#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k6a s LYS 3 N 0.00 4.33 0.11 1.43 2.20 -1.26 -4.69 119.74 121.86 3k6a s LYS 3 Ca 0.00 1.53 -0.31 0.00 -0.36 0.00 0.00 55.97 56.83 3k6a s LYS 3 Cb 0.00 -3.61 -0.07 0.00 -1.51 0.00 0.00 37.83 32.64 3k6a s LYS 3 CO 0.00 -0.49 1.25 0.00 -0.36 0.00 0.00 175.35 175.75 3k6a s ALA 4 N 2.58 3.45 -0.12 3.13 0.00 -1.26 -4.93 121.76 124.62 3k6a s ALA 4 Ca 0.51 0.95 -0.00 0.00 0.00 0.00 0.00 51.96 53.41 3k6a s ALA 4 Cb -0.20 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 3k6a s ALA 4 CO 0.16 -0.47 -0.09 0.15 0.00 0.00 0.00 175.76 175.51 3k6a s LYS 5 N 0.73 3.24 -0.13 0.00 1.02 -1.26 -0.93 119.74 122.41 3k6a s LYS 5 Ca 0.59 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.97 3k6a s LYS 5 Cb -0.32 -2.67 0.02 0.00 -0.52 0.00 0.00 37.83 34.34 3k6a s LYS 5 CO 0.31 0.36 -0.12 0.42 -0.92 0.00 0.00 175.35 175.41 3k6a s ILE 6 N -0.00 1.34 0.15 2.17 1.01 -0.37 -1.49 121.20 124.01 3k6a s ILE 6 Ca -0.02 -0.50 -0.27 0.00 0.00 0.00 0.00 60.65 59.86 3k6a s ILE 6 Cb -0.14 -1.28 -0.07 0.00 0.01 0.00 0.00 42.46 40.97 3k6a s ILE 6 CO 0.03 0.42 0.83 -0.83 0.00 0.00 0.00 174.94 175.40 3k6a s GLY 7 N 1.46 2.95 -0.12 6.18 0.00 -0.06 -1.08 107.32 116.65 3k6a s GLY 7 Ca 0.02 0.43 -0.01 0.00 0.00 0.00 0.00 44.72 45.17 3k6a s GLY 7 CO -0.08 1.06 -0.05 -0.42 0.00 0.00 0.00 173.10 173.61 3k6a s ILE 8 N -0.82 0.92 -0.22 0.90 1.01 0.10 -0.60 121.20 122.49 3k6a s ILE 8 Ca 0.39 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.73 3k6a s ILE 8 Cb -0.23 -1.03 0.04 0.00 0.01 0.00 0.00 42.46 41.25 3k6a s ILE 8 CO 0.27 0.26 -0.14 -0.69 0.00 0.00 0.00 174.94 174.64 3k6a s VAL 9 N 1.74 2.03 -0.30 2.92 1.01 -0.06 -1.32 120.40 126.43 3k6a s VAL 9 Ca 0.04 -1.25 -0.16 0.00 0.00 0.00 0.00 61.98 60.61 3k6a s VAL 9 Cb -0.13 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 3k6a s VAL 9 CO -0.08 0.23 0.42 -0.89 0.00 0.00 0.00 175.10 174.79 3k6a s THR 10 N 1.23 5.13 -0.26 3.92 2.01 -0.27 -0.87 115.64 126.52 3k6a s THR 10 Ca -0.02 0.48 -0.07 0.00 0.31 0.00 0.00 61.69 62.39 3k6a s THR 10 Cb -0.17 -3.79 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 3k6a s THR 10 CO -0.09 0.03 0.08 -0.69 -0.69 0.00 0.00 174.62 173.26 3k6a s VAL 11 N 2.16 4.31 -0.30 3.82 1.01 -0.27 -1.09 120.40 130.04 3k6a s VAL 11 Ca 0.16 -0.23 -0.17 0.00 0.00 0.00 0.00 61.98 61.74 3k6a s VAL 11 Cb -0.16 -3.04 0.18 0.00 0.00 0.00 0.00 36.38 33.36 3k6a s VAL 11 CO 0.11 0.30 1.15 -0.55 0.00 0.00 0.00 175.10 176.11 3k6a s SER 12 N 1.61 -0.30 0.20 3.32 0.15 0.33 -4.36 113.70 114.65 3k6a s SER 12 Ca 0.06 0.41 -0.11 0.00 0.70 0.00 0.00 55.95 57.00 3k6a s SER 12 Cb -0.15 1.34 0.24 0.00 -1.71 0.00 0.00 66.02 65.73 3k6a s SER 12 CO 0.04 -0.06 1.72 0.44 1.20 0.00 0.00 173.24 176.58 3k6a h ASP 13 N 7.27 0.05 -0.29 5.45 3.45 -1.88 -1.05 116.42 129.42 3k6a h ASP 13 Ca -0.14 0.09 -0.03 0.00 0.43 0.00 0.00 57.03 57.38 3k6a h ASP 13 Cb 1.12 0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 40.00 3k6a h ASP 13 CO 0.07 0.05 0.08 0.03 -1.57 0.00 0.00 179.24 177.89 3k6a h ARG 14 N 0.28 0.46 -0.68 3.56 2.47 -1.95 -1.91 114.38 116.61 3k6a h ARG 14 Ca 0.28 -0.11 -0.07 0.00 -1.26 0.00 0.00 59.98 58.83 3k6a h ARG 14 Cb 0.38 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.61 3k6a h ARG 14 CO -0.34 0.53 0.16 0.00 0.56 0.00 0.00 179.97 180.88 3k6a h ALA 15 N 0.91 0.90 -0.39 0.04 0.00 -1.84 -2.20 119.26 116.68 3k6a h ALA 15 Ca 0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3k6a h ALA 15 Cb 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3k6a h ALA 15 CO -0.00 0.62 0.11 1.03 0.00 0.00 0.00 179.25 181.01 3k6a h SER 16 N 1.02 0.51 1.35 0.00 0.87 -1.05 -2.07 113.55 114.18 3k6a h SER 16 Ca 0.21 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 3k6a h SER 16 Cb 0.37 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 3k6a h SER 16 CO 0.00 0.50 0.00 0.00 -0.53 0.00 0.00 176.83 176.80 3k6a h ALA 17 N 1.58 1.00 0.00 6.23 0.00 -0.90 -3.49 119.26 123.68 3k6a h ALA 17 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3k6a h ALA 17 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3k6a h ALA 17 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3k6a n GLY 18 N 0.70 2.86 3.32 0.00 0.00 -0.78 -5.10 105.19 106.19 3k6a n GLY 18 Ca 0.03 -1.06 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 3k6a n GLY 18 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k6a s ILE 19 N 0.00 0.86 0.12 -0.61 -4.36 -1.26 -4.78 121.20 111.18 3k6a s ILE 19 Ca 0.00 -2.01 -0.19 0.00 -0.26 0.00 0.00 60.65 58.19 3k6a s ILE 19 Cb 0.00 -2.41 -0.05 0.00 1.25 0.00 0.00 42.46 41.25 3k6a s ILE 19 CO 0.00 -0.24 1.71 0.22 0.24 0.00 0.00 174.94 176.87 3k6a h TYR 20 N 2.46 0.38 -2.39 1.37 3.20 -1.98 -3.45 116.97 116.57 3k6a h TYR 20 Ca -0.38 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.40 3k6a h TYR 20 Cb 1.23 -0.12 -0.22 0.00 1.54 0.00 0.00 36.73 39.16 3k6a h TYR 20 CO 0.54 0.33 -0.04 -1.83 -1.64 0.00 0.00 178.16 175.52 3k6a s GLU 21 N -5.82 0.72 -1.09 1.82 -1.05 -1.26 -5.09 118.70 106.94 3k6a s GLU 21 Ca -0.13 0.59 -0.18 0.00 -0.15 0.00 0.00 54.97 55.10 3k6a s GLU 21 Cb 0.09 0.35 0.12 0.00 -0.44 0.00 0.00 34.13 34.24 3k6a s GLU 21 CO 0.71 -0.13 1.38 0.34 0.95 0.00 0.00 175.26 178.51 3k6a s ASP 22 N -0.12 6.77 0.49 0.83 2.15 -1.26 -4.85 116.67 120.67 3k6a s ASP 22 Ca -0.03 -2.27 0.27 0.00 0.43 0.00 0.00 52.55 50.95 3k6a s ASP 22 Cb -0.03 -2.46 1.17 0.00 -0.30 0.00 0.00 42.92 41.29 3k6a s ASP 22 CO 0.03 -1.07 1.93 0.16 -0.17 0.00 0.00 175.17 176.04 3k6a h ILE 23 N 5.63 0.44 0.06 4.11 3.07 -1.98 -1.76 117.51 127.09 3k6a h ILE 23 Ca 0.26 -0.84 -0.00 0.00 1.55 0.00 0.00 64.86 65.82 3k6a h ILE 23 Cb 0.95 1.60 0.00 0.00 -0.27 0.00 0.00 36.82 39.10 3k6a h ILE 23 CO 1.27 0.15 -0.03 0.28 -1.05 0.00 0.00 178.15 178.77 3k6a h SER 24 N 0.00 -0.07 -0.76 2.16 0.02 -1.89 -1.64 113.55 111.37 3k6a h SER 24 Ca -0.00 -0.55 0.12 0.00 -0.84 0.00 0.00 61.79 60.52 3k6a h SER 24 Cb 0.59 0.02 -0.08 0.00 0.14 0.00 0.00 62.40 63.07 3k6a h SER 24 CO 0.02 0.57 0.37 1.23 -1.14 0.00 0.00 176.83 177.88 3k6a h GLY 25 N -0.79 1.18 1.01 -3.77 0.00 -1.91 -1.78 103.07 97.02 3k6a h GLY 25 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3k6a h GLY 25 CO 0.01 0.00 0.48 1.70 0.00 0.00 0.00 176.54 178.73 3k6a h LYS 26 N 0.58 1.02 -0.97 4.80 3.64 -1.33 -1.46 116.57 122.85 3k6a h LYS 26 Ca 0.40 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.71 3k6a h LYS 26 Cb 0.50 -0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 3k6a h LYS 26 CO -0.32 0.70 0.64 0.00 -2.27 0.00 0.00 179.45 178.20 3k6a h ALA 27 N 1.26 1.32 0.37 5.00 0.00 -0.48 0.14 119.26 126.86 3k6a h ALA 27 Ca 0.27 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3k6a h ALA 27 Cb -0.07 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.34 3k6a h ALA 27 CO -0.05 0.62 -0.18 0.82 0.00 0.00 0.00 179.25 180.46 3k6a h ILE 28 N 1.30 0.63 -0.75 0.00 2.04 -0.90 -1.70 117.51 118.13 3k6a h ILE 28 Ca 0.36 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 3k6a h ILE 28 Cb -0.12 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3k6a h ILE 28 CO -0.09 0.06 0.32 -0.29 0.00 0.00 0.00 178.15 178.16 3k6a h ILE 29 N -0.70 1.24 -0.46 -0.67 2.10 -0.95 -0.44 117.51 117.63 3k6a h ILE 29 Ca -0.05 -0.73 -0.02 0.00 1.08 0.00 0.00 64.86 65.13 3k6a h ILE 29 Cb 0.49 0.33 -0.02 0.00 -1.09 0.00 0.00 36.82 36.53 3k6a h ILE 29 CO 0.08 0.30 0.20 0.44 -1.08 0.00 0.00 178.15 178.09 3k6a h ASP 30 N 1.07 0.63 0.01 2.19 3.32 -0.73 -0.75 116.42 122.16 3k6a h ASP 30 Ca 0.25 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3k6a h ASP 30 Cb 0.16 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3k6a h ASP 30 CO -0.03 0.61 -0.01 0.74 -1.72 0.00 0.00 179.24 178.84 3k6a h THR 31 N 0.61 1.13 -0.79 0.35 2.02 -0.85 -1.70 112.91 113.67 3k6a h THR 31 Ca 0.16 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.94 3k6a h THR 31 Cb 0.17 1.43 -0.05 0.00 -1.74 0.00 0.00 68.15 67.96 3k6a h THR 31 CO -0.01 0.11 0.49 -0.07 0.37 0.00 0.00 175.52 176.41 3k6a h LEU 32 N -0.21 0.79 -0.64 2.58 3.38 -1.02 -0.41 115.31 119.78 3k6a h LEU 32 Ca -0.00 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.07 3k6a h LEU 32 Cb 0.20 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 3k6a h LEU 32 CO 0.00 0.52 0.27 0.78 0.09 0.00 0.00 178.44 180.11 3k6a h ASN 33 N 0.93 0.32 -0.48 -0.43 2.35 -1.07 -0.94 115.58 116.25 3k6a h ASN 33 Ca 0.33 0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 56.07 3k6a h ASN 33 Cb 0.10 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 3k6a h ASN 33 CO -0.14 0.19 0.01 0.44 -1.65 0.00 0.00 177.43 176.27 3k6a h ASP 34 N 0.48 0.87 -0.15 5.81 3.32 -0.28 -3.19 116.42 123.28 3k6a h ASP 34 Ca 0.32 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 3k6a h ASP 34 Cb 0.36 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 3k6a h ASP 34 CO -0.28 0.92 -0.11 1.88 -1.72 0.00 0.00 179.24 179.93 3k6a h TYR 35 N 0.84 0.40 -3.19 4.55 0.05 -0.89 -3.42 116.97 115.30 3k6a h TYR 35 Ca 0.16 -0.11 -0.60 0.00 0.05 0.00 0.00 58.73 58.23 3k6a h TYR 35 Cb 0.48 -0.09 -0.08 0.00 1.01 0.00 0.00 36.73 38.05 3k6a h TYR 35 CO 0.03 0.70 -0.26 -0.51 -1.05 0.00 0.00 178.16 177.07 3k6a s LEU 36 N -9.18 4.32 -0.14 3.88 1.43 -0.38 -0.27 118.68 118.34 3k6a s LEU 36 Ca -0.14 0.69 0.18 0.00 -1.03 0.00 0.00 54.13 53.83 3k6a s LEU 36 Cb 0.05 -2.49 -0.26 0.00 0.03 0.00 0.00 46.19 43.53 3k6a s LEU 36 CO 0.75 0.15 0.19 0.35 0.23 0.00 0.00 176.35 178.01 3k6a n THR 37 N 3.08 0.88 -2.20 5.49 -2.24 0.99 -4.78 114.28 115.50 3k6a n THR 37 Ca -0.12 -0.70 -0.34 0.00 -2.27 0.00 0.00 64.05 60.63 3k6a n THR 37 Cb 0.52 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3k6a n THR 37 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3k6a s SER 38 N -5.02 5.80 0.47 3.42 1.04 -1.04 -5.00 113.70 113.36 3k6a s SER 38 Ca -0.09 1.99 -0.22 0.00 0.48 0.00 0.00 55.95 58.11 3k6a s SER 38 Cb 0.08 -2.56 -0.07 0.00 0.10 0.00 0.00 66.02 63.57 3k6a s SER 38 CO 0.80 -1.16 1.15 -1.83 0.98 0.00 0.00 173.24 173.18 3k6a s GLU 39 N -3.60 3.72 0.09 4.02 -1.05 -1.26 -4.93 118.70 115.69 3k6a s GLU 39 Ca 0.68 1.71 -0.17 0.00 -0.15 0.00 0.00 54.97 57.04 3k6a s GLU 39 Cb -0.19 -2.34 0.03 0.00 -0.44 0.00 0.00 34.13 31.19 3k6a s GLU 39 CO 0.30 -0.57 0.40 1.67 0.95 0.00 0.00 175.26 178.01 3k6a s TRP 40 N -1.61 -0.22 -0.26 4.83 1.48 -1.26 -3.99 118.94 117.91 3k6a s TRP 40 Ca 0.65 0.00 -0.00 0.00 -1.06 0.00 0.00 56.10 55.69 3k6a s TRP 40 Cb -0.27 0.24 0.04 0.00 -1.16 0.00 0.00 33.47 32.32 3k6a s TRP 40 CO 0.32 -0.65 -0.07 -1.21 -4.06 0.00 0.00 176.95 171.28 3k6a s GLU 41 N -3.32 2.59 0.21 3.25 2.02 -0.10 -5.02 118.70 118.34 3k6a s GLU 41 Ca -0.00 -1.13 -0.30 0.00 0.02 0.00 0.00 54.97 53.56 3k6a s GLU 41 Cb 0.01 -2.97 -0.08 0.00 0.10 0.00 0.00 34.13 31.18 3k6a s GLU 41 CO -0.08 -0.48 1.13 -1.25 0.02 0.00 0.00 175.26 174.59 3k6a s PRO 42 N 1.24 4.58 -0.25 0.39 0.04 -1.26 -1.24 135.00 138.51 3k6a s PRO 42 Ca -0.03 1.79 0.02 0.00 0.04 0.00 0.00 61.00 62.82 3k6a s PRO 42 Cb -0.18 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.18 3k6a s PRO 42 CO -0.05 0.08 -0.10 0.42 0.04 0.00 0.00 177.00 177.39 3k6a s ILE 43 N -0.51 2.00 -0.07 0.56 1.01 -0.24 -4.93 121.20 119.02 3k6a s ILE 43 Ca 0.49 -1.49 0.04 0.00 0.00 0.00 0.00 60.65 59.68 3k6a s ILE 43 Cb -0.31 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 3k6a s ILE 43 CO 0.38 -0.01 -0.18 -0.47 0.00 0.00 0.00 174.94 174.65 3k6a s TYR 44 N 1.19 2.61 -0.01 3.97 5.04 -1.26 0.03 117.35 128.91 3k6a s TYR 44 Ca -0.07 -0.47 -0.01 0.00 -2.44 0.00 0.00 57.07 54.08 3k6a s TYR 44 Cb -0.19 -1.65 0.01 0.00 0.35 0.00 0.00 41.96 40.47 3k6a s TYR 44 CO -0.06 -0.05 0.03 -0.65 -1.34 0.00 0.00 175.55 173.48 3k6a s GLN 45 N -0.31 0.02 -0.20 4.97 -1.52 -0.44 -4.98 119.66 117.20 3k6a s GLN 45 Ca 0.02 0.07 -0.06 0.00 -1.95 0.00 0.00 55.36 53.44 3k6a s GLN 45 Cb -0.13 -0.04 -0.03 0.00 -0.22 0.00 0.00 33.01 32.59 3k6a s GLN 45 CO 0.03 -0.04 0.02 0.08 -0.25 0.00 0.00 175.29 175.12 3k6a s VAL 46 N 0.24 4.14 0.09 1.09 1.01 -1.26 -1.11 120.40 124.61 3k6a s VAL 46 Ca -0.02 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3k6a s VAL 46 Cb -0.03 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3k6a s VAL 46 CO -0.01 0.43 -0.08 0.27 0.00 0.00 0.00 175.10 175.72 3k6a s ILE 47 N 0.88 0.75 0.82 2.22 -4.36 -0.25 -4.88 121.20 116.38 3k6a s ILE 47 Ca 0.02 -1.79 -0.12 0.00 -0.26 0.00 0.00 60.65 58.50 3k6a s ILE 47 Cb -0.14 -1.50 0.09 0.00 1.25 0.00 0.00 42.46 42.15 3k6a s ILE 47 CO 0.02 -0.75 1.13 -2.16 0.24 0.00 0.00 174.94 173.42 3k6a s PRO 48 N -3.37 1.87 -1.04 0.37 0.04 -1.26 -0.52 135.00 131.10 3k6a s PRO 48 Ca 0.08 0.34 -0.15 0.00 0.04 0.00 0.00 61.00 61.32 3k6a s PRO 48 Cb 0.02 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 3k6a s PRO 48 CO -0.03 -1.70 2.15 -0.25 0.04 0.00 0.00 177.00 177.20 3k6a n ASP 49 N -3.44 4.11 -3.88 6.66 9.92 -1.26 -4.58 116.55 124.09 3k6a n ASP 49 Ca 0.07 -2.60 -0.28 0.00 -0.53 0.00 0.00 54.79 51.46 3k6a n ASP 49 Cb 0.59 -1.26 -0.17 0.00 -0.64 0.00 0.00 41.12 39.64 3k6a n ASP 49 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 3k6a s GLU 50 N 3.90 1.35 0.16 -1.24 0.41 -1.26 -4.91 118.70 117.11 3k6a s GLU 50 Ca 0.52 -0.42 -0.17 0.00 -0.41 0.00 0.00 54.97 54.48 3k6a s GLU 50 Cb 0.14 -1.87 0.08 0.00 -1.78 0.00 0.00 34.13 30.69 3k6a s GLU 50 CO 0.02 -0.41 1.69 0.37 -0.49 0.00 0.00 175.26 176.44 3k6a h GLN 51 N 8.15 0.06 -0.69 1.61 4.15 -1.87 -0.98 115.11 125.53 3k6a h GLN 51 Ca -0.24 -0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.20 3k6a h GLN 51 Cb 1.12 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.76 3k6a h GLN 51 CO 0.39 0.04 0.46 0.38 -1.93 0.00 0.00 178.83 178.17 3k6a h ASP 52 N 0.06 0.74 -0.10 -0.69 2.03 -1.96 0.00 116.42 116.49 3k6a h ASP 52 Ca 0.17 -0.01 -0.18 0.00 -0.73 0.00 0.00 57.03 56.28 3k6a h ASP 52 Cb 0.25 -0.17 -0.00 0.00 -0.83 0.00 0.00 39.33 38.58 3k6a h ASP 52 CO -0.32 0.51 -0.59 0.58 -1.03 0.00 0.00 179.24 178.39 3k6a h VAL 53 N 0.86 1.30 -0.33 4.15 2.07 -1.58 -1.75 116.25 120.96 3k6a h VAL 53 Ca 0.27 -1.82 -0.02 0.00 0.82 0.00 0.00 66.70 65.95 3k6a h VAL 53 Cb 0.03 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3k6a h VAL 53 CO -0.07 0.58 0.12 0.40 0.02 0.00 0.00 177.57 178.61 3k6a h ILE 54 N 0.53 1.20 -0.23 4.57 2.04 -0.48 -0.76 117.51 124.37 3k6a h ILE 54 Ca -0.00 -0.62 0.05 0.00 1.00 0.00 0.00 64.86 65.28 3k6a h ILE 54 Cb 1.18 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 3k6a h ILE 54 CO 0.12 0.21 -0.06 -0.33 0.00 0.00 0.00 178.15 178.09 3k6a h GLU 55 N 0.38 -0.01 -0.63 2.37 5.08 -0.92 -1.14 114.58 119.72 3k6a h GLU 55 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3k6a h GLU 55 Cb 0.22 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3k6a h GLU 55 CO -0.01 -0.01 0.41 1.15 -1.00 0.00 0.00 179.01 179.55 3k6a h THR 56 N -0.01 1.17 0.21 1.13 2.02 -1.16 -0.40 112.91 115.87 3k6a h THR 56 Ca 0.11 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 3k6a h THR 56 Cb 0.18 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 3k6a h THR 56 CO -0.24 0.16 -0.12 0.74 0.37 0.00 0.00 175.52 176.44 3k6a h THR 57 N 0.85 0.76 -0.37 3.16 2.02 -0.77 -1.19 112.91 117.37 3k6a h THR 57 Ca 0.23 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.43 3k6a h THR 57 Cb -0.08 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 3k6a h THR 57 CO -0.05 0.00 0.19 -0.07 0.37 0.00 0.00 175.52 175.96 3k6a h LEU 58 N -0.31 0.29 -0.31 2.58 3.38 -1.05 -3.00 115.31 116.90 3k6a h LEU 58 Ca -0.02 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.98 3k6a h LEU 58 Cb 0.25 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3k6a h LEU 58 CO 0.04 0.21 0.14 0.40 0.09 0.00 0.00 178.44 179.31 3k6a h ILE 59 N 0.39 0.97 0.00 1.22 2.04 -0.97 -1.50 117.51 119.66 3k6a h ILE 59 Ca 0.15 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3k6a h ILE 59 Cb 0.05 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 3k6a h ILE 59 CO -0.10 0.05 0.00 1.17 0.00 0.00 0.00 178.15 179.28 3k6a n LYS 60 N -4.98 0.00 0.00 2.37 4.81 -0.46 -0.22 118.16 119.68 3k6a n LYS 60 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3k6a n LYS 60 Cb 0.08 -0.94 0.00 0.00 0.02 0.00 0.00 35.03 34.20 3k6a n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3k6a n ALA 62 N 0.44 0.00 0.03 3.14 0.00 -0.56 -0.53 120.51 123.03 3k6a n ALA 62 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 3k6a n ALA 62 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 3k6a n ALA 62 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3k6a h ASP 63 N 0.00 0.45 0.04 0.00 5.19 -0.84 -3.29 116.42 117.97 3k6a h ASP 63 Ca 0.00 -0.88 -0.38 0.00 -0.62 0.00 0.00 57.03 55.16 3k6a h ASP 63 Cb 0.00 -0.15 -0.06 0.00 0.18 0.00 0.00 39.33 39.30 3k6a h ASP 63 CO 0.00 1.77 -2.36 -0.62 -3.12 0.00 0.00 179.24 174.91 3k6a n GLU 64 N -3.49 0.67 -0.09 3.56 1.02 0.31 -4.58 120.64 118.06 3k6a n GLU 64 Ca -0.28 0.13 0.08 0.00 -0.02 0.00 0.00 57.16 57.07 3k6a n GLU 64 Cb 1.06 -1.56 0.12 0.00 -0.02 0.00 0.00 31.44 31.04 3k6a n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3k6a n GLN 65 N -3.13 1.83 -3.85 3.49 6.02 -0.82 -4.99 117.38 115.93 3k6a n GLN 65 Ca -0.39 -1.78 -0.27 0.00 -0.01 0.00 0.00 57.00 54.55 3k6a n GLN 65 Cb 1.05 -1.35 0.03 0.00 1.02 0.00 0.00 30.24 30.98 3k6a n GLN 65 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3k6a n ASP 66 N 0.97 -3.38 -4.64 1.08 2.03 -1.24 -4.88 116.55 106.49 3k6a n ASP 66 Ca 0.12 -0.80 -0.43 0.00 0.52 0.00 0.00 54.79 54.20 3k6a n ASP 66 Cb 0.45 -3.90 -0.02 0.00 -0.72 0.00 0.00 41.12 36.93 3k6a n ASP 66 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k6a s LEU 69 N -8.14 1.69 -0.10 0.00 2.96 -1.25 -1.52 118.68 112.32 3k6a s LEU 69 Ca -0.04 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 3k6a s LEU 69 Cb 0.13 -0.68 0.01 0.00 0.50 0.00 0.00 46.19 46.15 3k6a s LEU 69 CO 0.77 0.05 -0.18 -0.63 -1.32 0.00 0.00 176.35 175.04 3k6a s ILE 70 N 0.42 1.64 -0.00 6.68 1.01 0.74 -0.88 121.20 130.82 3k6a s ILE 70 Ca -0.08 -0.76 0.08 0.00 0.00 0.00 0.00 60.65 59.89 3k6a s ILE 70 Cb -0.12 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 3k6a s ILE 70 CO 0.02 0.47 -0.24 0.68 0.00 0.00 0.00 174.94 175.87 3k6a s VAL 71 N 0.67 2.29 0.20 2.92 -7.23 0.23 -0.83 120.40 118.64 3k6a s VAL 71 Ca -0.13 -1.12 0.10 0.00 -1.81 0.00 0.00 61.98 59.02 3k6a s VAL 71 Cb -0.16 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 3k6a s VAL 71 CO 0.03 0.51 -0.16 0.42 -0.31 0.00 0.00 175.10 175.60 3k6a s THR 72 N -0.70 2.80 -0.02 5.32 -4.23 -0.65 -0.88 115.64 117.28 3k6a s THR 72 Ca 0.11 -1.89 0.01 0.00 -1.18 0.00 0.00 61.69 58.74 3k6a s THR 72 Cb -0.10 -2.38 0.01 0.00 1.34 0.00 0.00 72.50 71.37 3k6a s THR 72 CO 0.00 -0.15 -0.02 0.28 -0.54 0.00 0.00 174.62 174.19 3k6a s THR 73 N -1.80 0.26 0.00 3.99 -1.32 -0.05 -0.37 115.64 116.34 3k6a s THR 73 Ca 0.24 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.69 3k6a s THR 73 Cb -0.08 -0.29 0.00 0.00 -1.51 0.00 0.00 72.50 70.62 3k6a s THR 73 CO 0.13 0.13 0.00 0.61 -2.21 0.00 0.00 174.62 173.28 3k6a n GLY 74 N 3.65 2.37 2.13 6.08 0.00 -1.26 -1.11 105.19 117.05 3k6a n GLY 74 Ca -0.21 -1.77 -0.07 0.00 0.00 0.00 0.00 46.02 43.97 3k6a n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k6a n GLY 75 N 1.57 0.44 0.01 -0.02 0.00 -1.26 -4.66 105.19 101.26 3k6a n GLY 75 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3k6a n GLY 75 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k6a n THR 76 N -3.16 0.81 -2.19 2.61 -2.24 -1.26 -1.74 114.28 107.10 3k6a n THR 76 Ca -0.01 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 3k6a n THR 76 Cb 0.52 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 3k6a n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k6a n GLY 77 N -0.43 1.05 0.01 3.38 0.00 -1.26 -0.32 105.19 107.62 3k6a n GLY 77 Ca 0.01 -1.98 0.15 0.00 0.00 0.00 0.00 46.02 44.20 3k6a n GLY 77 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k6a n PRO 78 N -0.78 0.40 -1.91 1.61 -0.04 -1.26 -4.74 135.00 128.28 3k6a n PRO 78 Ca 0.00 -0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 3k6a n PRO 78 Cb 0.00 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.00 3k6a n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k6a s ALA 79 N -2.61 2.59 0.23 0.55 0.00 -1.26 -4.91 121.76 116.35 3k6a s ALA 79 Ca 0.27 1.13 -0.08 0.00 0.00 0.00 0.00 51.96 53.28 3k6a s ALA 79 Cb 0.20 -3.50 0.39 0.00 0.00 0.00 0.00 23.12 20.21 3k6a s ALA 79 CO 0.47 -1.28 1.66 -0.22 0.00 0.00 0.00 175.76 176.39 3k6a h LYS 80 N 1.01 0.14 -0.00 0.00 3.64 -2.04 -1.86 116.57 117.47 3k6a h LYS 80 Ca -0.51 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3k6a h LYS 80 Cb 1.31 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3k6a h LYS 80 CO 0.55 0.10 -0.05 0.54 -2.27 0.00 0.00 179.45 178.32 3k6a n ARG 81 N -5.27 0.59 -2.41 1.90 1.74 -1.26 -4.70 116.66 107.24 3k6a n ARG 81 Ca 0.12 -0.10 -0.40 0.00 -0.77 0.00 0.00 57.85 56.70 3k6a n ARG 81 Cb 0.42 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.33 3k6a n ARG 81 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3k6a s ASP 82 N -2.48 5.93 -0.05 0.55 1.11 -0.70 -4.79 116.67 116.24 3k6a s ASP 82 Ca 0.30 -0.36 0.07 0.00 0.18 0.00 0.00 52.55 52.74 3k6a s ASP 82 Cb 0.20 -2.55 0.10 0.00 1.07 0.00 0.00 42.92 41.74 3k6a s ASP 82 CO 0.46 -1.98 0.98 1.33 1.18 0.00 0.00 175.17 177.15 3k6a n VAL 83 N 6.69 1.04 -0.17 -1.27 0.24 -1.14 -4.75 118.33 118.97 3k6a n VAL 83 Ca 0.12 -1.18 -0.08 0.00 -2.04 0.00 0.00 64.34 61.16 3k6a n VAL 83 Cb 0.50 0.31 0.01 0.00 -1.47 0.00 0.00 33.84 33.18 3k6a n VAL 83 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 3k6a h THR 84 N 1.37 1.21 -0.50 3.34 2.02 -1.61 -2.26 112.91 116.48 3k6a h THR 84 Ca 0.00 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.46 3k6a h THR 84 Cb 0.87 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 3k6a h THR 84 CO 0.00 0.25 0.06 -0.65 0.37 0.00 0.00 175.52 175.55 3k6a h PRO 85 N 0.65 0.80 -0.89 6.66 0.11 -1.86 -1.26 132.00 136.22 3k6a h PRO 85 Ca 0.16 -0.19 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 3k6a h PRO 85 Cb 0.20 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.16 3k6a h PRO 85 CO -0.01 0.76 0.52 0.93 -0.21 0.00 0.00 178.00 179.99 3k6a h GLU 86 N 0.76 1.23 -0.59 1.05 3.07 -1.87 0.88 114.58 119.11 3k6a h GLU 86 Ca 0.16 -0.12 -0.06 0.00 -0.50 0.00 0.00 59.36 58.84 3k6a h GLU 86 Cb 0.37 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 3k6a h GLU 86 CO 0.01 0.88 0.15 0.00 -1.40 0.00 0.00 179.01 178.64 3k6a h ALA 87 N 1.28 0.78 -0.31 3.43 0.00 -1.08 -0.59 119.26 122.77 3k6a h ALA 87 Ca 0.32 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3k6a h ALA 87 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3k6a h ALA 87 CO -0.06 0.48 0.05 1.15 0.00 0.00 0.00 179.25 180.87 3k6a h THR 88 N 0.85 1.24 -0.91 0.00 2.02 -0.63 -2.40 112.91 113.08 3k6a h THR 88 Ca 0.19 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.56 3k6a h THR 88 Cb 0.34 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 3k6a h THR 88 CO 0.00 0.27 0.60 -0.33 0.37 0.00 0.00 175.52 176.43 3k6a h GLU 89 N 0.35 1.19 -0.71 6.66 5.08 -0.75 -1.66 114.58 124.73 3k6a h GLU 89 Ca 0.09 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 3k6a h GLU 89 Cb 0.35 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 3k6a h GLU 89 CO 0.01 0.79 0.18 0.00 -1.00 0.00 0.00 179.01 178.99 3k6a h ALA 90 N 1.34 0.97 0.00 3.43 0.00 -0.87 -3.23 119.26 120.90 3k6a h ALA 90 Ca 0.34 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3k6a h ALA 90 Cb -0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 3k6a h ALA 90 CO -0.08 0.66 -0.91 -0.39 0.00 0.00 0.00 179.25 178.54 3k6a h VAL 91 N 1.07 0.06 -3.81 0.00 -1.51 -1.23 -3.47 116.25 107.36 3k6a h VAL 91 Ca 0.22 -1.11 -0.48 0.00 -1.23 0.00 0.00 66.70 64.10 3k6a h VAL 91 Cb 0.36 1.62 -0.02 0.00 -2.13 0.00 0.00 31.29 31.12 3k6a h VAL 91 CO 0.00 0.03 0.28 0.00 -1.23 0.00 0.00 177.57 176.65 3k6a n ASP 93 N 0.52 0.70 -2.77 0.00 5.68 0.29 -4.94 116.55 116.03 3k6a n ASP 93 Ca 0.01 0.13 -0.10 0.00 -0.50 0.00 0.00 54.79 54.33 3k6a n ASP 93 Cb 0.51 0.55 0.01 0.00 -1.14 0.00 0.00 41.12 41.05 3k6a n ASP 93 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3k6a n ARG 94 N -2.34 0.94 0.00 0.11 1.85 -1.18 -5.03 116.66 111.01 3k6a n ARG 94 Ca 0.01 -2.31 0.00 0.00 -1.00 0.00 0.00 57.85 54.55 3k6a n ARG 94 Cb 0.50 2.62 0.00 0.00 -1.05 0.00 0.00 32.46 34.53 3k6a n ARG 94 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 3k6a n PRO 97 N -0.52 0.00 0.27 2.89 -0.04 -1.26 -0.76 135.00 135.57 3k6a n PRO 97 Ca -0.05 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.50 3k6a n PRO 97 Cb 0.56 0.00 0.68 0.00 -0.04 0.00 0.00 33.50 34.71 3k6a n PRO 97 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3k6a h GLY 98 N 0.00 0.00 0.41 0.55 0.00 -2.00 -2.65 103.07 99.39 3k6a h GLY 98 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3k6a h GLY 98 CO 0.00 0.00 -0.08 0.74 0.00 0.00 0.00 176.54 177.20 3k6a h PHE 99 N 0.00 -0.21 -0.89 5.60 0.04 -1.97 -2.42 116.94 117.10 3k6a h PHE 99 Ca -0.00 -0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.90 3k6a h PHE 99 Cb 0.00 0.07 -0.09 0.00 2.20 0.00 0.00 35.95 38.13 3k6a h PHE 99 CO 0.00 0.23 0.50 0.78 -0.60 0.00 0.00 178.31 179.22 3k6a h GLY 100 N -0.81 1.45 0.66 -1.45 0.00 -1.77 -2.55 103.07 98.59 3k6a h GLY 100 Ca -0.02 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.00 3k6a h GLY 100 CO 0.04 0.04 -0.26 0.83 0.00 0.00 0.00 176.54 177.19 3k6a h GLU 101 N 0.75 -0.51 -1.53 4.80 5.08 -1.49 -1.43 114.58 120.25 3k6a h GLU 101 Ca 0.46 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 3k6a h GLU 101 Cb 0.58 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3k6a h GLU 101 CO -0.32 -0.34 0.00 -0.11 -1.00 0.00 0.00 179.01 177.24 3k6a n LEU 102 N -5.38 2.00 0.00 1.33 7.94 -0.91 -1.28 117.00 120.69 3k6a n LEU 102 Ca -0.08 -0.97 0.00 0.00 -1.11 0.00 0.00 56.01 53.85 3k6a n LEU 102 Cb 0.29 -0.36 0.00 0.00 0.53 0.00 0.00 43.42 43.88 3k6a n LEU 102 CO 0.28 0.35 0.00 0.54 -1.11 0.00 0.00 177.39 177.44 3k6a n ARG 104 N 0.90 0.00 -0.24 1.96 1.74 -0.54 -0.19 116.66 120.29 3k6a n ARG 104 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 3k6a n ARG 104 Cb 0.29 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.78 3k6a n ARG 104 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k6a h ALA 105 N 0.00 0.87 -0.37 7.54 0.00 -1.43 0.97 119.26 126.84 3k6a h ALA 105 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 3k6a h ALA 105 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3k6a h ALA 105 CO 0.00 0.43 0.05 1.49 0.00 0.00 0.00 179.25 181.21 3k6a h GLU 106 N 0.94 0.62 -0.43 0.00 4.57 -0.84 -2.71 114.58 116.73 3k6a h GLU 106 Ca 0.23 -0.17 -0.09 0.00 -1.18 0.00 0.00 59.36 58.15 3k6a h GLU 106 Cb 0.10 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 3k6a h GLU 106 CO -0.03 0.69 -0.09 1.03 -1.18 0.00 0.00 179.01 179.44 3k6a h SER 107 N 0.45 0.74 0.45 1.04 0.87 -1.76 -3.00 113.55 112.35 3k6a h SER 107 Ca 0.11 -0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.46 3k6a h SER 107 Cb 0.39 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3k6a h SER 107 CO 0.01 0.86 -0.02 0.25 -0.53 0.00 0.00 176.83 177.40 3k6a h LEU 108 N 0.69 0.00 -1.08 2.23 5.85 -0.51 -1.85 115.31 120.64 3k6a h LEU 108 Ca 0.12 0.00 0.27 0.00 0.84 0.00 0.00 57.88 59.11 3k6a h LEU 108 Cb 0.55 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.45 3k6a h LEU 108 CO 0.03 0.02 0.61 0.11 -0.34 0.00 0.00 178.44 178.88 3k6a h LYS 109 N 0.00 0.47 0.00 1.25 1.57 -1.34 -3.31 116.57 115.20 3k6a h LYS 109 Ca -0.00 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3k6a h LYS 109 Cb 0.25 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 3k6a h LYS 109 CO 0.00 0.31 -1.13 1.19 -0.57 0.00 0.00 179.45 179.26 3k6a n PHE 110 N -4.86 0.00 -3.84 -1.35 3.72 -0.76 -5.01 117.46 105.36 3k6a n PHE 110 Ca 0.28 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.47 3k6a n PHE 110 Cb 0.84 -0.08 -0.17 0.00 -0.94 0.00 0.00 39.48 39.13 3k6a n PHE 110 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3k6a s VAL 111 N -2.10 0.29 0.54 -4.37 -7.23 -0.81 -5.02 120.40 101.70 3k6a s VAL 111 Ca -0.01 0.13 0.26 0.00 -1.81 0.00 0.00 61.98 60.54 3k6a s VAL 111 Cb 0.01 -0.43 0.39 0.00 0.56 0.00 0.00 36.38 36.91 3k6a s VAL 111 CO 0.09 0.22 2.00 -0.65 -0.31 0.00 0.00 175.10 176.45 3k6a h PRO 112 N 8.00 0.00 0.00 4.82 0.11 -1.87 -1.01 132.00 142.04 3k6a h PRO 112 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3k6a h PRO 112 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3k6a h PRO 112 CO 0.31 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.35 3k6a n THR 113 N -4.32 0.00 -0.25 -1.15 -2.24 -1.26 -3.48 114.28 101.58 3k6a n THR 113 Ca 0.09 0.00 0.20 0.00 -2.27 0.00 0.00 64.05 62.07 3k6a n THR 113 Cb 0.59 -0.44 0.52 0.00 -2.10 0.00 0.00 70.33 68.90 3k6a n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k6a h ALA 114 N 3.57 2.24 0.00 6.98 0.00 -1.49 -1.53 119.26 129.03 3k6a h ALA 114 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3k6a h ALA 114 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3k6a h ALA 114 CO 0.00 -0.54 0.00 0.44 0.00 0.00 0.00 179.25 179.15 3k6a n ILE 115 N -4.52 0.90 0.82 0.00 -5.35 -1.23 -2.05 119.36 107.94 3k6a n ILE 115 Ca 0.20 0.22 0.13 0.00 -0.27 0.00 0.00 62.75 63.03 3k6a n ILE 115 Cb 0.74 -0.99 0.36 0.00 -1.74 0.00 0.00 39.64 38.01 3k6a n ILE 115 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3k6a n LEU 116 N -1.43 0.47 -4.71 7.28 4.77 -0.57 -4.89 117.00 117.92 3k6a n LEU 116 Ca 0.04 0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.90 3k6a n LEU 116 Cb 0.15 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 3k6a n LEU 116 CO 0.12 -0.01 1.03 -0.55 -1.33 0.00 0.00 177.39 176.65 3k6a s SER 117 N -3.58 6.88 -0.14 -1.43 0.15 -0.87 -4.11 113.70 110.59 3k6a s SER 117 Ca 0.10 2.25 0.16 0.00 0.70 0.00 0.00 55.95 59.16 3k6a s SER 117 Cb 0.16 -2.58 0.63 0.00 -1.71 0.00 0.00 66.02 62.52 3k6a s SER 117 CO 0.64 -0.62 1.55 0.54 1.20 0.00 0.00 173.24 176.55 3k6a n ARG 118 N 4.05 3.64 -1.66 5.44 1.74 0.57 -5.00 116.66 125.44 3k6a n ARG 118 Ca 0.11 -2.82 -0.45 0.00 -0.77 0.00 0.00 57.85 53.92 3k6a n ARG 118 Cb 0.43 -1.87 -0.03 0.00 -1.02 0.00 0.00 32.46 29.97 3k6a n ARG 118 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3k6a n GLN 119 N 0.49 1.88 -2.30 5.56 6.02 -1.25 -4.75 117.38 123.03 3k6a n GLN 119 Ca 0.23 0.67 -0.03 0.00 -0.01 0.00 0.00 57.00 57.86 3k6a n GLN 119 Cb 0.89 -2.27 -0.01 0.00 1.02 0.00 0.00 30.24 29.87 3k6a n GLN 119 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 3k6a n THR 120 N 1.56 0.00 -3.58 5.09 5.66 -1.26 -4.52 114.28 117.23 3k6a n THR 120 Ca 0.11 -0.33 -0.15 0.00 -3.05 0.00 0.00 64.05 60.63 3k6a n THR 120 Cb 0.31 0.16 -0.06 0.00 -1.55 0.00 0.00 70.33 69.20 3k6a n THR 120 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3k6a s ALA 121 N -2.18 -1.42 0.22 1.79 0.00 -1.26 -0.97 121.76 117.92 3k6a s ALA 121 Ca 0.05 0.83 -0.18 0.00 0.00 0.00 0.00 51.96 52.67 3k6a s ALA 121 Cb 0.00 0.21 0.06 0.00 0.00 0.00 0.00 23.12 23.39 3k6a s ALA 121 CO 0.04 -0.43 0.86 0.41 0.00 0.00 0.00 175.76 176.65 3k6a n GLY 122 N 0.70 0.79 3.38 0.00 0.00 -0.22 -4.60 105.19 105.25 3k6a n GLY 122 Ca -0.19 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 3k6a n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k6a s LEU 123 N 0.00 2.54 -0.29 0.99 1.43 0.06 -0.67 118.68 122.74 3k6a s LEU 123 Ca 0.19 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 3k6a s LEU 123 Cb -0.03 -1.52 0.07 0.00 0.03 0.00 0.00 46.19 44.74 3k6a s LEU 123 CO 0.07 0.26 -0.04 -0.60 0.23 0.00 0.00 176.35 176.27 3k6a s ARG 124 N -0.24 1.99 6.80 1.70 3.52 -0.25 -0.55 118.95 131.92 3k6a s ARG 124 Ca 0.00 -1.53 0.00 0.00 -0.13 0.00 0.00 55.73 54.07 3k6a s ARG 124 Cb -0.13 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.22 3k6a s ARG 124 CO 0.03 -0.71 0.00 0.41 -0.81 0.00 0.00 175.30 174.22 3k6a n GLY 125 N 4.39 3.75 1.58 8.12 0.00 -1.26 -1.16 105.19 120.61 3k6a n GLY 125 Ca -0.08 0.22 0.08 0.00 0.00 0.00 0.00 46.02 46.24 3k6a n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k6a n ASP 126 N 8.57 5.10 -4.56 1.61 5.68 -1.26 -4.92 116.55 126.77 3k6a n ASP 126 Ca 0.00 -2.85 -0.34 0.00 -0.50 0.00 0.00 54.79 51.10 3k6a n ASP 126 Cb 0.00 -0.63 -0.11 0.00 -1.14 0.00 0.00 41.12 39.24 3k6a n ASP 126 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3k6a s SER 127 N -1.08 5.13 -0.13 -1.12 0.01 -0.31 -4.79 113.70 111.42 3k6a s SER 127 Ca 0.51 -0.03 -0.17 0.00 1.31 0.00 0.00 55.95 57.57 3k6a s SER 127 Cb 0.38 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.74 3k6a s SER 127 CO 0.16 0.19 0.41 -0.22 0.41 0.00 0.00 173.24 174.19 3k6a s LEU 128 N 0.27 4.27 -0.15 2.44 2.96 -0.58 -1.09 118.68 126.81 3k6a s LEU 128 Ca -0.00 0.72 0.02 0.00 -0.22 0.00 0.00 54.13 54.64 3k6a s LEU 128 Cb -0.13 -2.58 0.01 0.00 0.50 0.00 0.00 46.19 43.99 3k6a s LEU 128 CO 0.02 0.05 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.26 3k6a s ILE 129 N 0.49 2.18 -0.09 6.68 1.01 0.16 -0.18 121.20 131.45 3k6a s ILE 129 Ca 0.23 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.97 3k6a s ILE 129 Cb -0.14 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.45 3k6a s ILE 129 CO 0.08 0.54 -0.15 -0.69 0.00 0.00 0.00 174.94 174.72 3k6a s VAL 130 N 0.87 1.43 -0.28 2.92 1.01 -0.01 -1.05 120.40 125.29 3k6a s VAL 130 Ca -0.05 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 61.07 3k6a s VAL 130 Cb -0.15 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 3k6a s VAL 130 CO -0.03 0.42 0.72 0.20 0.00 0.00 0.00 175.10 176.41 3k6a s ASN 131 N 0.73 6.64 0.34 3.32 0.02 -0.15 -1.64 114.94 124.20 3k6a s ASN 131 Ca -0.12 0.71 0.07 0.00 -1.02 0.00 0.00 52.86 52.50 3k6a s ASN 131 Cb -0.16 -2.38 -0.01 0.00 0.02 0.00 0.00 41.25 38.73 3k6a s ASN 131 CO 0.03 -0.49 0.47 -0.76 0.02 0.00 0.00 177.10 176.36 3k6a s LEU 132 N 2.72 3.90 0.00 0.60 1.43 0.50 -4.46 118.68 123.37 3k6a s LEU 132 Ca 0.30 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 3k6a s LEU 132 Cb -0.15 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.38 3k6a s LEU 132 CO 0.10 -0.46 0.00 -0.81 0.23 0.00 0.00 176.35 175.41 3k6a n PRO 133 N -1.64 -0.17 -0.11 1.29 -0.04 -1.26 -3.99 135.00 129.08 3k6a n PRO 133 Ca 0.01 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.23 3k6a n PRO 133 Cb 0.58 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.93 3k6a n PRO 133 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3k6a n GLY 134 N 4.58 -0.54 3.74 0.55 0.00 -1.26 -4.25 105.19 108.01 3k6a n GLY 134 Ca 0.00 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 3k6a n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k6a s LYS 135 N -2.48 4.46 0.28 1.61 2.20 -1.26 -4.48 119.74 120.08 3k6a s LYS 135 Ca -0.33 1.95 0.03 0.00 -0.36 0.00 0.00 55.97 57.26 3k6a s LYS 135 Cb 0.10 -3.21 0.65 0.00 -1.51 0.00 0.00 37.83 33.87 3k6a s LYS 135 CO 0.59 -0.12 1.76 -1.35 -0.36 0.00 0.00 175.35 175.86 3k6a h PRO 136 N 5.00 0.62 -0.36 4.03 0.11 -1.92 0.19 132.00 139.66 3k6a h PRO 136 Ca -0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3k6a h PRO 136 Cb 1.21 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3k6a h PRO 136 CO 0.74 0.41 0.20 -0.22 -0.21 0.00 0.00 178.00 178.91 3k6a h LYS 137 N 0.64 0.51 -0.59 1.05 3.64 -1.98 -1.75 116.57 118.08 3k6a h LYS 137 Ca 0.53 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.77 3k6a h LYS 137 Cb 0.83 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 3k6a h LYS 137 CO -0.40 0.42 0.04 0.77 -2.27 0.00 0.00 179.45 178.01 3k6a h SER 138 N 0.46 0.96 -0.45 4.20 0.02 -1.66 -1.88 113.55 115.18 3k6a h SER 138 Ca 0.13 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 3k6a h SER 138 Cb 0.06 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 3k6a h SER 138 CO -0.02 0.99 0.24 0.40 -1.14 0.00 0.00 176.83 177.30 3k6a h ILE 139 N 0.92 1.17 -0.46 3.27 2.04 -0.45 0.33 117.51 124.33 3k6a h ILE 139 Ca 0.18 -0.43 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 3k6a h ILE 139 Cb 0.48 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3k6a h ILE 139 CO 0.02 0.18 0.08 -0.09 0.00 0.00 0.00 178.15 178.33 3k6a h ARG 140 N 0.59 0.75 -0.46 2.37 9.65 -1.20 -0.58 114.38 125.50 3k6a h ARG 140 Ca 0.16 -0.20 -0.06 0.00 -1.10 0.00 0.00 59.98 58.78 3k6a h ARG 140 Cb 0.06 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 3k6a h ARG 140 CO -0.02 0.77 0.04 0.93 2.80 0.00 0.00 179.97 184.49 3k6a h GLU 141 N 0.62 0.73 0.08 0.20 5.08 -1.15 0.29 114.58 120.42 3k6a h GLU 141 Ca 0.14 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3k6a h GLU 141 Cb 0.38 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3k6a h GLU 141 CO 0.01 0.71 -0.04 0.00 -1.00 0.00 0.00 179.01 178.69 3k6a h LEU 143 N -0.50 0.93 -1.25 0.00 3.38 -1.03 -1.21 115.31 115.63 3k6a h LEU 143 Ca -0.01 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.95 3k6a h LEU 143 Cb 0.43 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3k6a h LEU 143 CO 0.02 0.67 0.51 0.44 0.09 0.00 0.00 178.44 180.17 3k6a h ASP 144 N 1.10 0.86 -0.07 -0.43 3.32 -0.82 0.13 116.42 120.51 3k6a h ASP 144 Ca 0.30 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.22 3k6a h ASP 144 Cb -0.13 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.22 3k6a h ASP 144 CO -0.07 0.61 -0.41 0.00 -1.72 0.00 0.00 179.24 177.66 3k6a h ALA 145 N 1.53 0.15 0.00 3.45 0.00 -0.79 -3.40 119.26 120.20 3k6a h ALA 145 Ca 0.29 -0.48 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 3k6a h ALA 145 Cb -0.06 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3k6a h ALA 145 CO -0.07 0.27 -2.06 1.33 0.00 0.00 0.00 179.25 178.71 3k6a n VAL 146 N -4.34 1.23 -0.02 0.00 0.24 -0.52 -4.43 118.33 110.49 3k6a n VAL 146 Ca -0.08 -0.78 0.03 0.00 -2.04 0.00 0.00 64.34 61.47 3k6a n VAL 146 Cb 0.55 -0.56 0.39 0.00 -1.47 0.00 0.00 33.84 32.75 3k6a n VAL 146 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 3k6a h PHE 147 N 0.00 0.55 0.00 6.34 3.57 -0.95 -2.01 116.94 124.45 3k6a h PHE 147 Ca -0.37 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.13 3k6a h PHE 147 Cb 1.95 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.51 3k6a h PHE 147 CO 0.00 0.38 0.45 -1.35 -2.23 0.00 0.00 178.31 175.56 3k6a h PRO 148 N 0.58 0.00 0.00 6.41 0.11 -1.77 0.18 132.00 137.51 3k6a h PRO 148 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3k6a h PRO 148 Cb -0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3k6a h PRO 148 CO -0.03 0.00 -0.93 0.00 -0.21 0.00 0.00 178.00 176.83 3k6a n ALA 149 N -1.81 4.44 -0.02 -0.75 0.00 -0.75 -1.24 120.51 120.38 3k6a n ALA 149 Ca -0.02 -0.54 -0.16 0.00 0.00 0.00 0.00 53.44 52.72 3k6a n ALA 149 Cb 0.48 -0.84 -0.11 0.00 0.00 0.00 0.00 19.45 18.98 3k6a n ALA 149 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3k6a h ILE 150 N 0.00 1.49 -0.98 0.00 2.04 -0.70 -2.47 117.51 116.89 3k6a h ILE 150 Ca 0.00 -1.96 0.08 0.00 1.00 0.00 0.00 64.86 63.98 3k6a h ILE 150 Cb 0.52 2.66 -0.07 0.00 -0.74 0.00 0.00 36.82 39.19 3k6a h ILE 150 CO 0.00 0.55 0.63 -0.65 0.00 0.00 0.00 178.15 178.68 3k6a h PRO 151 N -0.33 1.07 -0.56 2.37 0.11 -1.83 -0.53 132.00 132.29 3k6a h PRO 151 Ca -0.04 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.91 3k6a h PRO 151 Cb 1.10 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 3k6a h PRO 151 CO 0.07 0.70 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.62 3k6a h TYR 152 N 1.10 1.07 -0.47 0.65 3.20 -1.78 0.29 116.97 121.03 3k6a h TYR 152 Ca 0.44 -0.18 0.05 0.00 3.14 0.00 0.00 58.73 62.18 3k6a h TYR 152 Cb 0.26 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.20 3k6a h TYR 152 CO -0.01 0.97 0.19 0.00 -1.64 0.00 0.00 178.16 177.67 3k6a h ILE 154 N 0.39 1.26 -0.57 0.00 2.04 -0.56 -2.45 117.51 117.62 3k6a h ILE 154 Ca 0.22 -1.17 0.09 0.00 1.00 0.00 0.00 64.86 65.00 3k6a h ILE 154 Cb 0.18 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.05 3k6a h ILE 154 CO -0.19 0.42 0.17 0.44 0.00 0.00 0.00 178.15 178.99 3k6a h ASP 155 N 0.93 0.12 0.00 1.72 3.32 -0.54 0.22 116.42 122.18 3k6a h ASP 155 Ca 0.16 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3k6a h ASP 155 Cb 0.58 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.23 3k6a h ASP 155 CO 0.03 0.08 0.00 0.18 -1.72 0.00 0.00 179.24 177.81 3k6a n LEU 156 N -5.06 1.48 -1.03 1.55 4.77 -0.36 -4.31 117.00 114.03 3k6a n LEU 156 Ca 0.08 -0.67 -0.00 0.00 -0.03 0.00 0.00 56.01 55.38 3k6a n LEU 156 Cb 0.27 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 3k6a n LEU 156 CO 0.21 0.28 0.20 -0.62 -1.33 0.00 0.00 177.39 176.13 3k6a n GLU 158 N 1.71 0.00 -0.91 3.23 1.02 -0.91 -5.11 120.64 119.67 3k6a n GLU 158 Ca 0.00 -1.26 -0.07 0.00 -0.02 0.00 0.00 57.16 55.81 3k6a n GLU 158 Cb 0.15 0.05 0.05 0.00 -0.02 0.00 0.00 31.44 31.66 3k6a n GLU 158 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k6a n GLY 159 N 0.20 -0.13 3.68 0.62 0.00 0.02 -5.04 105.19 104.55 3k6a n GLY 159 Ca -0.05 -1.85 -0.38 0.00 0.00 0.00 0.00 46.02 43.74 3k6a n GLY 159 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k6a n PRO 160 N -1.66 1.14 -2.75 1.61 -0.04 -1.26 -4.62 135.00 127.42 3k6a n PRO 160 Ca 0.05 0.44 -0.43 0.00 -0.04 0.00 0.00 63.50 63.52 3k6a n PRO 160 Cb 0.17 -2.39 -0.04 0.00 -0.04 0.00 0.00 33.50 31.21 3k6a n PRO 160 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3k6a s TYR 161 N -1.41 2.77 0.02 0.54 5.04 -1.26 -4.53 117.35 118.51 3k6a s TYR 161 Ca 0.78 0.22 -0.30 0.00 -2.44 0.00 0.00 57.07 55.33 3k6a s TYR 161 Cb -0.41 -4.19 -0.03 0.00 0.35 0.00 0.00 41.96 37.68 3k6a s TYR 161 CO 0.45 -1.36 0.97 -0.51 -1.34 0.00 0.00 175.55 173.76 3k6a s LEU 162 N 4.21 4.39 -0.13 6.97 1.43 -1.26 -4.98 118.68 129.31 3k6a s LEU 162 Ca 0.36 1.67 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 3k6a s LEU 162 Cb -0.10 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.54 3k6a s LEU 162 CO 0.23 -0.23 -0.09 -1.61 0.23 0.00 0.00 176.35 174.89 3k6a s GLU 163 N 0.84 3.40 0.15 1.70 2.02 -1.26 -4.96 118.70 120.59 3k6a s GLU 163 Ca 0.51 -0.61 0.09 0.00 0.02 0.00 0.00 54.97 54.98 3k6a s GLU 163 Cb -0.21 -2.72 -0.04 0.00 0.10 0.00 0.00 34.13 31.25 3k6a s GLU 163 CO 0.28 0.28 -0.14 0.00 0.02 0.00 0.00 175.26 175.71 3k6a s ASN 165 N -2.52 6.31 0.04 0.00 3.84 0.63 -4.74 114.94 118.48 3k6a s ASN 165 Ca 0.22 0.47 0.22 0.00 0.21 0.00 0.00 52.86 53.97 3k6a s ASN 165 Cb -0.10 -2.55 0.91 0.00 -0.55 0.00 0.00 41.25 38.96 3k6a s ASN 165 CO 0.13 -1.53 1.69 -0.62 -2.79 0.00 0.00 177.10 173.98 3k6a n GLU 166 N 8.33 0.04 0.22 0.43 1.02 -1.25 -1.31 120.64 128.11 3k6a n GLU 166 Ca 0.13 0.17 0.14 0.00 -0.02 0.00 0.00 57.16 57.58 3k6a n GLU 166 Cb 0.49 -1.55 0.40 0.00 -0.02 0.00 0.00 31.44 30.76 3k6a n GLU 166 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k6a h ALA 167 N 2.68 1.00 0.00 0.62 0.00 -1.98 -3.36 119.26 118.22 3k6a h ALA 167 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 3k6a h ALA 167 Cb 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3k6a h ALA 167 CO 0.00 0.00 -2.14 0.28 0.00 0.00 0.00 179.25 177.39 3k6a n VAL 168 N -2.92 1.14 -3.74 0.00 0.31 -0.51 -5.04 118.33 107.57 3k6a n VAL 168 Ca 0.03 -0.37 -0.13 0.00 -0.01 0.00 0.00 64.34 63.86 3k6a n VAL 168 Cb 0.42 -1.46 -0.10 0.00 -0.91 0.00 0.00 33.84 31.78 3k6a n VAL 168 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 3k6a s ILE 169 N -2.39 -0.00 -0.46 2.52 2.07 -0.43 -5.05 121.20 117.47 3k6a s ILE 169 Ca -0.28 0.01 0.00 0.00 -1.41 0.00 0.00 60.65 58.97 3k6a s ILE 169 Cb 0.09 -0.56 0.12 0.00 0.13 0.00 0.00 42.46 42.24 3k6a s ILE 169 CO 0.41 0.00 0.22 -1.59 -1.91 0.00 0.00 174.94 172.08 3k6a s LYS 170 N 0.30 1.98 0.37 3.50 -2.85 -1.26 -3.79 119.74 118.00 3k6a s LYS 170 Ca -0.01 -2.13 -0.27 0.00 -1.00 0.00 0.00 55.97 52.56 3k6a s LYS 170 Cb -0.03 -3.47 -0.09 0.00 -2.06 0.00 0.00 37.83 32.17 3k6a s LYS 170 CO -0.00 -1.07 1.30 -1.25 0.10 0.00 0.00 175.35 174.43 3k6a s PRO 171 N 0.56 4.13 -0.16 1.78 0.04 -1.26 -4.79 135.00 135.30 3k6a s PRO 171 Ca 0.12 2.17 -0.14 0.00 0.04 0.00 0.00 61.00 63.20 3k6a s PRO 171 Cb -0.22 -2.88 -0.05 0.00 0.04 0.00 0.00 34.50 31.39 3k6a s PRO 171 CO -0.04 -0.36 0.28 0.12 0.04 0.00 0.00 177.00 177.04 3k6a s PHE 172 N -1.22 3.46 -0.29 0.56 5.36 -0.38 -5.05 117.98 120.42 3k6a s PHE 172 Ca 0.54 0.58 -0.00 0.00 -0.96 0.00 0.00 56.93 57.09 3k6a s PHE 172 Cb -0.38 -2.33 0.09 0.00 -0.34 0.00 0.00 43.02 40.05 3k6a s PHE 172 CO 0.50 0.24 0.06 1.03 -1.46 0.00 0.00 175.22 175.59 3k6a s ARG 173 N 0.46 0.96 0.00 10.12 0.52 -1.26 -4.46 118.95 125.30 3k6a s ARG 173 Ca 0.16 -1.12 0.31 0.00 -0.52 0.00 0.00 55.73 54.57 3k6a s ARG 173 Cb -0.13 -2.28 1.87 0.00 0.52 0.00 0.00 34.95 34.92 3k6a s ARG 173 CO 0.04 -0.88 2.19 -0.35 0.02 0.00 0.00 175.30 176.31