#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kyc n GLY 10 N 0.00 5.78 3.80 -0.02 0.00 -1.26 -4.93 105.19 108.55 3kyc n GLY 10 Ca 0.00 -2.63 -0.22 0.00 0.00 0.00 0.00 46.02 43.17 3kyc n GLY 10 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kyc s ILE 11 N -5.31 3.90 0.74 -0.61 -4.36 -1.26 -5.13 121.20 109.17 3kyc s ILE 11 Ca 0.50 -1.50 -0.11 0.00 -0.26 0.00 0.00 60.65 59.27 3kyc s ILE 11 Cb 0.42 -3.22 0.03 0.00 1.25 0.00 0.00 42.46 40.94 3kyc s ILE 11 CO -0.29 -0.29 1.09 -0.94 0.24 0.00 0.00 174.94 174.74 3kyc s SER 12 N -3.86 5.10 0.49 4.36 1.04 -1.26 -4.84 113.70 114.73 3kyc s SER 12 Ca 0.35 1.29 0.25 0.00 0.48 0.00 0.00 55.95 58.32 3kyc s SER 12 Cb -0.07 -2.09 1.30 0.00 0.10 0.00 0.00 66.02 65.26 3kyc s SER 12 CO 0.24 -1.58 2.02 -0.33 0.98 0.00 0.00 173.24 174.57 3kyc h GLU 13 N -0.82 0.00 -0.39 4.02 5.08 -1.99 -0.94 114.58 119.53 3kyc h GLU 13 Ca -0.46 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.85 3kyc h GLU 13 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3kyc h GLU 13 CO 0.61 0.16 0.04 1.49 -1.00 0.00 0.00 179.01 180.30 3kyc h GLU 14 N 0.00 0.67 -0.26 2.33 4.81 -2.01 -2.58 114.58 117.54 3kyc h GLU 14 Ca -0.00 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 58.92 3kyc h GLU 14 Cb 0.40 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 3kyc h GLU 14 CO 0.02 0.74 -0.29 0.93 -0.73 0.00 0.00 179.01 179.68 3kyc h GLU 15 N 0.51 0.66 -0.95 1.92 5.08 -1.79 -2.58 114.58 117.42 3kyc h GLU 15 Ca 0.12 -0.36 0.14 0.00 -1.00 0.00 0.00 59.36 58.26 3kyc h GLU 15 Cb 0.41 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.59 3kyc h GLU 15 CO 0.01 0.97 0.56 0.00 -1.00 0.00 0.00 179.01 179.55 3kyc h ALA 16 N 0.68 1.47 -0.04 3.43 0.00 -1.10 0.18 119.26 123.88 3kyc h ALA 16 Ca 0.04 0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.78 3kyc h ALA 16 Cb 0.86 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.54 3kyc h ALA 16 CO 0.07 0.06 -0.90 0.00 0.00 0.00 0.00 179.25 178.48 3kyc h ALA 17 N 1.57 0.34 0.04 0.00 0.00 -1.22 -2.54 119.26 117.44 3kyc h ALA 17 Ca 0.50 -0.67 -0.22 0.00 0.00 0.00 0.00 54.91 54.53 3kyc h ALA 17 Cb 0.63 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3kyc h ALA 17 CO -0.32 0.75 -1.01 -0.56 0.00 0.00 0.00 179.25 178.10 3kyc h GLN 18 N 0.34 0.14 -0.30 0.00 3.07 -1.04 -3.21 115.11 114.11 3kyc h GLN 18 Ca -0.08 -0.20 0.00 0.00 0.09 0.00 0.00 58.65 58.46 3kyc h GLN 18 Cb 1.52 0.07 0.00 0.00 0.08 0.00 0.00 27.48 29.15 3kyc h GLN 18 CO 0.17 1.03 0.00 0.66 0.09 0.00 0.00 178.83 180.78 3kyc n TYR 19 N -3.52 0.40 -0.06 0.06 0.53 0.59 -4.52 117.16 110.63 3kyc n TYR 19 Ca -0.04 -0.20 -0.09 0.00 -1.02 0.00 0.00 57.90 56.55 3kyc n TYR 19 Cb 0.91 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 39.19 3kyc n TYR 19 CO 0.00 0.00 0.00 0.22 -1.02 0.00 0.00 176.86 176.06 3kyc h ASP 20 N 2.11 -1.04 0.84 7.72 1.82 -1.46 0.16 116.42 126.57 3kyc h ASP 20 Ca 0.00 0.17 -0.03 0.00 -0.39 0.00 0.00 57.03 56.78 3kyc h ASP 20 Cb 0.48 0.47 -0.00 0.00 0.68 0.00 0.00 39.33 40.95 3kyc h ASP 20 CO 0.00 -0.34 -0.15 0.03 -1.61 0.00 0.00 179.24 177.17 3kyc h ARG 21 N -0.32 0.00 0.15 0.28 2.47 -1.86 -1.68 114.38 113.43 3kyc h ARG 21 Ca 0.13 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.52 3kyc h ARG 21 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 3kyc h ARG 21 CO -0.45 0.15 -1.69 -0.56 0.56 0.00 0.00 179.97 177.98 3kyc h GLN 22 N 0.00 0.33 -0.54 0.04 3.07 -1.60 -3.29 115.11 113.11 3kyc h GLN 22 Ca -0.00 -0.56 0.08 0.00 0.09 0.00 0.00 58.65 58.26 3kyc h GLN 22 Cb 0.62 0.21 -0.03 0.00 0.08 0.00 0.00 27.48 28.35 3kyc h GLN 22 CO 0.02 1.22 0.36 0.82 0.09 0.00 0.00 178.83 181.34 3kyc h ILE 23 N 0.09 0.94 0.00 1.86 2.04 -0.35 0.38 117.51 122.47 3kyc h ILE 23 Ca -0.31 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.40 3kyc h ILE 23 Cb 2.07 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 3kyc h ILE 23 CO 0.16 0.08 0.00 0.03 0.00 0.00 0.00 178.15 178.42 3kyc h ARG 24 N 0.42 0.00 0.00 2.37 3.08 -1.44 0.34 114.38 119.16 3kyc h ARG 24 Ca 0.24 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.20 3kyc h ARG 24 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3kyc h ARG 24 CO -0.06 0.00 -0.53 1.25 -1.07 0.00 0.00 179.97 179.56 3kyc h LEU 25 N 0.00 0.00 -1.20 3.04 5.85 -0.45 -3.44 115.31 119.11 3kyc h LEU 25 Ca 0.00 -0.68 0.00 0.00 0.84 0.00 0.00 57.88 58.04 3kyc h LEU 25 Cb 0.68 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3kyc h LEU 25 CO 0.00 1.15 0.00 -2.67 -0.34 0.00 0.00 178.44 176.58 3kyc n TRP 26 N -4.55 0.00 0.00 1.25 2.14 0.27 -5.12 117.44 111.42 3kyc n TRP 26 Ca -0.18 -0.08 0.00 0.00 2.07 0.00 0.00 57.50 59.31 3kyc n TRP 26 Cb 0.52 -0.01 0.00 0.00 -0.81 0.00 0.00 31.31 31.01 3kyc n TRP 26 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3kyc n GLY 27 N -0.08 -1.39 0.31 -1.67 0.00 0.12 -4.14 105.19 98.34 3kyc n GLY 27 Ca 0.00 -1.57 -0.08 0.00 0.00 0.00 0.00 46.02 44.37 3kyc n GLY 27 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kyc h LEU 28 N 0.00 1.02 -0.19 0.99 6.46 -1.95 -2.91 115.31 118.74 3kyc h LEU 28 Ca 0.00 -0.28 0.04 0.00 -0.12 0.00 0.00 57.88 57.53 3kyc h LEU 28 Cb 0.00 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 39.62 3kyc h LEU 28 CO 0.00 1.06 -0.07 -0.33 -0.62 0.00 0.00 178.44 178.48 3kyc h GLU 29 N 0.96 -0.04 -0.75 1.25 4.39 -1.97 0.27 114.58 118.69 3kyc h GLU 29 Ca 0.18 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 3kyc h GLU 29 Cb 0.52 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.15 3kyc h GLU 29 CO 0.03 -0.03 0.46 0.00 -1.16 0.00 0.00 179.01 178.31 3kyc h ALA 30 N 1.13 0.96 0.00 3.43 0.00 -1.71 -0.64 119.26 122.43 3kyc h ALA 30 Ca 0.10 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3kyc h ALA 30 Cb 0.19 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3kyc h ALA 30 CO -0.22 0.41 -0.38 0.37 0.00 0.00 0.00 179.25 179.44 3kyc h GLN 31 N 1.03 0.00 -0.12 0.00 5.75 -1.22 -0.91 115.11 119.64 3kyc h GLN 31 Ca 0.27 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.66 3kyc h GLN 31 Cb -0.05 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 3kyc h GLN 31 CO -0.05 0.38 -0.42 0.87 -2.65 0.00 0.00 178.83 176.95 3kyc h LYS 32 N 0.00 0.26 0.54 1.69 1.57 0.96 -1.96 116.57 119.63 3kyc h LYS 32 Ca -0.00 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 3kyc h LYS 32 Cb 0.80 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.11 3kyc h LYS 32 CO 0.05 0.64 -0.26 0.00 -0.57 0.00 0.00 179.45 179.31 3kyc h ARG 33 N 0.22 -0.70 -0.91 3.15 3.08 -0.14 -2.18 114.38 116.90 3kyc h ARG 33 Ca 0.02 0.05 0.15 0.00 0.07 0.00 0.00 59.98 60.27 3kyc h ARG 33 Cb 0.84 0.16 -0.16 0.00 0.08 0.00 0.00 29.97 30.89 3kyc h ARG 33 CO 0.07 -0.39 -0.34 -0.07 -1.07 0.00 0.00 179.97 178.17 3kyc h LEU 34 N -1.01 -1.24 -2.33 3.04 4.07 -1.27 -1.41 115.31 115.15 3kyc h LEU 34 Ca -0.07 0.29 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 3kyc h LEU 34 Cb 0.63 0.68 -0.00 0.00 1.08 0.00 0.00 40.66 43.05 3kyc h LEU 34 CO 0.12 -0.30 -0.01 -0.09 -1.08 0.00 0.00 178.44 177.08 3kyc h ARG 35 N -0.03 0.00 -0.08 1.13 2.43 -1.02 0.12 114.38 116.93 3kyc h ARG 35 Ca 0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 3kyc h ARG 35 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 3kyc h ARG 35 CO -0.93 0.01 0.00 0.00 -1.51 0.00 0.00 179.97 177.55 3kyc n ALA 36 N -2.36 2.55 -2.78 2.80 0.00 -0.56 -3.09 120.51 117.08 3kyc n ALA 36 Ca -0.03 -0.47 -0.35 0.00 0.00 0.00 0.00 53.44 52.59 3kyc n ALA 36 Cb 0.10 -1.14 -0.09 0.00 0.00 0.00 0.00 19.45 18.31 3kyc n ALA 36 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3kyc s SER 37 N -1.80 5.48 -0.10 0.00 0.01 0.40 -4.82 113.70 112.87 3kyc s SER 37 Ca 0.36 0.15 0.01 0.00 1.31 0.00 0.00 55.95 57.78 3kyc s SER 37 Cb 0.19 -1.73 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 3kyc s SER 37 CO 0.30 0.31 -0.12 -0.60 0.41 0.00 0.00 173.24 173.54 3kyc s ARG 38 N -0.45 3.04 -0.05 12.44 3.52 -1.26 -0.13 118.95 136.06 3kyc s ARG 38 Ca 0.09 -0.67 0.03 0.00 -0.13 0.00 0.00 55.73 55.05 3kyc s ARG 38 Cb -0.12 -2.56 0.01 0.00 -1.56 0.00 0.00 34.95 30.72 3kyc s ARG 38 CO 0.02 0.40 -0.14 0.08 -0.81 0.00 0.00 175.30 174.85 3kyc s VAL 39 N -0.13 1.22 -0.22 7.11 1.01 0.21 -1.11 120.40 128.51 3kyc s VAL 39 Ca -0.01 -0.56 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 3kyc s VAL 39 Cb -0.14 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.11 3kyc s VAL 39 CO 0.03 0.37 0.18 -0.22 0.00 0.00 0.00 175.10 175.46 3kyc s LEU 40 N 0.39 4.16 -0.09 3.92 0.20 -0.93 0.26 118.68 126.59 3kyc s LEU 40 Ca -0.10 0.21 0.01 0.00 0.69 0.00 0.00 54.13 54.95 3kyc s LEU 40 Cb -0.14 -2.15 0.02 0.00 -0.43 0.00 0.00 46.19 43.49 3kyc s LEU 40 CO 0.03 0.10 -0.12 -0.22 -0.29 0.00 0.00 176.35 175.85 3kyc s LEU 41 N 0.79 1.57 -0.22 -0.68 2.96 -0.62 -0.34 118.68 122.15 3kyc s LEU 41 Ca 0.09 -0.35 -0.06 0.00 -0.22 0.00 0.00 54.13 53.59 3kyc s LEU 41 Cb -0.13 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 3kyc s LEU 41 CO 0.02 -0.01 0.03 -0.69 -1.32 0.00 0.00 176.35 174.39 3kyc s VAL 42 N 1.02 4.16 0.00 1.68 1.01 -0.27 -1.33 120.40 126.67 3kyc s VAL 42 Ca -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.67 3kyc s VAL 42 Cb -0.15 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3kyc s VAL 42 CO -0.01 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.10 3kyc n GLY 43 N 4.41 -0.83 2.20 4.51 0.00 0.15 -1.20 105.19 114.43 3kyc n GLY 43 Ca -0.17 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.52 3kyc n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kyc n LEU 44 N -0.16 4.32 0.00 0.99 7.99 -1.26 -4.07 117.00 124.80 3kyc n LEU 44 Ca 0.00 -4.50 0.00 0.00 -0.01 0.00 0.00 56.01 51.50 3kyc n LEU 44 Cb 0.00 -0.21 0.00 0.00 -0.11 0.00 0.00 43.42 43.10 3kyc n LEU 44 CO 0.00 1.94 0.00 0.29 -1.51 0.00 0.00 177.39 178.11 3kyc n LYS 45 N -0.66 3.23 0.21 3.23 5.02 -1.26 -4.50 118.16 123.42 3kyc n LYS 45 Ca 0.37 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.51 3kyc n LYS 45 Cb 0.92 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.85 3kyc n LYS 45 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3kyc h GLY 46 N 0.00 -0.49 0.94 0.72 0.00 -1.98 -0.99 103.07 101.26 3kyc h GLY 46 Ca 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 3kyc h GLY 46 CO 0.00 -0.18 0.16 -2.00 0.00 0.00 0.00 176.54 174.51 3kyc h LEU 47 N -0.47 0.43 -1.13 3.11 5.85 -1.93 -2.68 115.31 118.48 3kyc h LEU 47 Ca -0.04 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.60 3kyc h LEU 47 Cb 0.37 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 3kyc h LEU 47 CO 0.07 0.44 0.59 1.23 -0.34 0.00 0.00 178.44 180.43 3kyc h GLY 48 N 0.39 1.32 1.11 3.75 0.00 -1.67 -2.16 103.07 105.82 3kyc h GLY 48 Ca 0.11 -0.43 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 3kyc h GLY 48 CO -0.01 0.34 0.06 0.00 0.00 0.00 0.00 176.54 176.93 3kyc h ALA 49 N 1.49 0.91 -0.06 3.60 0.00 -0.90 -1.79 119.26 122.51 3kyc h ALA 49 Ca 0.38 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3kyc h ALA 49 Cb 0.12 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3kyc h ALA 49 CO -0.13 0.66 0.04 0.93 0.00 0.00 0.00 179.25 180.75 3kyc h GLU 50 N 1.00 0.08 -0.42 0.00 4.39 -1.08 -1.53 114.58 117.01 3kyc h GLU 50 Ca 0.19 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.91 3kyc h GLU 50 Cb 0.48 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 3kyc h GLU 50 CO 0.02 0.05 0.23 0.82 -1.16 0.00 0.00 179.01 178.98 3kyc h ILE 51 N 0.08 1.01 -0.37 3.13 2.04 -1.35 0.20 117.51 122.24 3kyc h ILE 51 Ca 0.02 -0.16 0.07 0.00 1.00 0.00 0.00 64.86 65.79 3kyc h ILE 51 Cb -0.01 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 36.51 3kyc h ILE 51 CO -0.00 0.08 0.01 0.00 0.00 0.00 0.00 178.15 178.24 3kyc h ALA 52 N 1.21 0.35 -0.25 1.87 0.00 -1.28 0.38 119.26 121.54 3kyc h ALA 52 Ca 0.18 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 3kyc h ALA 52 Cb 0.05 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3kyc h ALA 52 CO -0.10 -0.39 0.04 -0.22 0.00 0.00 0.00 179.25 178.59 3kyc h LYS 53 N 0.12 0.41 -0.08 0.00 3.11 -0.71 -1.24 116.57 118.17 3kyc h LYS 53 Ca 0.18 -0.11 -0.00 0.00 -2.81 0.00 0.00 60.65 57.91 3kyc h LYS 53 Cb 0.25 -0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 31.43 3kyc h LYS 53 CO -0.29 0.53 0.03 -0.91 -2.81 0.00 0.00 179.45 176.00 3kyc h ASN 54 N 0.22 0.11 0.04 4.20 2.35 -0.49 -1.87 115.58 120.14 3kyc h ASN 54 Ca 0.08 -0.15 -0.15 0.00 -0.55 0.00 0.00 56.30 55.52 3kyc h ASN 54 Cb 0.32 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3kyc h ASN 54 CO 0.00 0.24 -0.49 -0.07 -1.65 0.00 0.00 177.43 175.46 3kyc h LEU 55 N -0.02 0.56 -0.28 1.61 3.38 -0.13 -2.11 115.31 118.33 3kyc h LEU 55 Ca 0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 3kyc h LEU 55 Cb 0.16 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3kyc h LEU 55 CO -0.00 0.96 0.15 0.40 0.09 0.00 0.00 178.44 180.04 3kyc h ILE 56 N 0.41 1.13 -0.14 1.22 2.04 -1.20 -1.75 117.51 119.22 3kyc h ILE 56 Ca 0.02 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3kyc h ILE 56 Cb 1.01 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 3kyc h ILE 56 CO 0.09 0.13 0.12 -0.07 0.00 0.00 0.00 178.15 178.42 3kyc h LEU 57 N 0.33 0.00 -0.08 1.44 3.38 -1.13 -1.72 115.31 117.53 3kyc h LEU 57 Ca 0.10 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 3kyc h LEU 57 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3kyc h LEU 57 CO -0.02 0.00 -0.41 0.00 0.09 0.00 0.00 178.44 178.11 3kyc h ALA 58 N 1.89 0.75 -2.31 1.53 0.00 -0.80 -3.48 119.26 116.84 3kyc h ALA 58 Ca 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3kyc h ALA 58 Cb 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3kyc h ALA 58 CO -0.00 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.17 3kyc n GLY 59 N 1.13 0.73 3.75 0.00 0.00 -0.65 -4.90 105.19 105.26 3kyc n GLY 59 Ca 0.02 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 3kyc n GLY 59 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kyc s VAL 60 N -2.84 3.11 0.08 1.61 -7.23 -1.21 -3.26 120.40 110.66 3kyc s VAL 60 Ca 0.00 0.36 -0.24 0.00 -1.81 0.00 0.00 61.98 60.29 3kyc s VAL 60 Cb 0.00 -2.84 -0.16 0.00 0.56 0.00 0.00 36.38 33.95 3kyc s VAL 60 CO 0.00 -0.47 1.70 0.50 -0.31 0.00 0.00 175.10 176.52 3kyc h LYS 61 N -1.27 -0.10 -2.70 4.82 3.64 -0.24 -3.42 116.57 117.30 3kyc h LYS 61 Ca -0.45 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 58.84 3kyc h LYS 61 Cb 1.25 0.02 -0.20 0.00 -0.41 0.00 0.00 32.23 32.89 3kyc h LYS 61 CO 0.52 -0.04 -0.13 0.20 -2.27 0.00 0.00 179.45 177.73 3kyc s GLY 62 N -2.22 -0.29 -0.17 5.01 0.00 -0.95 -2.02 107.32 106.67 3kyc s GLY 62 Ca -0.14 0.65 0.01 0.00 0.00 0.00 0.00 44.72 45.24 3kyc s GLY 62 CO 0.65 0.39 -0.17 -2.27 0.00 0.00 0.00 173.10 171.70 3kyc s LEU 63 N -1.28 2.31 -0.30 0.66 2.96 -0.38 -0.62 118.68 122.04 3kyc s LEU 63 Ca -0.13 -0.56 -0.13 0.00 -0.22 0.00 0.00 54.13 53.10 3kyc s LEU 63 Cb -0.04 -1.53 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 3kyc s LEU 63 CO 0.06 0.04 0.25 -0.89 -1.32 0.00 0.00 176.35 174.50 3kyc s THR 64 N 1.06 5.26 -0.38 3.68 2.01 0.14 -0.27 115.64 127.15 3kyc s THR 64 Ca -0.01 0.12 -0.14 0.00 0.31 0.00 0.00 61.69 61.97 3kyc s THR 64 Cb -0.14 -3.64 0.01 0.00 0.01 0.00 0.00 72.50 68.73 3kyc s THR 64 CO -0.06 0.12 0.27 -0.04 -0.69 0.00 0.00 174.62 174.22 3kyc s MET 65 N 1.83 3.16 -0.25 4.92 1.00 0.46 -1.59 119.30 128.84 3kyc s MET 65 Ca 0.09 -0.88 -0.08 0.00 0.00 0.00 0.00 55.69 54.82 3kyc s MET 65 Cb -0.16 -3.88 -0.03 0.00 0.00 0.00 0.00 34.83 30.75 3kyc s MET 65 CO 0.11 -0.62 0.09 -1.17 0.00 0.00 0.00 175.02 173.42 3kyc s LEU 66 N 1.68 3.52 -0.17 -0.03 0.20 -0.44 -2.00 118.68 121.44 3kyc s LEU 66 Ca 0.05 -0.18 -0.09 0.00 0.69 0.00 0.00 54.13 54.60 3kyc s LEU 66 Cb -0.18 -1.95 0.06 0.00 -0.43 0.00 0.00 46.19 43.69 3kyc s LEU 66 CO 0.10 -0.04 0.42 -0.62 -0.29 0.00 0.00 176.35 175.92 3kyc s ASP 67 N 1.63 -0.52 0.01 3.68 -1.08 -0.85 0.30 116.67 119.84 3kyc s ASP 67 Ca 0.06 0.91 0.22 0.00 -0.52 0.00 0.00 52.55 53.22 3kyc s ASP 67 Cb -0.15 0.79 -0.09 0.00 -1.46 0.00 0.00 42.92 42.01 3kyc s ASP 67 CO 0.05 -0.19 0.92 0.00 0.52 0.00 0.00 175.17 176.46 3kyc n HIS 68 N 4.28 0.08 -2.07 -5.34 1.44 -1.25 -4.28 115.22 108.08 3kyc n HIS 68 Ca -0.23 0.02 -0.30 0.00 -2.01 0.00 0.00 57.72 55.20 3kyc n HIS 68 Cb 0.55 -0.23 0.01 0.00 0.12 0.00 0.00 29.99 30.44 3kyc n HIS 68 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3kyc s GLU 69 N -3.14 3.52 0.36 -1.40 2.02 -1.26 -4.95 118.70 113.84 3kyc s GLU 69 Ca 0.05 0.58 0.08 0.00 0.02 0.00 0.00 54.97 55.69 3kyc s GLU 69 Cb 0.15 -2.15 -0.05 0.00 0.10 0.00 0.00 34.13 32.18 3kyc s GLU 69 CO 0.84 -0.52 0.12 -0.65 0.02 0.00 0.00 175.26 175.07 3kyc s GLN 70 N -5.08 2.27 -0.12 1.61 -0.21 -1.26 -2.28 119.66 114.59 3kyc s GLN 70 Ca 0.53 -1.66 -0.29 0.00 0.02 0.00 0.00 55.36 53.96 3kyc s GLN 70 Cb -0.11 -2.08 -0.03 0.00 1.00 0.00 0.00 33.01 31.79 3kyc s GLN 70 CO 0.51 0.07 1.49 0.08 -2.12 0.00 0.00 175.29 175.32 3kyc s VAL 71 N -2.48 3.89 0.44 1.09 1.01 0.18 -4.74 120.40 119.77 3kyc s VAL 71 Ca 0.38 1.06 -0.01 0.00 0.00 0.00 0.00 61.98 63.41 3kyc s VAL 71 Cb -0.01 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 3kyc s VAL 71 CO 0.22 -0.12 0.67 -0.89 0.00 0.00 0.00 175.10 174.98 3kyc s THR 72 N 3.94 4.36 -1.41 3.92 2.01 -1.26 -0.16 115.64 127.04 3kyc s THR 72 Ca 0.65 -0.37 0.30 0.00 0.31 0.00 0.00 61.69 62.58 3kyc s THR 72 Cb -0.27 -3.62 0.51 0.00 0.01 0.00 0.00 72.50 69.12 3kyc s THR 72 CO 0.23 -0.46 2.03 -2.65 -0.69 0.00 0.00 174.62 173.09 3kyc n PRO 73 N -2.06 0.40 0.03 4.92 -0.02 -1.26 -3.11 135.00 133.89 3kyc n PRO 73 Ca -0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.31 3kyc n PRO 73 Cb 0.57 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.48 3kyc n PRO 73 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3kyc h GLU 74 N 0.00 0.65 -6.33 -0.52 5.08 -2.01 -3.45 114.58 108.00 3kyc h GLU 74 Ca 0.00 -0.63 -0.65 0.00 -1.00 0.00 0.00 59.36 57.08 3kyc h GLU 74 Cb 0.29 0.16 0.04 0.00 0.50 0.00 0.00 28.75 29.75 3kyc h GLU 74 CO 0.00 1.23 0.72 -0.25 -1.00 0.00 0.00 179.01 179.71 3kyc n ASP 75 N -3.86 2.48 -0.62 1.42 8.00 -1.18 -4.84 116.55 117.95 3kyc n ASP 75 Ca -0.09 1.08 -0.09 0.00 0.71 0.00 0.00 54.79 56.41 3kyc n ASP 75 Cb 0.82 -1.29 -0.01 0.00 -0.02 0.00 0.00 41.12 40.62 3kyc n ASP 75 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3kyc n PRO 76 N 3.78 0.00 0.08 -0.24 -0.02 -1.26 -4.84 135.00 132.51 3kyc n PRO 76 Ca 0.20 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.74 3kyc n PRO 76 Cb 0.23 -0.20 0.31 0.00 -0.02 0.00 0.00 33.50 33.82 3kyc n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kyc n GLY 77 N 0.50 -0.73 3.04 -1.23 0.00 -1.26 -4.40 105.19 101.11 3kyc n GLY 77 Ca 0.04 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3kyc n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kyc s ALA 78 N -3.27 1.71 -0.17 4.61 0.00 -1.26 -4.78 121.76 118.60 3kyc s ALA 78 Ca -0.01 -0.76 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 3kyc s ALA 78 Cb 0.04 -0.88 0.07 0.00 0.00 0.00 0.00 23.12 22.35 3kyc s ALA 78 CO 0.12 -0.15 0.38 -0.65 0.00 0.00 0.00 175.76 175.47 3kyc s GLN 79 N 1.11 0.33 0.00 0.00 -0.21 -1.26 -5.06 119.66 114.56 3kyc s GLN 79 Ca -0.04 0.84 0.28 0.00 0.02 0.00 0.00 55.36 56.46 3kyc s GLN 79 Cb -0.14 0.08 1.42 0.00 1.00 0.00 0.00 33.01 35.37 3kyc s GLN 79 CO -0.04 -0.20 1.97 1.97 -2.12 0.00 0.00 175.29 176.87 3kyc n PHE 80 N 4.73 0.00 1.00 0.91 1.16 -1.26 -1.29 117.46 122.71 3kyc n PHE 80 Ca -0.17 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.52 3kyc n PHE 80 Cb 0.53 -0.28 -0.01 0.00 -1.61 0.00 0.00 39.48 38.11 3kyc n PHE 80 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 3kyc n LEU 81 N -1.28 1.99 -3.77 5.98 4.77 -1.26 -4.89 117.00 118.53 3kyc n LEU 81 Ca 0.13 -0.74 -0.29 0.00 -0.03 0.00 0.00 56.01 55.08 3kyc n LEU 81 Cb 0.22 -0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.16 3kyc n LEU 81 CO 0.21 0.37 -0.36 -0.63 -1.33 0.00 0.00 177.39 175.66 3kyc s ILE 82 N -2.50 0.84 0.62 -0.08 1.01 -0.41 -3.57 121.20 117.11 3kyc s ILE 82 Ca 0.18 -1.04 -0.18 0.00 0.00 0.00 0.00 60.65 59.61 3kyc s ILE 82 Cb 0.18 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 41.16 3kyc s ILE 82 CO 0.59 -0.40 0.84 -2.11 0.00 0.00 0.00 174.94 173.85 3kyc n ARG 83 N 4.90 0.71 -0.94 2.79 1.85 -1.26 -4.25 116.66 120.45 3kyc n ARG 83 Ca -0.06 0.28 -0.33 0.00 -1.00 0.00 0.00 57.85 56.74 3kyc n ARG 83 Cb 0.44 -2.06 0.13 0.00 -1.05 0.00 0.00 32.46 29.93 3kyc n ARG 83 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3kyc n THR 84 N -1.91 1.08 -0.86 8.89 -2.24 -1.26 -3.68 114.28 114.30 3kyc n THR 84 Ca 0.13 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3kyc n THR 84 Cb 0.48 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 3kyc n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kyc n GLY 85 N 0.74 0.17 0.97 3.38 0.00 -1.26 -4.86 105.19 104.33 3kyc n GLY 85 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3kyc n GLY 85 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3kyc n SER 86 N -0.47 1.91 -4.75 1.61 7.64 -1.24 -4.89 113.62 113.43 3kyc n SER 86 Ca 0.00 -1.32 -0.41 0.00 1.01 0.00 0.00 58.87 58.15 3kyc n SER 86 Cb 0.24 -0.33 0.01 0.00 -1.01 0.00 0.00 64.21 63.11 3kyc n SER 86 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3kyc n VAL 87 N 0.64 2.36 0.00 0.44 0.31 -1.26 -2.81 118.33 118.01 3kyc n VAL 87 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3kyc n VAL 87 Cb 0.32 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 3kyc n VAL 87 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kyc n GLY 88 N 0.60 2.48 3.76 2.92 0.00 0.77 -4.94 105.19 110.79 3kyc n GLY 88 Ca 0.04 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 3kyc n GLY 88 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kyc s ARG 89 N 0.00 3.60 0.23 1.61 3.52 -1.12 -4.61 118.95 122.18 3kyc s ARG 89 Ca 0.00 2.39 -0.32 0.00 -0.13 0.00 0.00 55.73 57.68 3kyc s ARG 89 Cb 0.00 -2.60 -0.12 0.00 -1.56 0.00 0.00 34.95 30.67 3kyc s ARG 89 CO 0.00 -0.87 1.70 -1.71 -0.81 0.00 0.00 175.30 173.60 3kyc n ASN 90 N -0.32 3.99 0.04 -2.12 2.85 -1.26 -0.65 115.26 117.79 3kyc n ASN 90 Ca 0.06 1.08 -0.09 0.00 -0.11 0.00 0.00 54.58 55.52 3kyc n ASN 90 Cb 0.42 -1.58 -0.05 0.00 1.24 0.00 0.00 39.78 39.81 3kyc n ASN 90 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 3kyc h ARG 91 N 6.28 -0.36 -1.00 1.20 9.65 -1.75 0.38 114.38 128.78 3kyc h ARG 91 Ca -0.44 0.02 0.22 0.00 -1.10 0.00 0.00 59.98 58.68 3kyc h ARG 91 Cb 1.21 0.08 -0.11 0.00 -1.39 0.00 0.00 29.97 29.75 3kyc h ARG 91 CO 0.92 -0.24 0.61 0.00 2.80 0.00 0.00 179.97 184.05 3kyc h ALA 92 N -0.94 1.74 -0.17 2.80 0.00 -1.81 -1.73 119.26 119.14 3kyc h ALA 92 Ca 0.00 0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.81 3kyc h ALA 92 Cb 0.39 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3kyc h ALA 92 CO -0.18 -0.16 -0.71 1.49 0.00 0.00 0.00 179.25 179.69 3kyc h GLU 93 N 0.68 0.72 0.14 0.00 4.81 -1.64 -2.63 114.58 116.66 3kyc h GLU 93 Ca 0.61 -0.55 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 3kyc h GLU 93 Cb 1.06 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.54 3kyc h GLU 93 CO -0.42 1.17 -0.07 0.00 -0.73 0.00 0.00 179.01 178.96 3kyc h ALA 94 N 0.69 -0.19 -0.87 2.92 0.00 0.55 -3.14 119.26 119.22 3kyc h ALA 94 Ca -0.03 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.92 3kyc h ALA 94 Cb 1.32 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 19.02 3kyc h ALA 94 CO 0.14 -0.50 -0.25 0.77 0.00 0.00 0.00 179.25 179.41 3kyc h SER 95 N -0.41 -0.92 -1.78 0.00 0.02 -1.43 -3.33 113.55 105.71 3kyc h SER 95 Ca -0.02 0.27 0.53 0.00 -0.84 0.00 0.00 61.79 61.72 3kyc h SER 95 Cb 0.32 0.57 -0.08 0.00 0.14 0.00 0.00 62.40 63.35 3kyc h SER 95 CO 0.03 -0.29 1.27 0.25 -1.14 0.00 0.00 176.83 176.95 3kyc h LEU 96 N -0.01 0.04 0.21 5.07 5.85 -1.41 -2.64 115.31 122.40 3kyc h LEU 96 Ca 0.40 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.13 3kyc h LEU 96 Cb 0.63 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.68 3kyc h LEU 96 CO -0.90 -0.03 -0.10 -0.08 -0.34 0.00 0.00 178.44 176.99 3kyc h GLU 97 N 0.01 -0.27 -0.88 1.25 4.57 -1.79 -0.73 114.58 116.73 3kyc h GLU 97 Ca 0.88 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 59.14 3kyc h GLU 97 Cb 3.41 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 32.00 3kyc h GLU 97 CO -0.08 -0.18 0.55 0.00 -1.18 0.00 0.00 179.01 178.13 3kyc h ARG 98 N -0.68 0.96 -0.21 1.92 2.47 -1.67 -2.25 114.38 114.93 3kyc h ARG 98 Ca -0.03 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.63 3kyc h ARG 98 Cb 0.21 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.30 3kyc h ARG 98 CO 0.05 0.64 0.13 0.00 0.56 0.00 0.00 179.97 181.34 3kyc h ALA 99 N 1.42 0.26 -0.13 0.04 0.00 -1.53 -2.88 119.26 116.44 3kyc h ALA 99 Ca 0.39 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 3kyc h ALA 99 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3kyc h ALA 99 CO -0.18 -0.23 -0.33 0.37 0.00 0.00 0.00 179.25 178.87 3kyc h GLN 100 N 0.26 0.26 -0.69 0.00 5.75 -0.80 -2.49 115.11 117.39 3kyc h GLN 100 Ca 0.07 -0.10 0.09 0.00 -0.15 0.00 0.00 58.65 58.56 3kyc h GLN 100 Cb 0.01 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.50 3kyc h GLN 100 CO -0.01 0.56 0.46 -0.91 -2.65 0.00 0.00 178.83 176.28 3kyc h ASN 101 N 0.22 0.54 -1.02 -0.69 -0.26 -1.21 -2.23 115.58 110.93 3kyc h ASN 101 Ca 0.03 0.01 0.25 0.00 -0.56 0.00 0.00 56.30 56.03 3kyc h ASN 101 Cb 0.70 -0.10 -0.09 0.00 -1.06 0.00 0.00 38.32 37.77 3kyc h ASN 101 CO 0.05 0.33 0.66 -0.07 -1.06 0.00 0.00 177.43 177.34 3kyc h LEU 102 N 0.60 0.47 -5.93 1.61 3.38 -1.29 -3.38 115.31 110.77 3kyc h LEU 102 Ca 0.31 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.40 3kyc h LEU 102 Cb 0.43 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.99 3kyc h LEU 102 CO -0.10 0.11 -0.33 0.21 0.09 0.00 0.00 178.44 178.42 3kyc s ASN 103 N -5.32 -1.32 0.66 -0.43 2.47 -0.84 -4.80 114.94 105.37 3kyc s ASN 103 Ca -0.09 -0.16 0.36 0.00 0.42 0.00 0.00 52.86 53.39 3kyc s ASN 103 Cb 0.25 1.76 1.99 0.00 -1.45 0.00 0.00 41.25 43.80 3kyc s ASN 103 CO 0.80 -0.20 2.14 -0.65 -3.72 0.00 0.00 177.10 175.46 3kyc h PRO 104 N 7.35 0.00 0.00 0.43 0.11 -1.74 0.41 132.00 138.56 3kyc h PRO 104 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3kyc h PRO 104 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3kyc h PRO 104 CO 0.08 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 176.54 3kyc n MET 105 N -3.06 0.10 -3.81 1.05 2.81 -1.26 -4.69 117.12 108.26 3kyc n MET 105 Ca -0.02 0.26 -0.35 0.00 -1.81 0.00 0.00 57.70 55.78 3kyc n MET 105 Cb 0.24 -1.67 -0.08 0.00 -0.71 0.00 0.00 33.22 31.00 3kyc n MET 105 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kyc s VAL 106 N -3.12 5.28 -0.88 2.03 1.01 0.15 -4.90 120.40 119.97 3kyc s VAL 106 Ca 0.08 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.95 3kyc s VAL 106 Cb 0.11 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 3kyc s VAL 106 CO 0.40 0.46 1.90 -0.62 0.00 0.00 0.00 175.10 177.24 3kyc s ASP 107 N 0.23 5.26 -0.46 3.32 -1.08 -0.86 -4.94 116.67 118.14 3kyc s ASP 107 Ca 0.08 -0.62 -0.17 0.00 -0.52 0.00 0.00 52.55 51.32 3kyc s ASP 107 Cb -0.11 -2.56 0.05 0.00 -1.46 0.00 0.00 42.92 38.84 3kyc s ASP 107 CO -0.01 -2.61 0.47 -0.69 0.52 0.00 0.00 175.17 172.84 3kyc s VAL 108 N 9.59 5.08 0.28 1.11 1.01 -1.26 -1.25 120.40 134.96 3kyc s VAL 108 Ca 0.68 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 62.11 3kyc s VAL 108 Cb -0.07 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3kyc s VAL 108 CO 0.01 -0.57 0.22 -0.54 0.00 0.00 0.00 175.10 174.22 3kyc s LYS 109 N 2.09 2.85 0.25 2.72 1.02 0.62 -4.97 119.74 124.33 3kyc s LYS 109 Ca 0.10 -1.14 0.11 0.00 0.02 0.00 0.00 55.97 55.06 3kyc s LYS 109 Cb -0.20 -2.53 -0.05 0.00 -0.52 0.00 0.00 37.83 34.54 3kyc s LYS 109 CO 0.11 0.30 -0.19 0.14 -0.92 0.00 0.00 175.35 174.80 3kyc s VAL 110 N -2.19 2.26 -0.10 3.17 -7.23 -1.26 -0.40 120.40 114.65 3kyc s VAL 110 Ca 0.35 -2.33 -0.08 0.00 -1.81 0.00 0.00 61.98 58.11 3kyc s VAL 110 Cb -0.07 -2.21 0.03 0.00 0.56 0.00 0.00 36.38 34.68 3kyc s VAL 110 CO 0.25 -0.44 0.25 -0.62 -0.31 0.00 0.00 175.10 174.23 3kyc s ASP 111 N -3.41 -0.26 0.00 4.85 -1.08 -0.85 -4.86 116.67 111.06 3kyc s ASP 111 Ca 0.27 0.51 0.04 0.00 -0.52 0.00 0.00 52.55 52.86 3kyc s ASP 111 Cb -0.04 0.49 0.01 0.00 -1.46 0.00 0.00 42.92 41.93 3kyc s ASP 111 CO 0.12 -0.10 0.51 0.35 0.52 0.00 0.00 175.17 176.57 3kyc n THR 112 N 3.19 0.00 -2.74 1.71 -2.24 -1.26 -2.00 114.28 110.93 3kyc n THR 112 Ca -0.15 -0.48 -0.41 0.00 -2.27 0.00 0.00 64.05 60.74 3kyc n THR 112 Cb 0.57 1.07 -0.04 0.00 -2.10 0.00 0.00 70.33 69.83 3kyc n THR 112 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3kyc s GLU 113 N -0.63 4.67 0.06 -0.78 2.12 -1.26 -3.93 118.70 118.95 3kyc s GLU 113 Ca 0.04 1.42 -0.36 0.00 0.36 0.00 0.00 54.97 56.43 3kyc s GLU 113 Cb 0.03 -3.39 -0.16 0.00 0.26 0.00 0.00 34.13 30.88 3kyc s GLU 113 CO 0.08 0.19 1.45 -3.47 -0.54 0.00 0.00 175.26 172.97 3kyc n ASP 114 N 2.92 2.09 -0.32 -1.70 4.64 -1.26 -4.62 116.55 118.31 3kyc n ASP 114 Ca 0.02 1.10 0.26 0.00 -1.38 0.00 0.00 54.79 54.79 3kyc n ASP 114 Cb 0.49 -1.24 0.57 0.00 -1.04 0.00 0.00 41.12 39.90 3kyc n ASP 114 CO 0.00 0.00 0.00 -0.29 -0.82 0.00 0.00 177.20 176.09 3kyc h ILE 115 N 3.65 0.50 0.00 5.18 6.09 -1.95 -1.04 117.51 129.94 3kyc h ILE 115 Ca -0.47 -0.10 -0.01 0.00 -1.37 0.00 0.00 64.86 62.91 3kyc h ILE 115 Cb 1.31 0.18 -0.00 0.00 0.47 0.00 0.00 36.82 38.78 3kyc h ILE 115 CO 0.82 0.05 -0.04 -0.33 -3.07 0.00 0.00 178.15 175.59 3kyc h GLU 116 N 0.29 0.00 -0.20 2.19 5.08 -1.99 -3.05 114.58 116.90 3kyc h GLU 116 Ca 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.94 3kyc h GLU 116 Cb 1.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.92 3kyc h GLU 116 CO -0.23 0.04 0.00 1.63 -1.00 0.00 0.00 179.01 179.45 3kyc n LYS 117 N -3.63 1.59 -3.74 2.33 5.02 -0.39 -4.90 118.16 114.44 3kyc n LYS 117 Ca -0.03 -0.91 -0.36 0.00 -2.02 0.00 0.00 58.31 55.00 3kyc n LYS 117 Cb 0.13 -1.29 -0.07 0.00 -0.02 0.00 0.00 35.03 33.77 3kyc n LYS 117 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3kyc s LYS 118 N -1.74 4.02 0.65 1.97 2.47 -1.16 -5.06 119.74 120.90 3kyc s LYS 118 Ca 0.25 -0.16 -0.12 0.00 -1.56 0.00 0.00 55.97 54.38 3kyc s LYS 118 Cb 0.13 -3.36 -0.02 0.00 -1.46 0.00 0.00 37.83 33.12 3kyc s LYS 118 CO 0.19 0.41 1.05 -1.25 0.16 0.00 0.00 175.35 175.91 3kyc s PRO 119 N 0.02 3.25 0.11 4.03 0.04 -1.26 -4.99 135.00 136.21 3kyc s PRO 119 Ca 0.11 0.92 -0.30 0.00 0.04 0.00 0.00 61.00 61.76 3kyc s PRO 119 Cb -0.12 -2.03 -0.11 0.00 0.04 0.00 0.00 34.50 32.29 3kyc s PRO 119 CO 0.00 -0.85 1.50 1.49 0.04 0.00 0.00 177.00 179.18 3kyc h GLU 120 N -0.36 -0.40 0.00 4.56 4.81 -2.00 -2.45 114.58 118.73 3kyc h GLU 120 Ca -0.44 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 3kyc h GLU 120 Cb 1.20 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.67 3kyc h GLU 120 CO 0.59 -0.27 0.12 0.66 -0.73 0.00 0.00 179.01 179.38 3kyc h SER 121 N -0.42 0.00 -0.10 1.04 4.64 -2.01 -1.16 113.55 115.55 3kyc h SER 121 Ca 0.05 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 3kyc h SER 121 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 3kyc h SER 121 CO -0.50 0.00 -0.01 0.15 -0.87 0.00 0.00 176.83 175.60 3kyc h PHE 122 N 0.00 0.30 0.00 4.77 3.57 -1.82 -2.49 116.94 121.28 3kyc h PHE 122 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3kyc h PHE 122 Cb 0.24 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.89 3kyc h PHE 122 CO 0.00 0.32 0.00 0.74 -2.23 0.00 0.00 178.31 177.14 3kyc h PHE 123 N 0.29 0.00 0.00 0.41 -1.00 -1.35 -3.30 116.94 111.99 3kyc h PHE 123 Ca 0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.85 3kyc h PHE 123 Cb 0.22 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.78 3kyc h PHE 123 CO 0.00 0.00 0.00 0.25 -1.61 0.00 0.00 178.31 176.95 3kyc n THR 124 N -2.85 0.00 -0.22 -1.55 -2.24 -0.94 -2.23 114.28 104.26 3kyc n THR 124 Ca 0.02 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.90 3kyc n THR 124 Cb 0.34 -0.30 0.31 0.00 -2.10 0.00 0.00 70.33 68.57 3kyc n THR 124 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kyc n GLN 125 N -0.79 2.82 -4.70 -0.78 10.64 -1.24 -4.91 117.38 118.42 3kyc n GLN 125 Ca 0.14 -2.48 -0.25 0.00 -1.83 0.00 0.00 57.00 52.58 3kyc n GLN 125 Cb 0.06 -1.61 -0.16 0.00 -0.86 0.00 0.00 30.24 27.67 3kyc n GLN 125 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3kyc s PHE 126 N -1.30 1.50 -0.48 2.61 0.40 -0.95 -4.77 117.98 115.00 3kyc s PHE 126 Ca 0.46 -0.44 0.24 0.00 -0.60 0.00 0.00 56.93 56.58 3kyc s PHE 126 Cb 0.25 -1.03 0.29 0.00 0.51 0.00 0.00 43.02 43.04 3kyc s PHE 126 CO 0.28 -0.17 1.35 -0.44 0.70 0.00 0.00 175.22 176.94 3kyc h ASP 127 N 6.40 0.00 -4.95 1.36 3.32 -1.42 -3.47 116.42 117.67 3kyc h ASP 127 Ca -0.32 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 56.56 3kyc h ASP 127 Cb 1.18 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.53 3kyc h ASP 127 CO 0.48 0.04 -0.11 0.00 -1.72 0.00 0.00 179.24 177.92 3kyc s ALA 128 N -3.23 -1.14 -0.04 3.45 0.00 -1.20 -3.12 121.76 116.48 3kyc s ALA 128 Ca 0.05 0.71 0.03 0.00 0.00 0.00 0.00 51.96 52.75 3kyc s ALA 128 Cb 0.10 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.24 3kyc s ALA 128 CO 0.72 -0.30 -0.14 0.08 0.00 0.00 0.00 175.76 176.12 3kyc s VAL 129 N -1.22 1.17 -0.05 0.00 1.01 -0.18 -2.18 120.40 118.96 3kyc s VAL 129 Ca -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3kyc s VAL 129 Cb -0.03 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.34 3kyc s VAL 129 CO 0.06 0.35 -0.02 0.00 0.00 0.00 0.00 175.10 175.49 3kyc s LEU 131 N 1.23 3.62 0.07 0.00 1.02 0.22 -1.12 118.68 123.73 3kyc s LEU 131 Ca -0.06 -0.04 0.08 0.00 0.02 0.00 0.00 54.13 54.12 3kyc s LEU 131 Cb -0.14 -1.93 -0.03 0.00 0.02 0.00 0.00 46.19 44.11 3kyc s LEU 131 CO -0.02 0.10 -0.21 -0.89 0.02 0.00 0.00 176.35 175.35 3kyc s THR 132 N 0.82 1.73 -0.49 5.49 2.01 -0.34 -1.27 115.64 123.59 3kyc s THR 132 Ca 0.03 -1.39 0.00 0.00 0.31 0.00 0.00 61.69 60.64 3kyc s THR 132 Cb -0.14 -1.54 0.00 0.00 0.01 0.00 0.00 72.50 70.84 3kyc s THR 132 CO 0.02 0.08 0.00 0.00 -0.69 0.00 0.00 174.62 174.04 3kyc s SER 135 N -2.47 5.28 0.46 0.00 1.04 -1.26 -4.84 113.70 111.91 3kyc s SER 135 Ca 0.47 1.76 0.20 0.00 0.48 0.00 0.00 55.95 58.86 3kyc s SER 135 Cb -0.11 -2.52 1.17 0.00 0.10 0.00 0.00 66.02 64.66 3kyc s SER 135 CO 0.22 -1.51 1.91 -0.09 0.98 0.00 0.00 173.24 174.76 3kyc h ARG 136 N -0.41 0.28 -0.32 4.02 2.43 -1.95 -0.98 114.38 117.45 3kyc h ARG 136 Ca -0.45 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 58.65 3kyc h ARG 136 Cb 1.22 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 3kyc h ARG 136 CO 0.55 0.19 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.76 3kyc h ASP 137 N 0.29 0.55 0.01 -3.80 3.45 -1.98 -1.24 116.42 113.69 3kyc h ASP 137 Ca 0.38 -0.31 0.01 0.00 0.43 0.00 0.00 57.03 57.54 3kyc h ASP 137 Cb 1.07 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.68 3kyc h ASP 137 CO -0.10 0.73 -0.05 0.58 -1.57 0.00 0.00 179.24 178.82 3kyc h VAL 138 N 0.36 0.86 -0.46 -1.35 2.07 -1.66 0.64 116.25 116.72 3kyc h VAL 138 Ca 0.09 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.69 3kyc h VAL 138 Cb 0.44 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 3kyc h VAL 138 CO 0.02 0.00 0.10 0.40 0.02 0.00 0.00 177.57 178.10 3kyc h ILE 139 N -0.10 0.76 -0.03 4.57 2.04 -0.80 -0.20 117.51 123.75 3kyc h ILE 139 Ca 0.02 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 3kyc h ILE 139 Cb 0.12 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 3kyc h ILE 139 CO -0.05 0.04 -0.00 0.58 0.00 0.00 0.00 178.15 178.72 3kyc h VAL 140 N 0.24 1.26 -0.42 1.67 2.07 -0.94 -0.70 116.25 119.43 3kyc h VAL 140 Ca 0.23 -0.79 0.08 0.00 0.82 0.00 0.00 66.70 67.04 3kyc h VAL 140 Cb 0.29 1.74 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 3kyc h VAL 140 CO -0.29 0.21 -0.03 0.50 0.02 0.00 0.00 177.57 177.97 3kyc h LYS 141 N -0.26 0.07 -0.38 1.57 3.64 -0.10 -1.45 116.57 119.66 3kyc h LYS 141 Ca 0.01 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 3kyc h LYS 141 Cb 0.34 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 3kyc h LYS 141 CO 0.00 0.04 0.09 0.28 -2.27 0.00 0.00 179.45 177.60 3kyc h VAL 142 N 0.07 1.23 -0.89 2.00 2.07 -1.09 -1.37 116.25 118.27 3kyc h VAL 142 Ca 0.21 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.99 3kyc h VAL 142 Cb 0.31 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3kyc h VAL 142 CO -0.38 0.27 0.58 -0.78 0.02 0.00 0.00 177.57 177.28 3kyc h ASP 143 N 0.48 0.95 -0.61 0.57 -0.00 -0.60 -0.65 116.42 116.55 3kyc h ASP 143 Ca 0.12 -0.00 -0.09 0.00 -0.00 0.00 0.00 57.03 57.06 3kyc h ASP 143 Cb 0.31 -0.21 -0.02 0.00 -0.00 0.00 0.00 39.33 39.41 3kyc h ASP 143 CO 0.00 0.64 0.05 1.56 -0.00 0.00 0.00 179.24 181.49 3kyc h GLN 144 N 1.11 1.05 -0.55 0.28 4.20 -1.07 0.12 115.11 120.25 3kyc h GLN 144 Ca 0.36 -0.31 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3kyc h GLN 144 Cb 0.03 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 3kyc h GLN 144 CO -0.13 1.01 0.26 0.82 -0.67 0.00 0.00 178.83 180.12 3kyc h ILE 145 N 0.95 1.20 -0.13 2.54 2.04 -0.46 -1.41 117.51 122.25 3kyc h ILE 145 Ca 0.18 -0.59 -0.15 0.00 1.00 0.00 0.00 64.86 65.30 3kyc h ILE 145 Cb 0.50 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 3kyc h ILE 145 CO 0.02 0.23 -0.56 0.00 0.00 0.00 0.00 178.15 177.85 3kyc h HIS 147 N 0.30 1.14 0.00 0.00 -0.00 -0.55 0.19 115.15 116.23 3kyc h HIS 147 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3kyc h HIS 147 Cb 1.07 -0.38 0.00 0.00 -0.00 0.00 0.00 27.41 28.10 3kyc h HIS 147 CO 0.03 0.73 0.00 0.87 -0.00 0.00 0.00 177.93 179.56 3kyc h LYS 148 N 1.23 0.00 0.00 5.26 1.57 0.07 -3.13 116.57 121.56 3kyc h LYS 148 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3kyc h LYS 148 Cb -0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.18 3kyc h LYS 148 CO -0.07 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.90 3kyc n ASN 149 N -2.68 1.31 -2.34 0.86 3.02 -0.90 -4.99 115.26 109.53 3kyc n ASN 149 Ca 0.01 -1.54 -0.19 0.00 -0.03 0.00 0.00 54.58 52.83 3kyc n ASN 149 Cb 0.26 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.44 3kyc n ASN 149 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3kyc n SER 150 N -0.27 -5.39 -4.73 6.41 7.64 -0.02 -4.97 113.62 112.30 3kyc n SER 150 Ca 0.00 -0.13 -0.38 0.00 1.01 0.00 0.00 58.87 59.37 3kyc n SER 150 Cb 0.24 -4.34 -0.06 0.00 -1.01 0.00 0.00 64.21 59.04 3kyc n SER 150 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3kyc s ILE 151 N -3.00 5.16 -0.13 0.44 -1.09 0.48 -5.03 121.20 118.03 3kyc s ILE 151 Ca 0.13 0.98 -0.36 0.00 -2.23 0.00 0.00 60.65 59.17 3kyc s ILE 151 Cb -0.06 -3.82 -0.13 0.00 -1.58 0.00 0.00 42.46 36.86 3kyc s ILE 151 CO 0.16 0.34 1.79 0.29 -1.23 0.00 0.00 174.94 176.30 3kyc n LYS 152 N 3.52 1.78 -4.63 2.79 4.01 -1.18 -4.45 118.16 120.00 3kyc n LYS 152 Ca -0.07 0.65 -0.34 0.00 -0.51 0.00 0.00 58.31 58.04 3kyc n LYS 152 Cb 0.52 -2.43 -0.12 0.00 -0.51 0.00 0.00 35.03 32.49 3kyc n LYS 152 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 3kyc s PHE 153 N 3.51 2.91 0.02 2.13 5.36 -0.83 -1.01 117.98 130.08 3kyc s PHE 153 Ca 0.93 -0.13 -0.03 0.00 -0.96 0.00 0.00 56.93 56.75 3kyc s PHE 153 Cb -0.83 -1.76 -0.02 0.00 -0.34 0.00 0.00 43.02 40.07 3kyc s PHE 153 CO 0.55 0.19 0.04 -0.06 -1.46 0.00 0.00 175.22 174.48 3kyc s PHE 154 N -0.46 0.23 0.07 10.12 0.40 -0.43 -0.54 117.98 127.36 3kyc s PHE 154 Ca 0.07 -0.50 -0.07 0.00 -0.60 0.00 0.00 56.93 55.83 3kyc s PHE 154 Cb -0.12 -0.17 -0.01 0.00 0.51 0.00 0.00 43.02 43.23 3kyc s PHE 154 CO 0.02 -0.28 0.13 -0.08 0.70 0.00 0.00 175.22 175.72 3kyc s THR 155 N -2.00 0.16 -0.08 0.64 -1.32 -0.88 -0.61 115.64 111.55 3kyc s THR 155 Ca -0.10 -1.28 -0.31 0.00 -1.21 0.00 0.00 61.69 58.79 3kyc s THR 155 Cb -0.05 -1.29 0.12 0.00 -1.51 0.00 0.00 72.50 69.76 3kyc s THR 155 CO -0.02 -0.71 0.99 -0.83 -2.21 0.00 0.00 174.62 171.84 3kyc s GLY 156 N -2.72 -0.39 -0.00 6.08 0.00 -0.40 -0.24 107.32 109.64 3kyc s GLY 156 Ca 0.03 1.32 -0.28 0.00 0.00 0.00 0.00 44.72 45.79 3kyc s GLY 156 CO -0.09 0.49 0.73 0.99 0.00 0.00 0.00 173.10 175.22 3kyc s ASP 157 N -2.20 -0.55 -0.02 1.64 1.01 -0.82 -4.19 116.67 111.54 3kyc s ASP 157 Ca 0.05 0.39 0.06 0.00 0.71 0.00 0.00 52.55 53.76 3kyc s ASP 157 Cb -0.01 0.50 -0.02 0.00 1.01 0.00 0.00 42.92 44.40 3kyc s ASP 157 CO -0.06 -0.67 -0.20 -0.69 0.21 0.00 0.00 175.17 173.76 3kyc s VAL 158 N -2.11 2.60 -0.23 -1.27 1.01 -1.26 -1.96 120.40 117.17 3kyc s VAL 158 Ca -0.04 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 60.92 3kyc s VAL 158 Cb -0.00 -1.99 0.08 0.00 0.00 0.00 0.00 36.38 34.46 3kyc s VAL 158 CO 0.00 0.53 0.10 -0.36 0.00 0.00 0.00 175.10 175.37 3kyc s PHE 159 N -0.72 0.49 0.00 5.22 0.40 0.77 -4.80 117.98 119.34 3kyc s PHE 159 Ca 0.11 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.72 3kyc s PHE 159 Cb -0.10 -0.91 0.00 0.00 0.51 0.00 0.00 43.02 42.52 3kyc s PHE 159 CO 0.01 -0.68 0.00 0.41 0.70 0.00 0.00 175.22 175.66 3kyc n GLY 160 N 5.20 1.33 0.39 4.36 0.00 0.31 -0.24 105.19 116.54 3kyc n GLY 160 Ca -0.06 0.64 0.11 0.00 0.00 0.00 0.00 46.02 46.71 3kyc n GLY 160 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kyc n TYR 161 N 0.00 0.00 -3.99 1.61 4.02 -1.22 -2.67 117.16 114.91 3kyc n TYR 161 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.68 3kyc n TYR 161 Cb 0.00 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.27 3kyc n TYR 161 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 3kyc s HIS 162 N -2.58 3.16 0.12 -0.72 3.76 0.66 -0.71 115.29 118.99 3kyc s HIS 162 Ca 0.17 -0.13 -0.23 0.00 -0.15 0.00 0.00 55.06 54.73 3kyc s HIS 162 Cb 0.18 -1.54 0.06 0.00 1.11 0.00 0.00 32.58 32.39 3kyc s HIS 162 CO 0.62 0.42 0.57 0.20 -0.85 0.00 0.00 174.74 175.69 3kyc s GLY 163 N -3.92 -0.54 0.05 -2.22 0.00 -0.83 -0.16 107.32 99.69 3kyc s GLY 163 Ca 0.35 0.50 -0.12 0.00 0.00 0.00 0.00 44.72 45.45 3kyc s GLY 163 CO 0.27 0.18 0.26 -2.52 0.00 0.00 0.00 173.10 171.29 3kyc s TYR 164 N -3.37 -0.04 0.33 1.90 -0.85 -0.83 -0.17 117.35 114.31 3kyc s TYR 164 Ca -0.01 -0.14 0.06 0.00 -0.52 0.00 0.00 57.07 56.47 3kyc s TYR 164 Cb -0.00 0.05 -0.07 0.00 0.38 0.00 0.00 41.96 42.32 3kyc s TYR 164 CO -0.09 -0.49 -0.02 0.95 -1.52 0.00 0.00 175.55 174.38 3kyc s THR 165 N -2.66 1.70 -0.01 -3.49 -4.23 0.13 -1.94 115.64 105.14 3kyc s THR 165 Ca -0.04 -2.08 -0.06 0.00 -1.18 0.00 0.00 61.69 58.33 3kyc s THR 165 Cb -0.01 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.14 3kyc s THR 165 CO -0.04 -0.14 0.12 0.12 -0.54 0.00 0.00 174.62 174.14 3kyc s PHE 166 N -2.95 0.01 -0.00 3.99 5.36 0.67 -1.13 117.98 123.92 3kyc s PHE 166 Ca 0.33 -0.02 0.00 0.00 -0.96 0.00 0.00 56.93 56.28 3kyc s PHE 166 Cb 0.06 -0.03 0.00 0.00 -0.34 0.00 0.00 43.02 42.71 3kyc s PHE 166 CO 0.15 -0.21 -0.00 0.00 -1.46 0.00 0.00 175.22 173.70 3kyc s ALA 167 N -0.95 0.05 -0.30 11.12 0.00 -0.41 -2.06 121.76 129.21 3kyc s ALA 167 Ca -0.10 0.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 3kyc s ALA 167 Cb -0.06 -0.05 0.10 0.00 0.00 0.00 0.00 23.12 23.11 3kyc s ALA 167 CO 0.01 -0.01 0.09 1.21 0.00 0.00 0.00 175.76 177.06 3kyc s ASN 168 N 0.15 3.98 0.00 0.00 3.84 0.29 -4.38 114.94 118.82 3kyc s ASN 168 Ca -0.01 -1.59 0.15 0.00 0.21 0.00 0.00 52.86 51.62 3kyc s ASN 168 Cb -0.02 -0.88 0.38 0.00 -0.55 0.00 0.00 41.25 40.17 3kyc s ASN 168 CO -0.00 -0.40 1.30 0.18 -2.79 0.00 0.00 177.10 175.38 3kyc n LEU 169 N 4.84 3.13 0.00 3.21 4.77 -1.26 -1.96 117.00 129.72 3kyc n LEU 169 Ca -0.03 -1.85 0.00 0.00 -0.03 0.00 0.00 56.01 54.10 3kyc n LEU 169 Cb 0.42 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3kyc n LEU 169 CO 0.12 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 3kyc n GLY 170 N 0.89 1.97 3.40 -0.72 0.00 -1.26 -3.93 105.19 105.54 3kyc n GLY 170 Ca 0.15 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.33 3kyc n GLY 170 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kyc s GLU 171 N 0.00 3.07 -0.31 1.61 2.02 -1.26 -0.48 118.70 123.35 3kyc s GLU 171 Ca 0.00 -1.18 -0.08 0.00 0.02 0.00 0.00 54.97 53.74 3kyc s GLU 171 Cb 0.00 -4.23 0.01 0.00 0.10 0.00 0.00 34.13 30.01 3kyc s GLU 171 CO 0.00 -1.50 0.10 -1.58 0.02 0.00 0.00 175.26 172.30 3kyc s HIS 172 N 2.82 3.17 -0.10 1.61 2.46 -0.59 -4.99 115.29 119.68 3kyc s HIS 172 Ca 0.13 -0.95 -0.16 0.00 0.47 0.00 0.00 55.06 54.55 3kyc s HIS 172 Cb -0.22 -2.29 -0.05 0.00 -0.13 0.00 0.00 32.58 29.89 3kyc s HIS 172 CO 0.08 -0.58 0.41 -1.21 -2.47 0.00 0.00 174.74 170.98 3kyc s GLU 173 N 1.51 4.21 0.06 2.88 2.02 -1.26 -1.71 118.70 126.41 3kyc s GLU 173 Ca 0.02 0.35 -0.09 0.00 0.02 0.00 0.00 54.97 55.28 3kyc s GLU 173 Cb -0.17 -3.38 0.00 0.00 0.10 0.00 0.00 34.13 30.68 3kyc s GLU 173 CO 0.03 0.32 0.19 -0.59 0.02 0.00 0.00 175.26 175.24 3kyc s PHE 174 N 0.14 0.09 -0.07 1.61 -0.12 -0.74 -4.78 117.98 114.09 3kyc s PHE 174 Ca 0.23 -0.38 -0.05 0.00 -0.05 0.00 0.00 56.93 56.68 3kyc s PHE 174 Cb -0.15 -0.04 -0.04 0.00 -0.63 0.00 0.00 43.02 42.16 3kyc s PHE 174 CO 0.10 -0.47 0.16 0.54 -0.05 0.00 0.00 175.22 175.49 3kyc s VAL 175 N -3.03 5.47 0.36 -2.49 0.11 0.10 -1.29 120.40 119.63 3kyc s VAL 175 Ca -0.01 0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.17 3kyc s VAL 175 Cb 0.01 -3.45 -0.05 0.00 -1.53 0.00 0.00 36.38 31.35 3kyc s VAL 175 CO -0.06 0.50 0.06 -0.70 -3.33 0.00 0.00 175.10 171.56 3kyc s GLU 176 N -1.41 2.13 0.07 1.54 2.12 -0.42 0.91 118.70 123.63 3kyc s GLU 176 Ca 0.20 -1.77 -0.23 0.00 0.36 0.00 0.00 54.97 53.53 3kyc s GLU 176 Cb -0.12 -1.94 -0.06 0.00 0.26 0.00 0.00 34.13 32.26 3kyc s GLU 176 CO 0.10 0.07 0.69 -2.00 -0.54 0.00 0.00 175.26 173.58 3kyc s GLU 177 N -3.76 4.41 -0.35 4.30 2.12 -1.26 -1.82 118.70 122.34 3kyc s GLU 177 Ca 0.36 0.94 -0.17 0.00 0.36 0.00 0.00 54.97 56.46 3kyc s GLU 177 Cb 0.01 -3.31 -0.01 0.00 0.26 0.00 0.00 34.13 31.09 3kyc s GLU 177 CO 0.20 0.45 0.46 -1.59 -0.54 0.00 0.00 175.26 174.24 3kyc s LYS 178 N -0.58 3.58 0.00 4.30 -2.85 0.24 -4.89 119.74 119.55 3kyc s LYS 178 Ca 0.34 -0.27 -0.00 0.00 -1.00 0.00 0.00 55.97 55.04 3kyc s LYS 178 Cb -0.20 -3.81 -0.01 0.00 -2.06 0.00 0.00 37.83 31.74 3kyc s LYS 178 CO 0.22 -0.61 0.45 2.41 0.10 0.00 0.00 175.35 177.92 3kyc n THR 179 N 5.36 0.33 -2.62 3.79 -1.04 -1.26 -4.82 114.28 114.02 3kyc n THR 179 Ca -0.06 -0.11 -0.01 0.00 -2.04 0.00 0.00 64.05 61.83 3kyc n THR 179 Cb 0.49 -1.19 -0.01 0.00 -1.82 0.00 0.00 70.33 67.80 3kyc n THR 179 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 3kyc n LYS 180 N 2.17 -3.43 -0.09 -2.82 0.00 -1.26 -5.29 118.16 107.44 3kyc n LYS 180 Ca 0.02 2.74 -0.10 0.00 -0.00 0.00 0.00 58.31 60.97 3kyc n LYS 180 Cb 0.09 -5.09 -0.03 0.00 -0.00 0.00 0.00 35.03 29.99 3kyc n LYS 180 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 3kyc n THR 205 N 0.78 1.48 -3.48 0.58 -2.24 -1.26 -5.33 114.28 104.81 3kyc n THR 205 Ca -0.05 0.11 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 3kyc n THR 205 Cb 0.08 -2.31 -0.06 0.00 -2.10 0.00 0.00 70.33 65.93 3kyc n THR 205 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3kyc s MET 206 N -2.72 4.16 -0.14 -0.78 1.00 -1.26 0.83 119.30 120.40 3kyc s MET 206 Ca -0.27 0.26 0.01 0.00 0.00 0.00 0.00 55.69 55.70 3kyc s MET 206 Cb 0.05 -3.37 -0.00 0.00 0.00 0.00 0.00 34.83 31.50 3kyc s MET 206 CO 0.39 0.34 -0.17 0.08 0.00 0.00 0.00 175.02 175.67 3kyc s VAL 207 N 0.09 2.54 0.15 -6.03 1.01 -0.76 -4.93 120.40 112.48 3kyc s VAL 207 Ca 0.21 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 3kyc s VAL 207 Cb -0.14 -2.05 -0.07 0.00 0.00 0.00 0.00 36.38 34.11 3kyc s VAL 207 CO 0.08 0.53 1.08 -0.54 0.00 0.00 0.00 175.10 176.25 3kyc s LYS 208 N 0.67 4.60 0.02 2.72 3.01 -1.26 -1.30 119.74 128.20 3kyc s LYS 208 Ca -0.08 1.67 -0.12 0.00 -1.01 0.00 0.00 55.97 56.42 3kyc s LYS 208 Cb -0.16 -3.30 0.01 0.00 -1.01 0.00 0.00 37.83 33.37 3kyc s LYS 208 CO 0.02 0.07 0.26 0.21 0.51 0.00 0.00 175.35 176.42 3kyc s LYS 209 N -0.17 0.70 0.02 1.68 2.20 -0.41 -4.99 119.74 118.77 3kyc s LYS 209 Ca 0.50 -0.45 0.03 0.00 -0.36 0.00 0.00 55.97 55.69 3kyc s LYS 209 Cb -0.28 0.30 -0.01 0.00 -1.51 0.00 0.00 37.83 36.32 3kyc s LYS 209 CO 0.33 -0.21 -0.08 0.21 -0.36 0.00 0.00 175.35 175.25 3kyc s LYS 210 N -2.10 0.59 -0.17 4.03 2.20 -1.26 -1.79 119.74 121.23 3kyc s LYS 210 Ca -0.08 -0.52 -0.14 0.00 -0.36 0.00 0.00 55.97 54.86 3kyc s LYS 210 Cb -0.03 -0.49 0.05 0.00 -1.51 0.00 0.00 37.83 35.84 3kyc s LYS 210 CO -0.01 0.12 0.44 0.54 -0.36 0.00 0.00 175.35 176.08 3kyc s VAL 211 N -0.73 -0.00 -0.19 4.02 0.11 -0.69 -5.02 120.40 117.90 3kyc s VAL 211 Ca -0.02 0.01 0.01 0.00 -2.93 0.00 0.00 61.98 59.05 3kyc s VAL 211 Cb -0.06 -0.62 0.02 0.00 -1.53 0.00 0.00 36.38 34.19 3kyc s VAL 211 CO 0.00 0.01 -0.19 -0.69 -3.33 0.00 0.00 175.10 170.90 3kyc s VAL 212 N 0.43 2.11 0.47 2.04 1.01 -1.26 -1.54 120.40 123.67 3kyc s VAL 212 Ca -0.02 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.05 3kyc s VAL 212 Cb -0.04 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.45 3kyc s VAL 212 CO -0.02 0.50 0.65 -0.36 0.00 0.00 0.00 175.10 175.86 3kyc s PHE 213 N 1.28 2.78 0.06 5.22 0.40 0.37 -4.99 117.98 123.11 3kyc s PHE 213 Ca 0.04 -0.28 0.01 0.00 -0.60 0.00 0.00 56.93 56.10 3kyc s PHE 213 Cb -0.14 -2.50 -0.03 0.00 0.51 0.00 0.00 43.02 40.86 3kyc s PHE 213 CO -0.12 -0.60 -0.06 0.00 0.70 0.00 0.00 175.22 175.14 3kyc n PRO 215 N 0.61 0.33 -0.16 0.00 -0.02 -1.26 -4.81 135.00 129.69 3kyc n PRO 215 Ca -0.17 0.12 -0.02 0.00 -2.02 0.00 0.00 63.50 61.41 3kyc n PRO 215 Cb 0.58 -1.31 0.07 0.00 -0.02 0.00 0.00 33.50 32.82 3kyc n PRO 215 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3kyc h VAL 216 N 0.55 0.70 -0.88 -1.45 2.07 -1.94 -2.24 116.25 113.06 3kyc h VAL 216 Ca -0.39 -0.07 0.10 0.00 0.82 0.00 0.00 66.70 67.15 3kyc h VAL 216 Cb 1.42 0.47 -0.12 0.00 -1.52 0.00 0.00 31.29 31.53 3kyc h VAL 216 CO 0.49 0.04 -0.53 0.50 0.02 0.00 0.00 177.57 178.09 3kyc h LYS 217 N 0.21 -0.07 0.00 1.57 3.64 -1.94 0.34 116.57 120.33 3kyc h LYS 217 Ca 0.25 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 3kyc h LYS 217 Cb 0.35 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 3kyc h LYS 217 CO -0.34 -0.05 -0.22 0.93 -2.27 0.00 0.00 179.45 177.50 3kyc h GLU 218 N -0.07 0.00 0.04 1.90 5.08 -1.79 -2.61 114.58 117.12 3kyc h GLU 218 Ca 0.19 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.28 3kyc h GLU 218 Cb 0.49 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.76 3kyc h GLU 218 CO -0.88 0.22 -1.07 0.00 -1.00 0.00 0.00 179.01 176.28 3kyc h ALA 219 N 1.78 0.07 0.00 3.43 0.00 -0.60 -3.30 119.26 120.64 3kyc h ALA 219 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.20 3kyc h ALA 219 Cb 0.43 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3kyc h ALA 219 CO 0.03 0.65 0.00 1.28 0.00 0.00 0.00 179.25 181.21 3kyc n LEU 220 N -3.87 0.00 -3.61 0.00 4.77 0.11 -4.38 117.00 110.01 3kyc n LEU 220 Ca -0.12 0.49 -0.27 0.00 -0.03 0.00 0.00 56.01 56.08 3kyc n LEU 220 Cb 0.90 -0.49 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 3kyc n LEU 220 CO 0.56 -0.02 -0.08 -0.62 -1.33 0.00 0.00 177.39 175.90 3kyc n GLU 221 N -1.49 1.64 -3.38 3.23 1.02 -0.99 -5.07 120.64 115.60 3kyc n GLU 221 Ca 0.07 -4.20 -0.38 0.00 -0.02 0.00 0.00 57.16 52.63 3kyc n GLU 221 Cb 0.32 -2.07 -0.06 0.00 -0.02 0.00 0.00 31.44 29.61 3kyc n GLU 221 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3kyc s VAL 222 N -1.47 4.99 -0.78 2.62 1.01 -1.26 -4.80 120.40 120.71 3kyc s VAL 222 Ca 0.31 0.98 -0.26 0.00 0.00 0.00 0.00 61.98 63.01 3kyc s VAL 222 Cb 0.05 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.66 3kyc s VAL 222 CO -0.13 0.50 1.36 -0.62 0.00 0.00 0.00 175.10 176.21 3kyc s ASP 223 N -0.59 6.14 0.09 3.32 3.68 -1.26 -4.81 116.67 123.24 3kyc s ASP 223 Ca 0.26 -0.58 0.27 0.00 2.13 0.00 0.00 52.55 54.63 3kyc s ASP 223 Cb -0.17 -2.56 0.85 0.00 -1.45 0.00 0.00 42.92 39.59 3kyc s ASP 223 CO 0.14 -1.83 1.71 0.79 0.13 0.00 0.00 175.17 176.11 3kyc n TRP 224 N 9.60 0.42 0.67 -5.34 7.02 -1.26 -3.93 117.44 124.62 3kyc n TRP 224 Ca 0.10 0.12 0.00 0.00 -1.02 0.00 0.00 57.50 56.71 3kyc n TRP 224 Cb 0.50 -0.65 0.00 0.00 -2.42 0.00 0.00 31.31 28.74 3kyc n TRP 224 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 3kyc n SER 225 N -1.87 1.97 -3.22 -0.99 2.88 -1.26 -3.70 113.62 107.43 3kyc n SER 225 Ca 0.06 -1.34 -0.12 0.00 -1.33 0.00 0.00 58.87 56.14 3kyc n SER 225 Cb 0.39 -0.34 -0.00 0.00 -0.75 0.00 0.00 64.21 63.51 3kyc n SER 225 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3kyc n SER 226 N 0.65 1.90 -0.12 -3.46 2.88 -1.25 -5.03 113.62 109.19 3kyc n SER 226 Ca 0.00 -1.85 -0.24 0.00 -1.33 0.00 0.00 58.87 55.45 3kyc n SER 226 Cb 0.33 0.01 -0.11 0.00 -0.75 0.00 0.00 64.21 63.69 3kyc n SER 226 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3kyc n GLU 227 N -0.98 0.62 -0.02 -1.46 4.07 -1.26 -3.30 120.64 118.31 3kyc n GLU 227 Ca -0.02 0.27 -0.12 0.00 -0.06 0.00 0.00 57.16 57.22 3kyc n GLU 227 Cb 0.27 -1.55 -0.06 0.00 -0.06 0.00 0.00 31.44 30.04 3kyc n GLU 227 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 3kyc h LYS 228 N -0.59 -0.46 0.35 5.31 1.63 -1.97 -2.70 116.57 118.14 3kyc h LYS 228 Ca -0.60 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.22 3kyc h LYS 228 Cb 1.70 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 33.43 3kyc h LYS 228 CO -0.25 -0.31 -0.33 0.00 -3.45 0.00 0.00 179.45 175.11 3kyc h ALA 229 N 0.13 -1.03 -0.17 5.00 0.00 -1.84 -1.34 119.26 120.01 3kyc h ALA 229 Ca 0.08 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3kyc h ALA 229 Cb 0.63 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3kyc h ALA 229 CO -0.42 -1.05 0.18 0.87 0.00 0.00 0.00 179.25 178.83 3kyc h LYS 230 N -0.67 0.00 -0.07 0.00 1.79 -1.63 0.77 116.57 116.76 3kyc h LYS 230 Ca -0.05 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 3kyc h LYS 230 Cb 0.58 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.23 3kyc h LYS 230 CO -0.03 0.00 -0.05 0.00 -1.08 0.00 0.00 179.45 178.29 3kyc h ALA 231 N 1.81 0.10 0.00 3.86 0.00 -1.11 -3.30 119.26 120.62 3kyc h ALA 231 Ca 0.08 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3kyc h ALA 231 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3kyc h ALA 231 CO -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.13 3kyc h ALA 232 N 0.59 1.00 0.00 0.00 0.00 0.09 -3.18 119.26 117.76 3kyc h ALA 232 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3kyc h ALA 232 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3kyc h ALA 232 CO 0.01 0.00 -0.06 1.25 0.00 0.00 0.00 179.25 180.46 3kyc h LEU 233 N 0.00 0.00 -0.80 0.00 5.85 -1.01 -1.30 115.31 118.05 3kyc h LEU 233 Ca 0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3kyc h LEU 233 Cb 0.75 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 3kyc h LEU 233 CO 0.00 0.06 0.52 0.11 -0.34 0.00 0.00 178.44 178.78 3kyc h LYS 234 N 0.00 0.98 -0.56 1.25 6.56 -1.71 -2.96 116.57 120.13 3kyc h LYS 234 Ca -0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 3kyc h LYS 234 Cb 0.21 -0.22 0.00 0.00 -0.57 0.00 0.00 32.23 31.65 3kyc h LYS 234 CO 0.01 0.65 0.00 0.54 -2.06 0.00 0.00 179.45 178.59 3kyc n ARG 235 N -4.58 2.57 -3.74 3.15 1.74 -0.49 -4.90 116.66 110.41 3kyc n ARG 235 Ca 0.09 -1.81 -0.38 0.00 -0.77 0.00 0.00 57.85 54.99 3kyc n ARG 235 Cb 0.08 -1.58 -0.12 0.00 -1.02 0.00 0.00 32.46 29.82 3kyc n ARG 235 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3kyc s THR 236 N -1.62 3.68 0.27 0.55 2.01 -1.12 -5.08 115.64 114.32 3kyc s THR 236 Ca 0.33 -1.46 -0.27 0.00 0.31 0.00 0.00 61.69 60.60 3kyc s THR 236 Cb 0.20 -3.24 -0.16 0.00 0.01 0.00 0.00 72.50 69.32 3kyc s THR 236 CO 0.18 -0.38 0.60 1.07 -0.69 0.00 0.00 174.62 175.40 3kyc n THR 237 N 4.77 1.84 0.31 -0.82 5.66 -1.26 -4.81 114.28 119.96 3kyc n THR 237 Ca -0.10 -0.50 0.19 0.00 -3.05 0.00 0.00 64.05 60.60 3kyc n THR 237 Cb 0.43 -0.31 0.95 0.00 -1.55 0.00 0.00 70.33 69.85 3kyc n THR 237 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 3kyc h SER 238 N 1.15 0.00 -0.52 1.09 4.64 -1.97 -2.66 113.55 115.27 3kyc h SER 238 Ca -0.33 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.04 3kyc h SER 238 Cb 1.41 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.47 3kyc h SER 238 CO 0.56 0.02 0.35 0.44 -0.87 0.00 0.00 176.83 177.33 3kyc h ASP 239 N 0.00 0.45 -0.94 4.97 5.19 -1.95 0.52 116.42 124.66 3kyc h ASP 239 Ca -0.00 -0.00 0.24 0.00 -0.62 0.00 0.00 57.03 56.65 3kyc h ASP 239 Cb 0.25 -0.10 -0.06 0.00 0.18 0.00 0.00 39.33 39.59 3kyc h ASP 239 CO 0.00 0.30 0.64 0.22 -3.12 0.00 0.00 179.24 177.28 3kyc h TYR 240 N 0.52 0.40 0.12 4.55 3.20 -1.82 0.27 116.97 124.21 3kyc h TYR 240 Ca 0.22 0.01 -0.35 0.00 3.14 0.00 0.00 58.73 61.75 3kyc h TYR 240 Cb 0.22 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 3kyc h TYR 240 CO -0.00 0.08 -1.93 1.19 -1.64 0.00 0.00 178.16 175.87 3kyc n PHE 241 N -4.46 1.28 -0.35 -3.82 3.01 0.16 -3.23 117.46 110.05 3kyc n PHE 241 Ca 0.21 0.29 0.24 0.00 1.01 0.00 0.00 57.45 59.20 3kyc n PHE 241 Cb 0.83 -1.16 0.51 0.00 -0.01 0.00 0.00 39.48 39.64 3kyc n PHE 241 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 3kyc h LEU 242 N -0.02 0.46 0.64 4.37 5.85 -0.52 -1.39 115.31 124.70 3kyc h LEU 242 Ca -0.41 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 3kyc h LEU 242 Cb 1.98 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 3kyc h LEU 242 CO 0.07 0.02 -0.46 0.25 -0.34 0.00 0.00 178.44 177.99 3kyc h LEU 243 N 0.37 -1.18 -0.55 2.25 5.85 -0.44 -1.96 115.31 119.65 3kyc h LEU 243 Ca 0.65 0.08 0.11 0.00 0.84 0.00 0.00 57.88 59.56 3kyc h LEU 243 Cb 1.65 0.36 -0.10 0.00 0.37 0.00 0.00 40.66 42.94 3kyc h LEU 243 CO -0.38 -0.67 -0.04 1.56 -0.34 0.00 0.00 178.44 178.57 3kyc h GLN 244 N -1.05 0.08 -0.39 1.25 1.08 -1.25 0.36 115.11 115.19 3kyc h GLN 244 Ca -0.08 -0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.20 3kyc h GLN 244 Cb 0.87 -0.02 -0.08 0.00 -0.05 0.00 0.00 27.48 28.20 3kyc h GLN 244 CO 0.04 0.05 -0.19 0.28 -0.95 0.00 0.00 178.83 178.06 3kyc h VAL 245 N 0.08 0.44 -0.21 -0.54 2.07 -1.35 -1.32 116.25 115.41 3kyc h VAL 245 Ca 0.28 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.61 3kyc h VAL 245 Cb 0.43 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3kyc h VAL 245 CO -0.49 0.00 -0.61 -0.07 0.02 0.00 0.00 177.57 176.41 3kyc h LEU 246 N -0.12 0.83 -1.11 2.57 3.38 0.05 -1.78 115.31 119.13 3kyc h LEU 246 Ca 0.19 -0.47 0.01 0.00 0.09 0.00 0.00 57.88 57.70 3kyc h LEU 246 Cb 0.41 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 3kyc h LEU 246 CO -0.46 1.24 0.58 -0.07 0.09 0.00 0.00 178.44 179.82 3kyc h LEU 247 N 0.54 1.03 0.25 1.67 3.38 -0.13 -2.56 115.31 119.49 3kyc h LEU 247 Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3kyc h LEU 247 Cb 1.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3kyc h LEU 247 CO 0.13 0.76 -0.12 0.50 0.09 0.00 0.00 178.44 179.79 3kyc h LYS 248 N 1.21 -0.32 0.00 1.13 1.63 -0.74 -0.75 116.57 118.74 3kyc h LYS 248 Ca 0.33 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 3kyc h LYS 248 Cb -0.12 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 3kyc h LYS 248 CO -0.07 -0.04 0.27 0.35 -3.45 0.00 0.00 179.45 176.51 3kyc h PHE 249 N -0.59 0.00 0.07 1.91 3.57 -1.21 0.23 116.94 120.92 3kyc h PHE 249 Ca -0.03 0.00 -0.37 0.00 3.53 0.00 0.00 57.97 61.10 3kyc h PHE 249 Cb 0.43 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.13 3kyc h PHE 249 CO 0.01 0.00 -2.15 -2.13 -2.23 0.00 0.00 178.31 171.81 3kyc n ARG 250 N -2.30 0.72 0.04 1.11 0.63 -0.76 -3.62 116.66 112.48 3kyc n ARG 250 Ca -0.01 0.22 -0.13 0.00 -0.92 0.00 0.00 57.85 57.01 3kyc n ARG 250 Cb 0.30 -1.65 -0.09 0.00 0.45 0.00 0.00 32.46 31.48 3kyc n ARG 250 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 3kyc h THR 251 N 0.04 1.12 -2.17 5.15 2.02 0.76 0.11 112.91 119.95 3kyc h THR 251 Ca -0.47 -0.78 -0.76 0.00 0.77 0.00 0.00 66.41 65.17 3kyc h THR 251 Cb 2.00 1.62 -0.20 0.00 -1.74 0.00 0.00 68.15 69.83 3kyc h THR 251 CO 0.03 0.19 1.41 0.47 0.37 0.00 0.00 175.52 177.99 3kyc n ASP 252 N -4.97 5.37 0.00 4.18 8.00 0.34 -3.85 116.55 125.62 3kyc n ASP 252 Ca -0.08 -3.09 0.00 0.00 0.71 0.00 0.00 54.79 52.33 3kyc n ASP 252 Cb 0.21 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.84 3kyc n ASP 252 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3kyc n LYS 253 N 4.06 0.00 -1.62 -1.24 0.00 -1.24 -4.65 118.16 113.47 3kyc n LYS 253 Ca 0.35 0.00 -0.19 0.00 0.00 0.00 0.00 58.31 58.47 3kyc n LYS 253 Cb 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.34 3kyc n LYS 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3kyc n GLY 254 N 0.00 1.67 3.63 3.14 0.00 0.39 -4.91 105.19 109.11 3kyc n GLY 254 Ca 0.00 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 3kyc n GLY 254 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kyc s ARG 255 N -3.72 1.53 0.28 1.61 1.70 -1.25 -5.05 118.95 114.05 3kyc s ARG 255 Ca 0.00 -0.92 0.00 0.00 -0.47 0.00 0.00 55.73 54.35 3kyc s ARG 255 Cb 0.00 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 3kyc s ARG 255 CO 0.00 -0.67 0.47 -0.51 -1.08 0.00 0.00 175.30 173.52 3kyc s ASP 256 N -2.90 6.34 -0.40 -2.89 1.01 -1.26 -4.23 116.67 112.34 3kyc s ASP 256 Ca 0.11 0.40 -0.44 0.00 0.71 0.00 0.00 52.55 53.32 3kyc s ASP 256 Cb -0.03 -2.01 -0.19 0.00 1.01 0.00 0.00 42.92 41.71 3kyc s ASP 256 CO 0.01 -0.18 1.62 -2.65 0.21 0.00 0.00 175.17 174.18 3kyc n PRO 257 N -1.34 0.38 -3.00 8.23 -0.02 -1.26 -4.92 135.00 133.07 3kyc n PRO 257 Ca -0.05 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.35 3kyc n PRO 257 Cb 0.55 -1.70 0.01 0.00 -0.02 0.00 0.00 33.50 32.35 3kyc n PRO 257 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kyc s SER 258 N 2.99 5.75 -0.23 2.55 0.15 -1.26 -2.41 113.70 121.24 3kyc s SER 258 Ca 1.02 0.14 -0.18 0.00 0.70 0.00 0.00 55.95 57.63 3kyc s SER 258 Cb -1.34 -1.34 -0.15 0.00 -1.71 0.00 0.00 66.02 61.47 3kyc s SER 258 CO 0.75 -0.74 -0.01 -1.54 1.20 0.00 0.00 173.24 172.90 3kyc n SER 259 N -2.05 1.89 -1.80 5.45 3.41 -1.26 -3.92 113.62 115.34 3kyc n SER 259 Ca 0.02 0.41 -0.00 0.00 -0.26 0.00 0.00 58.87 59.04 3kyc n SER 259 Cb 0.58 -0.91 -0.00 0.00 -0.26 0.00 0.00 64.21 63.62 3kyc n SER 259 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3kyc n ASP 260 N -4.39 2.14 -0.73 4.04 5.75 -1.26 0.03 116.55 122.13 3kyc n ASP 260 Ca -0.37 -1.57 -0.03 0.00 -0.01 0.00 0.00 54.79 52.81 3kyc n ASP 260 Cb 0.71 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.31 3kyc n ASP 260 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 3kyc n THR 261 N 1.81 0.00 -0.14 2.12 5.66 -1.26 -5.06 114.28 117.41 3kyc n THR 261 Ca 0.00 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 3kyc n THR 261 Cb 0.20 0.23 -0.10 0.00 -1.55 0.00 0.00 70.33 69.12 3kyc n THR 261 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 175.07 172.24 3kyc h TYR 262 N 0.00 -1.67 -0.37 1.09 3.20 -0.52 -2.28 116.97 116.42 3kyc h TYR 262 Ca -0.27 0.08 0.07 0.00 3.14 0.00 0.00 58.73 61.76 3kyc h TYR 262 Cb 1.19 0.78 -0.09 0.00 1.54 0.00 0.00 36.73 40.16 3kyc h TYR 262 CO -0.24 -0.48 -0.33 0.93 -1.64 0.00 0.00 178.16 176.40 3kyc h GLU 263 N -0.38 -0.26 -0.39 1.82 4.39 -1.93 0.26 114.58 118.09 3kyc h GLU 263 Ca 0.07 0.02 0.08 0.00 0.34 0.00 0.00 59.36 59.87 3kyc h GLU 263 Cb 0.58 0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 29.20 3kyc h GLU 263 CO -0.59 -0.17 -0.17 1.49 -1.16 0.00 0.00 179.01 178.41 3kyc h GLU 264 N -0.27 -0.09 -0.21 2.33 4.81 -1.93 -3.14 114.58 116.08 3kyc h GLU 264 Ca 0.16 0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.21 3kyc h GLU 264 Cb 0.54 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.94 3kyc h GLU 264 CO -0.52 -0.06 -0.63 -0.44 -0.73 0.00 0.00 179.01 176.64 3kyc h ASP 265 N -0.09 0.83 -0.70 1.04 3.32 -0.55 -3.12 116.42 117.15 3kyc h ASP 265 Ca 0.19 -0.48 0.13 0.00 0.02 0.00 0.00 57.03 56.88 3kyc h ASP 265 Cb 0.39 -0.24 -0.09 0.00 0.22 0.00 0.00 39.33 39.61 3kyc h ASP 265 CO -0.45 1.26 0.26 0.28 -1.72 0.00 0.00 179.24 178.87 3kyc h SER 266 N 0.54 0.24 -0.22 6.45 0.02 -0.51 -1.42 113.55 118.64 3kyc h SER 266 Ca -0.01 0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 3kyc h SER 266 Cb 1.22 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 3kyc h SER 266 CO 0.13 0.10 -0.10 -0.33 -1.14 0.00 0.00 176.83 175.50 3kyc h GLU 267 N 0.42 0.46 -0.64 3.45 4.39 -1.55 -1.12 114.58 119.99 3kyc h GLU 267 Ca 0.38 -0.20 0.10 0.00 0.34 0.00 0.00 59.36 59.98 3kyc h GLU 267 Cb 0.54 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.10 3kyc h GLU 267 CO -0.38 0.73 0.25 1.25 -1.16 0.00 0.00 179.01 179.70 3kyc h LEU 268 N 0.18 0.24 0.28 1.33 5.85 -1.40 0.97 115.31 122.76 3kyc h LEU 268 Ca 0.05 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 3kyc h LEU 268 Cb 0.59 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 3kyc h LEU 268 CO 0.03 0.14 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.01 3kyc h LEU 269 N 0.43 -0.47 -0.63 2.25 3.38 -1.03 -1.35 115.31 117.88 3kyc h LEU 269 Ca 0.33 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.44 3kyc h LEU 269 Cb 0.42 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 3kyc h LEU 269 CO -0.32 -0.29 0.19 -0.07 0.09 0.00 0.00 178.44 178.04 3kyc h LEU 270 N -0.46 0.14 0.00 1.67 3.38 -0.27 -1.46 115.31 118.31 3kyc h LEU 270 Ca -0.02 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3kyc h LEU 270 Cb 0.39 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3kyc h LEU 270 CO 0.01 0.07 0.00 1.67 0.09 0.00 0.00 178.44 180.29 3kyc n GLN 271 N -5.06 0.00 -0.32 1.13 -0.06 0.25 -3.46 117.38 109.86 3kyc n GLN 271 Ca 0.10 0.47 0.22 0.00 -2.00 0.00 0.00 57.00 55.79 3kyc n GLN 271 Cb 0.32 -1.28 0.43 0.00 -4.06 0.00 0.00 30.24 25.64 3kyc n GLN 271 CO 0.00 0.00 0.00 0.82 -0.20 0.00 0.00 177.06 177.68 3kyc h ILE 272 N 0.00 0.13 -0.52 1.69 2.04 -1.02 0.95 117.51 120.78 3kyc h ILE 272 Ca 0.00 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3kyc h ILE 272 Cb 0.00 0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.03 3kyc h ILE 272 CO 0.00 0.02 -0.31 -1.14 0.00 0.00 0.00 178.15 176.72 3kyc n ARG 273 N -5.27 -0.23 -0.08 2.37 0.63 -0.57 -2.57 116.66 110.94 3kyc n ARG 273 Ca 0.29 1.19 -0.07 0.00 -0.92 0.00 0.00 57.85 58.34 3kyc n ARG 273 Cb 0.96 -1.76 -0.00 0.00 0.45 0.00 0.00 32.46 32.12 3kyc n ARG 273 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 3kyc h ASN 274 N 0.00 -0.15 -0.69 6.15 4.21 -0.89 -1.18 115.58 123.03 3kyc h ASN 274 Ca 0.08 0.07 0.08 0.00 1.21 0.00 0.00 56.30 57.75 3kyc h ASN 274 Cb 0.21 0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 37.50 3kyc h ASN 274 CO -0.49 -0.04 0.45 0.44 -1.29 0.00 0.00 177.43 176.50 3kyc h ASP 275 N 0.07 0.56 0.34 5.81 3.32 -1.56 0.25 116.42 125.21 3kyc h ASP 275 Ca 0.14 0.01 -0.33 0.00 0.02 0.00 0.00 57.03 56.87 3kyc h ASP 275 Cb 0.20 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.64 3kyc h ASP 275 CO -0.25 0.35 -1.58 0.58 -1.72 0.00 0.00 179.24 176.61 3kyc h VAL 276 N 0.63 1.12 -0.40 -1.35 2.07 -1.18 -3.06 116.25 114.07 3kyc h VAL 276 Ca 0.31 -2.70 0.01 0.00 0.82 0.00 0.00 66.70 65.13 3kyc h VAL 276 Cb 0.39 2.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.95 3kyc h VAL 276 CO -0.10 0.83 0.26 -0.07 0.02 0.00 0.00 177.57 178.51 3kyc h LEU 277 N 0.09 0.45 -0.62 2.57 3.38 -0.95 -2.92 115.31 117.32 3kyc h LEU 277 Ca -0.27 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 57.80 3kyc h LEU 277 Cb 2.07 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 42.59 3kyc h LEU 277 CO 0.19 0.33 -0.33 0.44 0.09 0.00 0.00 178.44 179.16 3kyc h ASP 278 N 0.54 -1.14 0.00 -0.43 5.19 -1.04 -0.14 116.42 119.40 3kyc h ASP 278 Ca 0.15 0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.79 3kyc h ASP 278 Cb -0.05 0.58 0.00 0.00 0.18 0.00 0.00 39.33 40.03 3kyc h ASP 278 CO -0.04 -0.30 0.00 -1.54 -3.12 0.00 0.00 179.24 174.24 3kyc n SER 279 N -5.44 0.00 0.00 6.45 3.41 -1.10 -2.67 113.62 114.27 3kyc n SER 279 Ca 0.05 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.88 3kyc n SER 279 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3kyc n SER 279 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kyc n LEU 280 N -0.94 0.00 0.00 1.04 4.77 -1.19 -5.08 117.00 115.60 3kyc n LEU 280 Ca 0.15 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3kyc n LEU 280 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3kyc n LEU 280 CO 0.11 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 3kyc n GLY 281 N 0.55 0.69 3.36 -0.72 0.00 -0.41 -4.05 105.19 104.62 3kyc n GLY 281 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3kyc n GLY 281 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kyc s ILE 282 N -0.98 2.63 -0.32 -0.61 -1.09 -0.20 -5.02 121.20 115.61 3kyc s ILE 282 Ca 0.00 -0.86 -0.29 0.00 -2.23 0.00 0.00 60.65 57.28 3kyc s ILE 282 Cb 0.00 -2.02 -0.01 0.00 -1.58 0.00 0.00 42.46 38.85 3kyc s ILE 282 CO 0.00 0.57 1.64 -0.94 -1.23 0.00 0.00 174.94 174.97 3kyc s SER 283 N -0.25 6.15 0.00 3.58 1.04 -1.26 -4.46 113.70 118.50 3kyc s SER 283 Ca 0.00 1.25 0.00 0.00 0.48 0.00 0.00 55.95 57.68 3kyc s SER 283 Cb -0.13 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.46 3kyc s SER 283 CO 0.03 -1.51 0.00 -2.65 0.98 0.00 0.00 173.24 170.09 3kyc n PRO 284 N 8.12 0.00 -0.00 4.02 -0.02 -1.26 -0.34 135.00 145.52 3kyc n PRO 284 Ca 0.20 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3kyc n PRO 284 Cb 0.47 -0.86 -0.00 0.00 -0.02 0.00 0.00 33.50 33.09 3kyc n PRO 284 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3kyc n ASP 285 N 0.00 0.44 0.27 2.55 5.75 -1.26 -4.69 116.55 119.62 3kyc n ASP 285 Ca 0.00 -0.47 0.13 0.00 -0.01 0.00 0.00 54.79 54.44 3kyc n ASP 285 Cb 0.00 1.00 0.79 0.00 -1.03 0.00 0.00 41.12 41.88 3kyc n ASP 285 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3kyc h LEU 286 N 0.00 0.00 -8.32 -2.12 3.38 -1.07 -2.94 115.31 104.24 3kyc h LEU 286 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 3kyc h LEU 286 Cb 0.01 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.50 3kyc h LEU 286 CO 0.00 0.06 -0.55 -0.22 0.09 0.00 0.00 178.44 177.83 3kyc s LEU 287 N -7.72 4.55 0.29 1.67 2.96 -1.26 -4.73 118.68 114.44 3kyc s LEU 287 Ca -0.04 -1.02 -0.15 0.00 -0.22 0.00 0.00 54.13 52.70 3kyc s LEU 287 Cb 0.15 -1.97 -0.11 0.00 0.50 0.00 0.00 46.19 44.76 3kyc s LEU 287 CO 0.58 -0.36 0.04 -2.65 -1.32 0.00 0.00 176.35 172.65 3kyc n PRO 288 N 4.93 0.00 0.00 0.98 -0.02 -1.11 -4.85 135.00 134.93 3kyc n PRO 288 Ca -0.12 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.51 3kyc n PRO 288 Cb 0.46 -0.71 0.69 0.00 -0.02 0.00 0.00 33.50 33.92 3kyc n PRO 288 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3kyc n GLU 289 N 0.96 1.19 -0.01 -0.52 2.13 -1.26 -3.96 120.64 119.17 3kyc n GLU 289 Ca 0.08 -0.45 0.09 0.00 0.66 0.00 0.00 57.16 57.53 3kyc n GLU 289 Cb 0.29 -1.49 -0.13 0.00 0.27 0.00 0.00 31.44 30.38 3kyc n GLU 289 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 3kyc n ASP 290 N -0.52 0.95 -0.31 4.31 5.75 -1.26 -4.58 116.55 120.89 3kyc n ASP 290 Ca 0.19 -0.18 0.23 0.00 -0.01 0.00 0.00 54.79 55.03 3kyc n ASP 290 Cb 0.25 1.65 0.43 0.00 -1.03 0.00 0.00 41.12 42.42 3kyc n ASP 290 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 3kyc n PHE 291 N -1.97 0.87 -0.60 2.11 1.16 -1.25 -2.49 117.46 115.29 3kyc n PHE 291 Ca -0.02 1.13 0.48 0.00 -1.87 0.00 0.00 57.45 57.17 3kyc n PHE 291 Cb 0.42 -1.38 0.73 0.00 -1.61 0.00 0.00 39.48 37.65 3kyc n PHE 291 CO 0.00 0.00 0.00 -0.39 -1.87 0.00 0.00 176.76 174.50 3kyc h VAL 292 N 0.00 0.00 -0.22 1.97 -1.51 -1.90 -0.91 116.25 113.69 3kyc h VAL 292 Ca 0.70 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 66.12 3kyc h VAL 292 Cb 1.69 0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 3kyc h VAL 292 CO -0.80 0.00 -0.06 0.03 -1.23 0.00 0.00 177.57 175.51 3kyc h ARG 293 N 0.00 0.42 -2.28 5.19 3.08 -1.87 -3.37 114.38 115.55 3kyc h ARG 293 Ca 0.84 -0.16 -0.64 0.00 0.07 0.00 0.00 59.98 60.09 3kyc h ARG 293 Cb 3.60 -0.02 -0.39 0.00 0.08 0.00 0.00 29.97 33.24 3kyc h ARG 293 CO -0.01 0.67 -0.28 2.48 -1.07 0.00 0.00 179.97 181.76 3kyc n TYR 294 N -4.59 3.79 -2.44 3.04 0.18 -0.34 -4.44 117.16 112.34 3kyc n TYR 294 Ca -0.04 -3.69 -0.03 0.00 1.88 0.00 0.00 57.90 56.01 3kyc n TYR 294 Cb 0.29 -0.64 0.04 0.00 -0.38 0.00 0.00 39.34 38.65 3kyc n TYR 294 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3kyc s PHE 296 N -0.42 3.16 0.00 0.00 0.40 -1.26 -3.57 117.98 116.30 3kyc s PHE 296 Ca 0.11 0.09 0.00 0.00 -0.60 0.00 0.00 56.93 56.53 3kyc s PHE 296 Cb 0.27 -1.87 0.00 0.00 0.51 0.00 0.00 43.02 41.93 3kyc s PHE 296 CO -0.08 0.33 0.00 0.45 0.70 0.00 0.00 175.22 176.62 3kyc n SER 297 N 2.63 0.00 -3.81 1.36 2.88 -1.01 -3.22 113.62 112.44 3kyc n SER 297 Ca -0.18 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.17 3kyc n SER 297 Cb 0.53 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.83 3kyc n SER 297 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3kyc s GLU 298 N 0.00 0.47 -0.32 -1.46 2.02 -1.26 -0.53 118.70 117.63 3kyc s GLU 298 Ca 0.00 0.06 -0.24 0.00 0.02 0.00 0.00 54.97 54.81 3kyc s GLU 298 Cb 0.00 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.55 3kyc s GLU 298 CO 0.00 -0.17 0.80 -1.64 0.02 0.00 0.00 175.26 174.27 3kyc s MET 299 N 1.30 3.93 0.28 1.61 -1.94 -1.09 -4.91 119.30 118.48 3kyc s MET 299 Ca -0.06 0.56 -0.03 0.00 -1.71 0.00 0.00 55.69 54.46 3kyc s MET 299 Cb -0.13 -3.74 0.59 0.00 2.01 0.00 0.00 34.83 33.56 3kyc s MET 299 CO -0.02 -0.72 1.61 0.00 -0.01 0.00 0.00 175.02 175.88 3kyc h ALA 300 N 8.17 0.98 0.00 3.03 0.00 -2.00 0.22 119.26 129.66 3kyc h ALA 300 Ca -0.24 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3kyc h ALA 300 Cb 1.09 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 3kyc h ALA 300 CO 0.89 -0.48 -0.23 -1.35 0.00 0.00 0.00 179.25 178.08 3kyc h PRO 301 N 0.07 0.00 -0.31 0.00 0.11 -1.97 -1.87 132.00 128.03 3kyc h PRO 301 Ca 0.50 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.52 3kyc h PRO 301 Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 3kyc h PRO 301 CO -0.79 0.23 -0.17 0.28 -0.21 0.00 0.00 178.00 177.33 3kyc h VAL 302 N 0.00 1.29 -0.60 3.15 2.07 -0.89 -1.95 116.25 119.32 3kyc h VAL 302 Ca -0.00 -1.29 0.12 0.00 0.82 0.00 0.00 66.70 66.35 3kyc h VAL 302 Cb 0.46 1.45 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 3kyc h VAL 302 CO 0.03 0.42 0.07 0.00 0.02 0.00 0.00 177.57 178.11 3kyc h ALA 304 N 1.51 -0.30 0.46 0.00 0.00 -1.30 0.29 119.26 119.92 3kyc h ALA 304 Ca 0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3kyc h ALA 304 Cb 0.50 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3kyc h ALA 304 CO -0.46 -0.69 -0.22 0.28 0.00 0.00 0.00 179.25 178.16 3kyc h VAL 305 N -0.33 0.55 -0.31 0.00 2.07 -0.87 0.19 116.25 117.55 3kyc h VAL 305 Ca 0.00 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.37 3kyc h VAL 305 Cb 0.31 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3kyc h VAL 305 CO -0.04 0.01 -0.26 0.58 0.02 0.00 0.00 177.57 177.88 3kyc h VAL 306 N -0.64 1.27 -0.14 2.57 2.07 -1.20 -1.17 116.25 119.01 3kyc h VAL 306 Ca -0.06 -1.34 -0.12 0.00 0.82 0.00 0.00 66.70 66.00 3kyc h VAL 306 Cb 0.49 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 3kyc h VAL 306 CO 0.10 0.43 -0.44 1.23 0.02 0.00 0.00 177.57 178.92 3kyc h GLY 307 N 1.01 0.35 0.88 2.17 0.00 -0.36 0.76 103.07 107.87 3kyc h GLY 307 Ca 0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3kyc h GLY 307 CO 0.06 0.32 -0.24 -1.33 0.00 0.00 0.00 176.54 175.35 3kyc h GLY 308 N 1.22 -0.61 1.00 4.60 0.00 0.14 -1.34 103.07 108.08 3kyc h GLY 308 Ca 0.02 0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.59 3kyc h GLY 308 CO 0.07 -0.23 -0.24 -2.22 0.00 0.00 0.00 176.54 173.92 3kyc h ILE 309 N -0.58 0.51 0.11 2.60 1.08 -1.08 -2.34 117.51 117.80 3kyc h ILE 309 Ca -0.04 -0.02 0.01 0.00 -0.39 0.00 0.00 64.86 64.42 3kyc h ILE 309 Cb 0.49 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 34.74 3kyc h ILE 309 CO 0.03 0.00 -0.14 0.25 -0.69 0.00 0.00 178.15 177.60 3kyc h LEU 310 N -0.68 -0.39 -0.88 1.44 5.85 -0.94 0.18 115.31 119.89 3kyc h LEU 310 Ca -0.07 0.04 0.21 0.00 0.84 0.00 0.00 57.88 58.90 3kyc h LEU 310 Cb 0.52 0.15 -0.12 0.00 0.37 0.00 0.00 40.66 41.58 3kyc h LEU 310 CO 0.11 -0.21 0.38 0.00 -0.34 0.00 0.00 178.44 178.38 3kyc h ALA 311 N 0.56 1.39 -0.23 1.25 0.00 -1.25 -0.01 119.26 120.96 3kyc h ALA 311 Ca 0.02 0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.91 3kyc h ALA 311 Cb 0.30 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3kyc h ALA 311 CO -0.06 -0.32 -0.53 0.37 0.00 0.00 0.00 179.25 178.70 3kyc h GLN 312 N 0.41 0.69 -0.72 0.00 5.75 -0.72 -0.70 115.11 119.81 3kyc h GLN 312 Ca 0.54 -0.42 0.08 0.00 -0.15 0.00 0.00 58.65 58.70 3kyc h GLN 312 Cb 1.00 0.05 -0.07 0.00 1.07 0.00 0.00 27.48 29.53 3kyc h GLN 312 CO -0.51 1.04 0.39 0.93 -2.65 0.00 0.00 178.83 178.03 3kyc h GLU 313 N 0.53 0.65 -0.36 1.69 4.39 0.59 -0.80 114.58 121.27 3kyc h GLU 313 Ca 0.01 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 3kyc h GLU 313 Cb 1.10 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.59 3kyc h GLU 313 CO 0.11 0.43 0.11 0.82 -1.16 0.00 0.00 179.01 179.32 3kyc h ILE 314 N 0.67 1.21 -0.49 3.13 2.04 -0.42 -0.88 117.51 122.78 3kyc h ILE 314 Ca 0.35 -0.71 0.07 0.00 1.00 0.00 0.00 64.86 65.57 3kyc h ILE 314 Cb 0.31 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 3kyc h ILE 314 CO -0.24 0.24 0.17 0.58 0.00 0.00 0.00 178.15 178.91 3kyc h VAL 315 N 0.43 0.83 -0.19 1.67 2.07 -0.68 -0.91 116.25 119.47 3kyc h VAL 315 Ca 0.12 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.54 3kyc h VAL 315 Cb 0.27 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 3kyc h VAL 315 CO -0.00 0.06 0.02 0.50 0.02 0.00 0.00 177.57 178.17 3kyc h LYS 316 N 0.34 0.09 -0.79 1.57 3.64 -0.97 -2.06 116.57 118.39 3kyc h LYS 316 Ca 0.24 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.71 3kyc h LYS 316 Cb 0.26 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.98 3kyc h LYS 316 CO -0.25 0.06 0.43 0.00 -2.27 0.00 0.00 179.45 177.42 3kyc h ALA 317 N 1.15 1.13 0.05 5.00 0.00 -0.01 -0.36 119.26 126.22 3kyc h ALA 317 Ca 0.09 0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 3kyc h ALA 317 Cb 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3kyc h ALA 317 CO -0.13 0.02 -1.04 -0.07 0.00 0.00 0.00 179.25 178.03 3kyc h LEU 318 N 0.70 0.26 -0.27 0.00 3.38 -0.87 -3.15 115.31 115.36 3kyc h LEU 318 Ca 0.39 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3kyc h LEU 318 Cb 0.41 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3kyc h LEU 318 CO -0.27 1.14 -0.40 -1.54 0.09 0.00 0.00 178.44 177.46 3kyc n SER 319 N -3.53 0.82 -3.06 -0.43 3.41 -0.81 -4.63 113.62 105.38 3kyc n SER 319 Ca -0.05 -0.62 -0.21 0.00 -0.26 0.00 0.00 58.87 57.73 3kyc n SER 319 Cb 0.92 0.23 0.01 0.00 -0.26 0.00 0.00 64.21 65.11 3kyc n SER 319 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kyc n GLN 320 N -1.04 -3.66 -4.74 4.33 6.02 -0.15 -4.78 117.38 113.36 3kyc n GLN 320 Ca 0.09 0.66 -0.33 0.00 -0.01 0.00 0.00 57.00 57.41 3kyc n GLN 320 Cb 0.34 -5.40 -0.16 0.00 1.02 0.00 0.00 30.24 26.04 3kyc n GLN 320 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3kyc s ARG 321 N -5.72 3.17 0.00 -1.09 3.52 -1.19 -0.72 118.95 116.93 3kyc s ARG 321 Ca 0.29 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 55.10 3kyc s ARG 321 Cb -0.14 -2.52 0.00 0.00 -1.56 0.00 0.00 34.95 30.72 3kyc s ARG 321 CO 0.36 0.08 0.00 -0.25 -0.81 0.00 0.00 175.30 174.67 3kyc n ASP 322 N 3.86 0.00 -4.73 -2.12 8.00 0.26 -4.68 116.55 117.14 3kyc n ASP 322 Ca -0.19 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.90 3kyc n ASP 322 Cb 0.52 0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 42.03 3kyc n ASP 322 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3kyc s PRO 323 N -3.81 4.49 0.22 -0.24 0.04 -1.26 -4.85 135.00 129.59 3kyc s PRO 323 Ca 0.00 1.84 -0.20 0.00 0.04 0.00 0.00 61.00 62.68 3kyc s PRO 323 Cb 0.00 -3.26 -0.08 0.00 0.04 0.00 0.00 34.50 31.19 3kyc s PRO 323 CO 0.00 -0.10 0.74 -1.25 0.04 0.00 0.00 177.00 176.43 3kyc s PRO 324 N -0.01 4.27 0.09 0.56 0.04 -1.26 -5.01 135.00 133.68 3kyc s PRO 324 Ca 0.54 0.90 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 3kyc s PRO 324 Cb -0.32 -2.89 -0.08 0.00 0.04 0.00 0.00 34.50 31.26 3kyc s PRO 324 CO 0.35 0.39 1.45 -1.01 0.04 0.00 0.00 177.00 178.22 3kyc s HIS 325 N -1.52 3.04 -0.29 0.56 3.76 -1.26 -4.93 115.29 114.65 3kyc s HIS 325 Ca 0.43 0.81 -0.29 0.00 -0.15 0.00 0.00 55.06 55.86 3kyc s HIS 325 Cb -0.17 -3.74 -0.02 0.00 1.11 0.00 0.00 32.58 29.76 3kyc s HIS 325 CO 0.21 -2.71 1.76 1.21 -0.85 0.00 0.00 174.74 174.36 3kyc s ASN 326 N 1.43 6.03 0.00 1.40 3.84 -1.26 -4.64 114.94 121.74 3kyc s ASN 326 Ca 0.66 1.42 0.00 0.00 0.21 0.00 0.00 52.86 55.15 3kyc s ASN 326 Cb -0.37 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 37.80 3kyc s ASN 326 CO 0.30 -1.58 0.00 -0.46 -2.79 0.00 0.00 177.10 172.57 3kyc n ASN 327 N 9.75 0.00 -4.51 -4.21 6.94 -1.26 -3.41 115.26 118.56 3kyc n ASN 327 Ca 0.22 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.45 3kyc n ASN 327 Cb 0.46 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.76 3kyc n ASN 327 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3kyc s PHE 328 N 0.00 2.75 -0.13 -2.53 0.40 -0.56 -1.29 117.98 116.63 3kyc s PHE 328 Ca 0.00 -0.12 0.01 0.00 -0.60 0.00 0.00 56.93 56.22 3kyc s PHE 328 Cb 0.00 -1.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.90 3kyc s PHE 328 CO 0.00 0.25 -0.16 0.12 0.70 0.00 0.00 175.22 176.13 3kyc s PHE 329 N -0.81 2.74 -0.18 0.36 5.36 -0.28 -1.50 117.98 123.67 3kyc s PHE 329 Ca 0.13 -0.84 -0.00 0.00 -0.96 0.00 0.00 56.93 55.26 3kyc s PHE 329 Cb -0.11 -1.82 0.01 0.00 -0.34 0.00 0.00 43.02 40.76 3kyc s PHE 329 CO 0.02 -0.33 -0.16 -0.06 -1.46 0.00 0.00 175.22 173.24 3kyc s PHE 330 N 0.46 2.81 -0.13 10.12 0.40 0.82 -0.70 117.98 131.75 3kyc s PHE 330 Ca -0.12 -1.29 -0.02 0.00 -0.60 0.00 0.00 56.93 54.90 3kyc s PHE 330 Cb -0.16 -1.94 -0.02 0.00 0.51 0.00 0.00 43.02 41.40 3kyc s PHE 330 CO 0.05 -0.64 -0.07 0.12 0.70 0.00 0.00 175.22 175.39 3kyc s PHE 331 N 1.14 2.96 -0.33 0.36 5.36 0.76 -1.02 117.98 127.21 3kyc s PHE 331 Ca 0.01 -0.33 -0.02 0.00 -0.96 0.00 0.00 56.93 55.63 3kyc s PHE 331 Cb -0.14 -1.89 0.07 0.00 -0.34 0.00 0.00 43.02 40.72 3kyc s PHE 331 CO -0.06 -0.02 0.06 0.34 -1.46 0.00 0.00 175.22 174.08 3kyc s ASP 332 N 0.17 4.99 0.00 6.13 -1.08 0.10 -1.97 116.67 125.02 3kyc s ASP 332 Ca -0.03 -1.52 0.21 0.00 -0.52 0.00 0.00 52.55 50.68 3kyc s ASP 332 Cb -0.14 -1.74 0.92 0.00 -1.46 0.00 0.00 42.92 40.50 3kyc s ASP 332 CO 0.03 -0.34 1.66 0.61 0.52 0.00 0.00 175.17 177.65 3kyc n GLY 333 N 4.60 -1.14 0.11 2.66 0.00 0.11 -0.29 105.19 111.25 3kyc n GLY 333 Ca -0.09 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 3kyc n GLY 333 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3kyc h MET 334 N 0.00 0.16 0.00 1.61 2.86 -1.94 -3.37 114.93 114.25 3kyc h MET 334 Ca 0.00 -0.28 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 3kyc h MET 334 Cb 0.31 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.07 3kyc h MET 334 CO 0.00 1.13 -0.46 0.87 1.06 0.00 0.00 176.91 179.52 3kyc h LYS 335 N -0.52 0.00 -1.81 1.72 1.79 -1.92 -3.47 116.57 112.35 3kyc h LYS 335 Ca -0.29 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 57.95 3kyc h LYS 335 Cb 1.59 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.23 3kyc h LYS 335 CO -0.01 0.00 -0.31 0.41 -1.08 0.00 0.00 179.45 178.46 3kyc n GLY 336 N 1.18 -0.11 3.80 3.86 0.00 0.60 -5.03 105.19 109.50 3kyc n GLY 336 Ca 0.03 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 3kyc n GLY 336 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kyc s ASN 337 N -2.51 6.92 -0.19 1.61 0.01 -1.00 -4.94 114.94 114.85 3kyc s ASN 337 Ca 0.02 1.10 -0.01 0.00 -0.71 0.00 0.00 52.86 53.25 3kyc s ASN 337 Cb -0.01 -2.31 0.05 0.00 0.41 0.00 0.00 41.25 39.39 3kyc s ASN 337 CO 0.02 0.24 -0.01 -0.83 -1.51 0.00 0.00 177.10 175.02 3kyc s GLY 338 N -0.80 0.89 0.03 0.66 0.00 -1.26 0.01 107.32 106.85 3kyc s GLY 338 Ca 0.27 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 44.18 3kyc s GLY 338 CO 0.16 1.17 -0.06 -0.42 0.00 0.00 0.00 173.10 173.95 3kyc s ILE 339 N 1.70 3.68 -0.24 0.90 1.09 -0.19 -4.94 121.20 123.21 3kyc s ILE 339 Ca -0.01 -0.85 0.02 0.00 -1.10 0.00 0.00 60.65 58.70 3kyc s ILE 339 Cb -0.17 -2.64 0.05 0.00 -1.06 0.00 0.00 42.46 38.64 3kyc s ILE 339 CO -0.07 0.32 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.28 3kyc s VAL 340 N -1.07 2.28 -0.08 2.92 1.01 -1.26 -0.12 120.40 124.08 3kyc s VAL 340 Ca 0.19 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.80 3kyc s VAL 340 Cb -0.11 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3kyc s VAL 340 CO 0.10 0.13 -0.09 -1.61 0.00 0.00 0.00 175.10 173.63 3kyc s GLU 341 N 1.18 2.90 -0.45 2.72 0.41 -0.56 -4.96 118.70 119.94 3kyc s GLU 341 Ca -0.04 -0.59 -0.13 0.00 -0.41 0.00 0.00 54.97 53.80 3kyc s GLU 341 Cb -0.18 -2.60 0.07 0.00 -1.78 0.00 0.00 34.13 29.65 3kyc s GLU 341 CO -0.07 0.55 0.33 0.00 -0.49 0.00 0.00 175.26 175.59 3kyc s LEU 343 N 1.56 2.03 0.00 0.00 1.43 -1.26 -4.88 118.68 117.56 3kyc s LEU 343 Ca 0.04 -1.76 0.00 0.00 -1.03 0.00 0.00 54.13 51.38 3kyc s LEU 343 Cb -0.23 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.19 3kyc s LEU 343 CO 0.05 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.85 3kyc n GLY 344 N 4.68 1.65 0.00 -3.19 0.00 -1.26 -4.09 105.19 102.98 3kyc n GLY 344 Ca -0.00 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 3kyc n GLY 344 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27