0.00 173.24 173.74 3ksc s TYR 432 N -2.96 -0.49 -0.06 5.02 1.13 -0.04 0.22 117.35 120.17 3ksc s TYR 432 Ca 0.04 0.25 0.05 0.00 -1.41 0.00 0.00 57.07 56.00 3ksc s TYR 432 Cb 0.01 0.58 -0.01 0.00 -1.10 0.00 0.00 41.96 41.44 3ksc s TYR 432 CO -0.04 -0.88 -0.23 0.54 -2.51 0.00 0.00 175.55 172.43 3ksc s VAL 433 N -3.74 1.88 -0.24 -3.49 0.11 -0.68 -0.28 120.40 113.97 3ksc s VAL 433 Ca 0.02 -0.96 -0.05 0.00 -2.93 0.00 0.00 61.98 58.07 3ksc s VAL 433 Cb -0.02 -1.61 -0.01 0.00 -1.53 0.00 0.00 36.38 33.21 3ksc s VAL 433 CO -0.10 0.52 0.01 0.00 -3.33 0.00 0.00 175.10 172.20 3ksc s ALA 434 N 0.03 2.95 -0.02 1.54 0.00 0.25 -1.03 121.76 125.48 3ksc s ALA 434 Ca -0.07 -1.19 -0.23 0.00 0.00 0.00 0.00 51.96 50.47 3ksc s ALA 434 Cb -0.14 -1.87 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 3ksc s ALA 434 CO 0.05 -0.50 0.68 -0.06 0.00 0.00 0.00 175.76 175.93 3ksc s PHE 435 N 1.52 3.65 -0.00 0.00 0.08 -0.08 -0.97 117.98 122.18 3ksc s PHE 435 Ca 0.06 1.29 0.07 0.00 0.12 0.00 0.00 56.93 58.46 3ksc s PHE 435 Cb -0.15 -2.75 -0.02 0.00 -0.57 0.00 0.00 43.02 39.53 3ksc s PHE 435 CO -0.00 0.22 -0.21 0.15 -0.10 0.00 0.00 175.22 175.27 3ksc s LYS 436 N 0.28 1.65 -0.29 0.44 1.02 -0.32 -0.79 119.74 121.73 3ksc s LYS 436 Ca 0.36 -0.80 -0.05 0.00 0.02 0.00 0.00 55.97 55.50 3ksc s LYS 436 Cb -0.19 -1.63 -0.08 0.00 -0.52 0.00 0.00 37.83 35.41 3ksc s LYS 436 CO 0.19 0.44 3.14 0.25 -0.92 0.00 0.00 175.35 178.45 3ksc n THR 437 N 2.41 3.23 -3.64 2.17 -2.24 -0.74 -1.62 114.28 113.86 3ksc n THR 437 Ca -0.16 -2.37 -0.09 0.00 -2.27 0.00 0.00 64.05 59.16 3ksc n THR 437 Cb 0.53 -1.79 -0.07 0.00 -2.10 0.00 0.00 70.33 66.89 3ksc n THR 437 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ksc s ASN 438 N 1.09 -0.64 0.11 3.42 3.84 -1.09 -4.65 114.94 117.02 3ksc s ASN 438 Ca 0.63 1.15 0.21 0.00 0.21 0.00 0.00 52.86 55.06 3ksc s ASN 438 Cb 0.35 1.20 0.86 0.00 -0.55 0.00 0.00 41.25 43.11 3ksc s ASN 438 CO -0.12 -0.19 1.66 -0.90 -2.79 0.00 0.00 177.10 174.76 3ksc n ASP 439 N 2.98 0.32 -3.17 -4.21 5.75 -1.24 -3.00 116.55 113.98 3ksc n ASP 439 Ca -0.15 0.56 -0.22 0.00 -0.01 0.00 0.00 54.79 54.97 3ksc n ASP 439 Cb 0.56 -0.63 -0.05 0.00 -1.03 0.00 0.00 41.12 39.97 3ksc n ASP 439 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3ksc n ARG 440 N -1.83 1.48 -2.03 0.11 5.12 -1.26 -1.96 116.66 116.28 3ksc n ARG 440 Ca 0.04 -3.74 -0.43 0.00 -1.93 0.00 0.00 57.85 51.79 3ksc n ARG 440 Cb 0.25 -1.73 -0.03 0.00 -1.16 0.00 0.00 32.46 29.79 3ksc n ARG 440 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3ksc s ALA 441 N -2.30 3.41 -0.00 7.54 0.00 -1.20 -4.98 121.76 124.24 3ksc s ALA 441 Ca 0.40 0.73 -0.15 0.00 0.00 0.00 0.00 51.96 52.94 3ksc s ALA 441 Cb 0.27 -3.81 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 3ksc s ALA 441 CO -0.09 -1.72 0.41 0.20 0.00 0.00 0.00 175.76 174.56 3ksc s GLY 442 N 4.04 2.48 0.01 0.00 0.00 -1.26 -5.04 107.32 107.55 3ksc s GLY 442 Ca 0.74 -0.21 0.03 0.00 0.00 0.00 0.00 44.72 45.28 3ksc s GLY 442 CO 0.30 0.17 -0.05 -0.26 0.00 0.00 0.00 173.10 173.25 3ksc s ILE 443 N -1.03 3.73 -0.25 0.90 -4.36 -1.26 -1.47 121.20 117.47 3ksc s ILE 443 Ca 0.24 -0.77 -0.07 0.00 -0.26 0.00 0.00 60.65 59.79 3ksc s ILE 443 Cb -0.17 -2.64 -0.02 0.00 1.25 0.00 0.00 42.46 40.88 3ksc s ILE 443 CO 0.13 0.37 0.05 0.00 0.24 0.00 0.00 174.94 175.74 3ksc s ALA 444 N -1.03 3.10 -0.01 2.27 0.00 0.13 -4.91 121.76 121.31 3ksc s ALA 444 Ca 0.18 -1.15 -0.23 0.00 0.00 0.00 0.00 51.96 50.76 3ksc s ALA 444 Cb -0.11 -2.02 -0.05 0.00 0.00 0.00 0.00 23.12 20.94 3ksc s ALA 444 CO 0.09 -0.50 0.69 1.03 0.00 0.00 0.00 175.76 177.06 3ksc s ARG 445 N 1.59 4.42 0.06 0.00 0.52 -1.26 -1.31 118.95 122.96 3ksc s ARG 445 Ca 0.06 0.90 0.23 0.00 -0.52 0.00 0.00 55.73 56.39 3ksc s ARG 445 Cb -0.15 -3.38 -0.02 0.00 0.52 0.00 0.00 34.95 31.92 3ksc s ARG 445 CO 0.02 0.25 0.95 1.28 0.02 0.00 0.00 175.30 177.82 3ksc n LEU 446 N 3.07 0.57 -4.00 2.53 4.32 0.25 0.51 117.00 124.24 3ksc n LEU 446 Ca -0.04 0.02 -0.10 0.00 -0.02 0.00 0.00 56.01 55.88 3ksc n LEU 446 Cb 0.51 -0.07 -0.07 0.00 -1.62 0.00 0.00 43.42 42.16 3ksc n LEU 446 CO 0.46 0.01 -0.05 0.00 -1.22 0.00 0.00 177.39 176.59 3ksc s ALA 447 N -3.26 0.17 0.00 -1.18 0.00 -1.24 -4.55 121.76 111.70 3ksc s ALA 447 Ca 0.01 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.96 3ksc s ALA 447 Cb 0.14 0.92 0.00 0.00 0.00 0.00 0.00 23.12 24.18 3ksc s ALA 447 CO 0.82 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.34 3ksc n GLY 448 N -0.22 -3.51 0.32 0.00 0.00 -1.26 -4.46 105.19 96.06 3ksc n GLY 448 Ca -0.06 -2.00 -0.05 0.00 0.00 0.00 0.00 46.02 43.92 3ksc n GLY 448 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ksc h THR 449 N 0.00 1.25 -0.50 2.61 2.02 -1.43 -2.72 112.91 114.14 3ksc h THR 449 Ca 0.00 -0.84 0.00 0.00 0.77 0.00 0.00 66.41 66.34 3ksc h THR 449 Cb 0.00 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3ksc h THR 449 CO 0.00 0.33 0.00 -1.20 0.37 0.00 0.00 175.52 175.02 3ksc n SER 450 N -4.27 4.73 -4.74 4.18 7.64 -1.26 -4.86 113.62 115.04 3ksc n SER 450 Ca 0.06 -2.67 -0.32 0.00 1.01 0.00 0.00 58.87 56.96 3ksc n SER 450 Cb 0.21 -0.62 0.10 0.00 -1.01 0.00 0.00 64.21 62.89 3ksc n SER 450 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3ksc s SER 451 N -0.70 4.23 0.26 6.43 1.04 -1.03 -4.67 113.70 119.26 3ksc s SER 451 Ca 0.45 1.97 -0.02 0.00 0.48 0.00 0.00 55.95 58.83 3ksc s SER 451 Cb 0.33 -2.54 0.52 0.00 0.10 0.00 0.00 66.02 64.43 3ksc s SER 451 CO 0.15 -2.22 1.74 0.58 0.98 0.00 0.00 173.24 174.47 3ksc h VAL 452 N -1.05 0.67 -0.73 5.02 2.07 -0.20 -2.20 116.25 119.83 3ksc h VAL 452 Ca -0.44 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 3ksc h VAL 452 Cb 1.25 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3ksc h VAL 452 CO 0.49 0.09 0.33 0.40 0.02 0.00 0.00 177.57 178.90 3ksc h ILE 453 N 0.51 1.24 0.00 4.57 2.04 -1.81 -1.83 117.51 122.24 3ksc h ILE 453 Ca 0.45 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 3ksc h ILE 453 Cb 0.68 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 3ksc h ILE 453 CO -0.40 0.29 -0.09 0.78 0.00 0.00 0.00 178.15 178.73 3ksc h ASN 454 N 1.03 0.00 -0.12 1.72 -0.26 -1.72 -2.70 115.58 113.52 3ksc h ASN 454 Ca 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.99 3ksc h ASN 454 Cb 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 3ksc h ASN 454 CO -0.03 0.09 0.00 0.59 -1.06 0.00 0.00 177.43 177.02 3ksc n ASN 455 N -4.26 2.11 -4.85 5.81 4.13 -0.72 -4.83 115.26 112.65 3ksc n ASN 455 Ca -0.03 -1.73 -0.34 0.00 1.68 0.00 0.00 54.58 54.16 3ksc n ASN 455 Cb 0.17 -0.07 -0.06 0.00 -1.54 0.00 0.00 39.78 38.28 3ksc n ASN 455 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ksc s LEU 456 N -1.78 4.28 0.51 3.41 1.43 -1.02 -5.06 118.68 120.45 3ksc s LEU 456 Ca 0.34 1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 54.26 3ksc s LEU 456 Cb 0.20 -3.42 -0.06 0.00 0.03 0.00 0.00 46.19 42.94 3ksc s LEU 456 CO 0.30 0.04 1.33 -2.84 0.23 0.00 0.00 176.35 175.41 3ksc s PRO 457 N -2.25 3.36 0.19 1.29 0.02 -1.26 -4.82 135.00 131.53 3ksc s PRO 457 Ca 0.41 2.17 -0.18 0.00 0.02 0.00 0.00 61.00 63.42 3ksc s PRO 457 Cb -0.14 -2.36 0.14 0.00 0.02 0.00 0.00 34.50 32.17 3ksc s PRO 457 CO 0.20 -0.99 1.62 1.25 -0.33 0.00 0.00 177.00 178.74 3ksc h LEU 458 N 1.73 -0.78 -1.45 -5.54 5.85 -1.94 -1.87 115.31 111.31 3ksc h LEU 458 Ca -0.51 0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 3ksc h LEU 458 Cb 1.28 0.43 -0.01 0.00 0.37 0.00 0.00 40.66 42.73 3ksc h LEU 458 CO 0.58 -0.25 0.01 0.44 -0.34 0.00 0.00 178.44 178.89 3ksc h ASP 459 N -0.11 0.34 1.13 1.25 3.32 -1.97 -0.70 116.42 119.67 3ksc h ASP 459 Ca 0.24 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 57.11 3ksc h ASP 459 Cb 0.48 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 3ksc h ASP 459 CO -0.58 0.39 -0.61 -0.37 -1.72 0.00 0.00 179.24 176.35 3ksc h VAL 460 N 0.36 1.14 0.14 -1.35 -1.51 -1.76 -1.22 116.25 112.04 3ksc h VAL 460 Ca 0.08 -2.34 -0.01 0.00 -1.23 0.00 0.00 66.70 63.20 3ksc h VAL 460 Cb 0.22 2.38 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 3ksc h VAL 460 CO 0.00 0.60 -0.07 0.58 -1.23 0.00 0.00 177.57 177.45 3ksc h VAL 461 N 0.00 0.95 -0.49 7.19 2.07 -0.55 0.45 116.25 125.87 3ksc h VAL 461 Ca -0.01 -0.34 0.04 0.00 0.82 0.00 0.00 66.70 67.21 3ksc h VAL 461 Cb 1.34 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 3ksc h VAL 461 CO 0.08 0.08 0.25 0.00 0.02 0.00 0.00 177.57 178.01 3ksc h ALA 462 N 0.49 0.62 -0.44 1.67 0.00 -1.09 -2.39 119.26 118.14 3ksc h ALA 462 Ca -0.02 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3ksc h ALA 462 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ksc h ALA 462 CO 0.03 -0.09 -0.22 0.00 0.00 0.00 0.00 179.25 178.97 3ksc h ALA 463 N 1.25 0.78 0.04 0.00 0.00 -1.22 0.18 119.26 120.29 3ksc h ALA 463 Ca 0.21 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3ksc h ALA 463 Cb 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3ksc h ALA 463 CO -0.14 0.66 -0.02 1.15 0.00 0.00 0.00 179.25 180.90 3ksc h THR 464 N 0.77 1.00 -0.21 0.00 2.02 -0.51 -3.09 112.91 112.89 3ksc h THR 464 Ca 0.10 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3ksc h THR 464 Cb 0.77 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 3ksc h THR 464 CO 0.06 0.03 0.00 0.49 0.37 0.00 0.00 175.52 176.48 3ksc n PHE 465 N -5.09 0.25 -3.49 3.16 3.72 -0.93 -4.96 117.46 110.12 3ksc n PHE 465 Ca -0.08 -0.12 -0.19 0.00 -0.05 0.00 0.00 57.45 57.01 3ksc n PHE 465 Cb 0.07 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.68 3ksc n PHE 465 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3ksc n ASN 466 N 1.22 -2.60 -4.77 4.37 5.15 -0.42 -5.03 115.26 113.17 3ksc n ASN 466 Ca 0.17 -0.71 -0.22 0.00 -0.60 0.00 0.00 54.58 53.22 3ksc n ASN 466 Cb 0.56 -4.75 -0.05 0.00 -0.53 0.00 0.00 39.78 35.00 3ksc n ASN 466 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3ksc s LEU 467 N -6.31 3.61 0.42 1.20 1.43 -0.08 -5.03 118.68 113.91 3ksc s LEU 467 Ca 0.09 -0.39 -0.21 0.00 -1.03 0.00 0.00 54.13 52.58 3ksc s LEU 467 Cb -0.02 -2.14 -0.11 0.00 0.03 0.00 0.00 46.19 43.96 3ksc s LEU 467 CO 0.76 -0.05 0.95 -1.10 0.23 0.00 0.00 176.35 177.15 3ksc s GLN 468 N -3.80 4.25 0.26 1.70 -0.21 -1.26 -4.55 119.66 116.05 3ksc s GLN 468 Ca 0.33 1.15 0.01 0.00 0.02 0.00 0.00 55.36 56.87 3ksc s GLN 468 Cb -0.07 -2.24 0.62 0.00 1.00 0.00 0.00 33.01 32.32 3ksc s GLN 468 CO 0.23 -0.01 1.31 0.54 -2.12 0.00 0.00 175.29 175.24 3ksc n ARG 469 N -0.53 -0.07 0.07 2.91 1.74 -1.26 -0.60 116.66 118.93 3ksc n ARG 469 Ca 0.07 1.25 -0.06 0.00 -0.77 0.00 0.00 57.85 58.33 3ksc n ARG 469 Cb 0.54 -1.98 0.09 0.00 -1.02 0.00 0.00 32.46 30.08 3ksc n ARG 469 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3ksc h ASN 470 N 0.00 0.33 -0.43 0.55 2.35 -2.00 -1.41 115.58 114.98 3ksc h ASN 470 Ca 0.50 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.97 3ksc h ASN 470 Cb 1.01 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.26 3ksc h ASN 470 CO -0.79 0.89 0.00 -0.33 -1.65 0.00 0.00 177.43 175.55 3ksc h GLU 471 N 0.20 0.83 -0.72 0.81 5.08 -1.22 -2.60 114.58 116.96 3ksc h GLU 471 Ca -0.01 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.07 3ksc h GLU 471 Cb 1.18 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 3ksc h GLU 471 CO 0.10 0.83 0.27 0.00 -1.00 0.00 0.00 179.01 179.21 3ksc h ALA 472 N 1.23 1.10 -0.82 3.43 0.00 -0.82 -1.70 119.26 121.68 3ksc h ALA 472 Ca 0.15 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3ksc h ALA 472 Cb 0.46 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3ksc h ALA 472 CO 0.02 0.63 0.54 0.00 0.00 0.00 0.00 179.25 180.44 3ksc h ARG 473 N 1.06 1.05 -0.54 0.00 3.08 -0.99 -1.73 114.38 116.31 3ksc h ARG 473 Ca 0.24 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 3ksc h ARG 473 Cb 0.24 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3ksc h ARG 473 CO -0.02 0.69 0.00 1.96 -1.07 0.00 0.00 179.97 181.54 3ksc h GLN 474 N 1.08 0.91 -0.31 0.04 4.20 -1.11 -1.27 115.11 118.64 3ksc h GLN 474 Ca 0.31 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3ksc h GLN 474 Cb -0.07 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 3ksc h GLN 474 CO -0.09 0.90 0.21 1.25 -0.67 0.00 0.00 178.83 180.43 3ksc h LEU 475 N 0.84 0.27 0.20 1.46 5.85 -0.45 -1.79 115.31 121.68 3ksc h LEU 475 Ca 0.16 -0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.56 3ksc h LEU 475 Cb 0.49 -0.06 0.02 0.00 0.37 0.00 0.00 40.66 41.48 3ksc h LEU 475 CO 0.02 0.19 -1.50 0.11 -0.34 0.00 0.00 178.44 176.91 3ksc h LYS 476 N 0.31 0.42 0.00 1.25 1.57 -1.01 -3.42 116.57 115.69 3ksc h LYS 476 Ca 0.13 -0.71 -0.28 0.00 -1.87 0.00 0.00 60.65 57.92 3ksc h LYS 476 Cb 0.13 0.26 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 3ksc h LYS 476 CO -0.03 1.34 -1.97 0.43 -0.57 0.00 0.00 179.45 178.65 3ksc n SER 477 N -3.75 0.42 0.26 0.86 7.64 -0.52 -4.55 113.62 113.99 3ksc n SER 477 Ca -0.21 0.19 0.14 0.00 1.01 0.00 0.00 58.87 60.01 3ksc n SER 477 Cb 1.03 0.62 0.70 0.00 -1.01 0.00 0.00 64.21 65.55 3ksc n SER 477 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 3ksc h ASN 478 N 0.00 0.00 -3.62 6.43 4.21 -1.58 -3.37 115.58 117.66 3ksc h ASN 478 Ca -0.35 0.00 -0.69 0.00 1.21 0.00 0.00 56.30 56.47 3ksc h ASN 478 Cb 1.94 0.00 -0.23 0.00 -1.12 0.00 0.00 38.32 38.92 3ksc h ASN 478 CO 0.04 0.10 -0.52 0.21 -1.29 0.00 0.00 177.43 175.98 3ksc s ASN 479 N -5.93 5.75 0.00 5.81 2.47 -1.26 -4.97 114.94 116.81 3ksc s ASN 479 Ca -0.01 -0.75 0.28 0.00 0.42 0.00 0.00 52.86 52.80 3ksc s ASN 479 Cb 0.11 -2.04 1.11 0.00 -1.45 0.00 0.00 41.25 38.98 3ksc s ASN 479 CO 0.57 -0.31 1.82 -2.65 -3.72 0.00 0.00 177.10 172.81 3ksc n PRO 480 N 5.02 0.13 -4.00 0.43 -0.02 -1.26 -4.13 135.00 131.18 3ksc n PRO 480 Ca -0.13 -0.03 -0.31 0.00 -2.02 0.00 0.00 63.50 61.02 3ksc n PRO 480 Cb 0.48 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.40 3ksc n PRO 480 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3ksc s PHE 481 N -2.89 3.33 0.00 6.00 0.08 -1.26 -4.72 117.98 118.53 3ksc s PHE 481 Ca 0.17 0.16 -0.05 0.00 0.12 0.00 0.00 56.93 57.33 3ksc s PHE 481 Cb 0.19 -1.69 -0.03 0.00 -0.57 0.00 0.00 43.02 40.92 3ksc s PHE 481 CO 0.55 0.55 0.77 -0.22 -0.10 0.00 0.00 175.22 176.78 3ksc h LYS 482 N 3.30 -0.19 0.00 0.44 3.64 -1.93 -1.73 116.57 120.10 3ksc h LYS 482 Ca -0.46 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 3ksc h LYS 482 Cb 1.16 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 3ksc h LYS 482 CO 0.70 -0.13 -0.82 0.34 -2.27 0.00 0.00 179.45 177.27 3ksc n PHE 483 N -2.71 0.00 -3.58 1.91 7.35 -1.26 -3.91 117.46 115.26 3ksc n PHE 483 Ca -0.02 0.00 -0.37 0.00 -0.76 0.00 0.00 57.45 56.29 3ksc n PHE 483 Cb 0.08 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 39.85 3ksc n PHE 483 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 3ksc s LEU 484 N -4.50 4.39 -0.21 -2.13 1.02 -1.26 -1.72 118.68 114.28 3ksc s LEU 484 Ca 0.00 0.75 0.02 0.00 0.02 0.00 0.00 54.13 54.92 3ksc s LEU 484 Cb 0.00 -2.44 0.04 0.00 0.02 0.00 0.00 46.19 43.81 3ksc s LEU 484 CO 0.00 0.27 -0.16 0.54 0.02 0.00 0.00 176.35 177.03 3ksc s VAL 485 N -0.61 2.05 0.90 -1.59 0.11 -0.16 -4.76 120.40 116.33 3ksc s VAL 485 Ca 0.20 -1.20 -0.13 0.00 -2.93 0.00 0.00 61.98 57.92 3ksc s VAL 485 Cb -0.15 -1.99 0.05 0.00 -1.53 0.00 0.00 36.38 32.76 3ksc s VAL 485 CO 0.09 0.29 0.65 -2.65 -3.33 0.00 0.00 175.10 170.14 3ksc n PRO 486 N 4.56 -0.20 -1.80 1.54 -0.02 -1.26 -2.00 135.00 135.81 3ksc n PRO 486 Ca -0.18 -0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.88 3ksc n PRO 486 Cb 0.47 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 3ksc n PRO 486 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ksc s ALA 487 N -2.35 3.76 0.76 3.55 0.00 -1.26 -4.76 121.76 121.47 3ksc s ALA 487 Ca 0.62 1.54 -0.15 0.00 0.00 0.00 0.00 51.96 53.97 3ksc s ALA 487 Cb -0.24 -3.64 0.04 0.00 0.00 0.00 0.00 23.12 19.27 3ksc s ALA 487 CO 0.63 -0.94 1.07 2.89 0.00 0.00 0.00 175.76 179.41 3ksc n ARG 488 N 2.54 0.41 -0.15 0.00 1.85 -1.26 -5.01 116.66 115.04 3ksc n ARG 488 Ca 0.09 0.21 0.00 0.00 -1.00 0.00 0.00 57.85 57.15 3ksc n ARG 488 Cb 0.37 -2.33 0.00 0.00 -1.05 0.00 0.00 32.46 29.46 3ksc n ARG 488 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71