#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k6a n SER 2 N 0.00 -7.67 -4.72 0.00 2.88 -1.26 -1.69 113.62 101.16 3k6a n SER 2 Ca 0.00 1.67 -0.42 0.00 -1.33 0.00 0.00 58.87 58.79 3k6a n SER 2 Cb 0.00 -4.83 -0.03 0.00 -0.75 0.00 0.00 64.21 58.60 3k6a n SER 2 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3k6a s LYS 3 N -5.19 4.39 0.21 -1.46 2.20 -1.26 -4.70 119.74 113.93 3k6a s LYS 3 Ca 0.00 1.90 -0.30 0.00 -0.36 0.00 0.00 55.97 57.22 3k6a s LYS 3 Cb 0.00 -3.29 -0.08 0.00 -1.51 0.00 0.00 37.83 32.94 3k6a s LYS 3 CO 0.00 -0.31 1.12 0.00 -0.36 0.00 0.00 175.35 175.80 3k6a s ALA 4 N 0.94 3.40 -0.10 3.13 0.00 -1.22 -4.96 121.76 122.95 3k6a s ALA 4 Ca 0.60 0.87 0.04 0.00 0.00 0.00 0.00 51.96 53.47 3k6a s ALA 4 Cb -0.33 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.43 3k6a s ALA 4 CO 0.31 -0.23 -0.24 0.15 0.00 0.00 0.00 175.76 175.75 3k6a s LYS 5 N -0.67 3.03 -0.14 0.00 1.02 -1.26 -0.99 119.74 120.73 3k6a s LYS 5 Ca 0.49 -0.87 0.01 0.00 0.02 0.00 0.00 55.97 55.61 3k6a s LYS 5 Cb -0.31 -2.30 0.02 0.00 -0.52 0.00 0.00 37.83 34.71 3k6a s LYS 5 CO 0.37 0.19 -0.17 0.42 -0.92 0.00 0.00 175.35 175.24 3k6a s ILE 6 N 0.31 1.76 0.23 2.17 1.01 -0.75 -1.83 121.20 124.10 3k6a s ILE 6 Ca -0.18 -0.78 -0.28 0.00 0.00 0.00 0.00 60.65 59.42 3k6a s ILE 6 Cb -0.18 -1.61 -0.09 0.00 0.01 0.00 0.00 42.46 40.60 3k6a s ILE 6 CO 0.09 0.49 0.88 -0.83 0.00 0.00 0.00 174.94 175.57 3k6a s GLY 7 N 1.17 2.99 -0.15 6.18 0.00 0.39 -0.96 107.32 116.95 3k6a s GLY 7 Ca -0.01 0.50 -0.01 0.00 0.00 0.00 0.00 44.72 45.21 3k6a s GLY 7 CO -0.07 1.03 -0.04 -0.42 0.00 0.00 0.00 173.10 173.60 3k6a s ILE 8 N -1.24 0.92 -0.22 0.90 1.01 0.68 -0.99 121.20 122.26 3k6a s ILE 8 Ca 0.41 -0.46 -0.00 0.00 0.00 0.00 0.00 60.65 60.60 3k6a s ILE 8 Cb -0.24 -1.11 0.03 0.00 0.01 0.00 0.00 42.46 41.15 3k6a s ILE 8 CO 0.29 0.14 -0.12 -0.69 0.00 0.00 0.00 174.94 174.56 3k6a s VAL 9 N 1.72 2.48 -0.26 2.92 1.01 -0.29 -1.33 120.40 126.64 3k6a s VAL 9 Ca 0.02 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 3k6a s VAL 9 Cb -0.15 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 3k6a s VAL 9 CO -0.07 0.31 0.18 -0.89 0.00 0.00 0.00 175.10 174.63 3k6a s THR 10 N 1.29 5.33 -0.31 3.92 2.01 -0.08 -0.92 115.64 126.88 3k6a s THR 10 Ca 0.01 0.18 -0.09 0.00 0.31 0.00 0.00 61.69 62.10 3k6a s THR 10 Cb -0.16 -3.52 -0.00 0.00 0.01 0.00 0.00 72.50 68.84 3k6a s THR 10 CO -0.08 0.29 0.13 -0.69 -0.69 0.00 0.00 174.62 173.59 3k6a s VAL 11 N 1.44 4.40 -0.09 3.82 1.01 -0.08 -0.25 120.40 130.66 3k6a s VAL 11 Ca 0.07 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 3k6a s VAL 11 Cb -0.15 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.01 3k6a s VAL 11 CO 0.08 0.07 0.23 -0.55 0.00 0.00 0.00 175.10 174.93 3k6a s SER 12 N 1.58 -0.24 0.00 3.32 0.15 -0.05 -4.33 113.70 114.13 3k6a s SER 12 Ca 0.04 0.47 0.10 0.00 0.70 0.00 0.00 55.95 57.25 3k6a s SER 12 Cb -0.17 0.43 0.58 0.00 -1.71 0.00 0.00 66.02 65.15 3k6a s SER 12 CO 0.05 -0.11 1.02 -0.90 1.20 0.00 0.00 173.24 174.50 3k6a n ASP 13 N 3.40 0.00 -0.13 5.45 5.68 -1.26 -1.54 116.55 128.14 3k6a n ASP 13 Ca -0.17 -0.34 0.02 0.00 -0.50 0.00 0.00 54.79 53.80 3k6a n ASP 13 Cb 0.56 0.00 0.04 0.00 -1.14 0.00 0.00 41.12 40.59 3k6a n ASP 13 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3k6a n ARG 14 N -0.97 2.85 0.17 0.11 1.74 -1.26 -4.76 116.66 114.55 3k6a n ARG 14 Ca 0.07 -1.70 0.06 0.00 -0.77 0.00 0.00 57.85 55.52 3k6a n ARG 14 Cb 0.03 -1.10 0.56 0.00 -1.02 0.00 0.00 32.46 30.94 3k6a n ARG 14 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k6a h ALA 15 N 0.38 1.89 0.00 7.54 0.00 -1.55 -1.48 119.26 126.03 3k6a h ALA 15 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3k6a h ALA 15 Cb 0.59 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3k6a h ALA 15 CO 0.00 0.10 -0.06 0.66 0.00 0.00 0.00 179.25 179.95 3k6a h SER 16 N 0.18 0.00 -3.48 0.00 4.64 -1.85 -3.42 113.55 109.62 3k6a h SER 16 Ca 0.05 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.76 3k6a h SER 16 Cb -0.00 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 61.98 3k6a h SER 16 CO -0.01 0.06 0.30 0.00 -0.87 0.00 0.00 176.83 176.31 3k6a s ALA 17 N -4.03 3.52 0.57 5.18 0.00 -0.56 -4.94 121.76 121.50 3k6a s ALA 17 Ca -0.02 -0.53 0.26 0.00 0.00 0.00 0.00 51.96 51.67 3k6a s ALA 17 Cb 0.12 -3.23 1.66 0.00 0.00 0.00 0.00 23.12 21.67 3k6a s ALA 17 CO 0.53 -1.18 2.20 0.78 0.00 0.00 0.00 175.76 178.10 3k6a h GLY 18 N 9.36 0.00 0.45 0.00 0.00 -1.86 -1.75 103.07 109.28 3k6a h GLY 18 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3k6a h GLY 18 CO 0.85 0.00 0.00 0.29 0.00 0.00 0.00 176.54 177.68 3k6a n ILE 19 N -4.01 0.00 -2.05 2.60 -5.35 -1.26 -4.84 119.36 104.45 3k6a n ILE 19 Ca -0.02 -0.09 -0.42 0.00 -0.27 0.00 0.00 62.75 61.95 3k6a n ILE 19 Cb 0.14 -0.13 -0.03 0.00 -1.74 0.00 0.00 39.64 37.88 3k6a n ILE 19 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 3k6a s TYR 20 N -2.00 2.57 -0.46 4.28 5.04 -0.66 -4.97 117.35 121.14 3k6a s TYR 20 Ca 0.44 0.51 -0.22 0.00 -2.44 0.00 0.00 57.07 55.36 3k6a s TYR 20 Cb 0.21 -3.84 0.03 0.00 0.35 0.00 0.00 41.96 38.71 3k6a s TYR 20 CO 0.35 -3.29 0.73 -2.00 -1.34 0.00 0.00 175.55 170.00 3k6a s GLU 21 N 2.64 3.32 -1.29 4.97 2.56 -1.26 -4.99 118.70 124.65 3k6a s GLU 21 Ca 0.70 -0.30 -0.16 0.00 0.00 0.00 0.00 54.97 55.21 3k6a s GLU 21 Cb -0.36 -3.97 0.10 0.00 2.00 0.00 0.00 34.13 31.90 3k6a s GLU 21 CO 0.30 -1.13 1.71 -3.47 -0.56 0.00 0.00 175.26 172.11 3k6a n ASP 22 N 6.58 4.92 0.14 -1.70 2.03 -1.26 -4.79 116.55 122.47 3k6a n ASP 22 Ca -0.00 -2.94 0.01 0.00 0.52 0.00 0.00 54.79 52.38 3k6a n ASP 22 Cb 0.48 -1.68 0.32 0.00 -0.72 0.00 0.00 41.12 39.51 3k6a n ASP 22 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3k6a h ILE 23 N 5.09 1.26 0.18 5.18 3.07 -1.96 -2.47 117.51 127.86 3k6a h ILE 23 Ca 0.42 -1.26 -0.01 0.00 1.55 0.00 0.00 64.86 65.57 3k6a h ILE 23 Cb 0.84 1.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.98 3k6a h ILE 23 CO 1.45 0.37 -0.09 0.28 -1.05 0.00 0.00 178.15 179.11 3k6a h SER 24 N 0.11 -0.21 -0.67 2.16 0.02 -1.87 -0.73 113.55 112.38 3k6a h SER 24 Ca 0.01 -0.27 0.06 0.00 -0.84 0.00 0.00 61.79 60.76 3k6a h SER 24 Cb 0.65 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.19 3k6a h SER 24 CO 0.05 0.18 0.36 1.23 -1.14 0.00 0.00 176.83 177.51 3k6a h GLY 25 N -0.63 0.98 0.51 -3.77 0.00 -1.91 -1.27 103.07 96.98 3k6a h GLY 25 Ca -0.02 -0.25 0.07 0.00 0.00 0.00 0.00 47.33 47.12 3k6a h GLY 25 CO 0.04 0.14 0.15 1.70 0.00 0.00 0.00 176.54 178.57 3k6a h LYS 26 N 0.67 0.30 -0.85 4.80 1.63 -1.42 -0.87 116.57 120.83 3k6a h LYS 26 Ca 0.30 -0.02 0.03 0.00 -0.85 0.00 0.00 60.65 60.11 3k6a h LYS 26 Cb 0.20 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 31.72 3k6a h LYS 26 CO -0.19 0.20 0.55 0.00 -3.45 0.00 0.00 179.45 176.56 3k6a h ALA 27 N 1.33 1.11 0.06 5.00 0.00 -0.25 0.53 119.26 127.04 3k6a h ALA 27 Ca 0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3k6a h ALA 27 Cb 0.25 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3k6a h ALA 27 CO -0.25 0.41 -0.03 0.82 0.00 0.00 0.00 179.25 180.20 3k6a h ILE 28 N 1.08 0.99 -0.24 0.00 2.04 -0.78 -0.01 117.51 120.60 3k6a h ILE 28 Ca 0.33 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 66.05 3k6a h ILE 28 Cb -0.02 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 3k6a h ILE 28 CO -0.11 0.04 0.15 0.40 0.00 0.00 0.00 178.15 178.63 3k6a h ILE 29 N -0.14 1.04 -0.63 -0.67 2.04 -0.82 -0.69 117.51 117.64 3k6a h ILE 29 Ca -0.01 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.76 3k6a h ILE 29 Cb 0.12 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 3k6a h ILE 29 CO 0.01 0.06 0.40 0.44 0.00 0.00 0.00 178.15 179.06 3k6a h ASP 30 N 0.31 0.68 -0.13 1.72 3.32 -0.83 -1.09 116.42 120.39 3k6a h ASP 30 Ca 0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3k6a h ASP 30 Cb -0.02 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3k6a h ASP 30 CO -0.03 0.48 0.08 0.74 -1.72 0.00 0.00 179.24 178.79 3k6a h THR 31 N 0.81 1.05 -0.23 0.35 2.02 -0.57 -1.26 112.91 115.08 3k6a h THR 31 Ca 0.24 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.25 3k6a h THR 31 Cb -0.04 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3k6a h THR 31 CO -0.08 0.05 -0.07 -0.07 0.37 0.00 0.00 175.52 175.72 3k6a h LEU 32 N 0.16 0.33 -0.70 2.58 3.38 -0.89 0.11 115.31 120.29 3k6a h LEU 32 Ca 0.05 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 3k6a h LEU 32 Cb 0.01 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3k6a h LEU 32 CO -0.01 0.45 -0.11 0.78 0.09 0.00 0.00 178.44 179.64 3k6a h ASN 33 N 0.34 0.89 -0.42 -0.43 2.35 -0.94 -0.70 115.58 116.67 3k6a h ASN 33 Ca 0.07 -0.28 -0.07 0.00 -0.55 0.00 0.00 56.30 55.47 3k6a h ASN 33 Cb 0.34 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 3k6a h ASN 33 CO 0.02 1.01 0.02 0.44 -1.65 0.00 0.00 177.43 177.26 3k6a h ASP 34 N 0.80 0.77 -0.03 5.81 3.32 -0.39 -3.29 116.42 123.41 3k6a h ASP 34 Ca 0.13 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 56.84 3k6a h ASP 34 Cb 0.63 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.99 3k6a h ASP 34 CO 0.04 0.83 -0.58 1.88 -1.72 0.00 0.00 179.24 179.69 3k6a h TYR 35 N 0.76 0.65 -3.13 4.55 -1.99 -0.82 -3.41 116.97 113.57 3k6a h TYR 35 Ca 0.15 -0.33 -0.61 0.00 2.00 0.00 0.00 58.73 59.94 3k6a h TYR 35 Cb 0.43 -0.08 -0.10 0.00 2.00 0.00 0.00 36.73 38.98 3k6a h TYR 35 CO 0.02 1.14 -0.42 -0.51 -0.00 0.00 0.00 178.16 178.39 3k6a s LEU 36 N -8.41 4.27 -0.02 3.88 1.43 -0.29 0.04 118.68 119.60 3k6a s LEU 36 Ca -0.13 0.41 0.16 0.00 -1.03 0.00 0.00 54.13 53.54 3k6a s LEU 36 Cb 0.04 -2.20 -0.23 0.00 0.03 0.00 0.00 46.19 43.83 3k6a s LEU 36 CO 0.83 0.22 0.41 0.35 0.23 0.00 0.00 176.35 178.38 3k6a n THR 37 N 3.10 0.00 -1.72 5.49 -2.24 0.27 -4.72 114.28 114.46 3k6a n THR 37 Ca -0.16 -0.32 -0.30 0.00 -2.27 0.00 0.00 64.05 61.00 3k6a n THR 37 Cb 0.53 0.30 0.05 0.00 -2.10 0.00 0.00 70.33 69.10 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 -3.58 5.38 0.16 3.42 1.04 -1.05 -5.00 113.70 114.07 3k6a s SER 38 Ca -0.04 1.36 -0.30 0.00 0.48 0.00 0.00 55.95 57.45 3k6a s SER 38 Cb 0.11 -2.22 -0.08 0.00 0.10 0.00 0.00 66.02 63.93 3k6a s SER 38 CO 0.66 -1.41 1.25 -1.61 0.98 0.00 0.00 173.24 173.11 3k6a s GLU 39 N -5.19 4.43 0.11 4.02 2.02 -1.26 -4.92 118.70 117.91 3k6a s GLU 39 Ca 0.58 1.93 -0.12 0.00 0.02 0.00 0.00 54.97 57.38 3k6a s GLU 39 Cb -0.13 -3.25 0.01 0.00 0.10 0.00 0.00 34.13 30.87 3k6a s GLU 39 CO 0.54 -0.21 0.29 1.67 0.02 0.00 0.00 175.26 177.57 3k6a s TRP 40 N 0.34 0.05 -0.08 1.61 1.48 -1.26 -3.43 118.94 117.65 3k6a s TRP 40 Ca 0.56 -0.44 0.01 0.00 -1.06 0.00 0.00 56.10 55.18 3k6a s TRP 40 Cb -0.34 0.07 0.02 0.00 -1.16 0.00 0.00 33.47 32.06 3k6a s TRP 40 CO 0.35 -0.63 -0.11 -1.21 -4.06 0.00 0.00 176.95 171.28 3k6a s GLU 41 N -3.86 1.73 0.17 3.25 2.02 -0.16 -4.99 118.70 116.87 3k6a s GLU 41 Ca 0.06 -0.39 -0.30 0.00 0.02 0.00 0.00 54.97 54.36 3k6a s GLU 41 Cb 0.03 -1.52 -0.07 0.00 0.10 0.00 0.00 34.13 32.67 3k6a s GLU 41 CO -0.10 -0.06 1.01 -1.25 0.02 0.00 0.00 175.26 174.88 3k6a s PRO 42 N 0.98 4.70 -0.29 0.39 0.04 -1.26 -1.82 135.00 137.74 3k6a s PRO 42 Ca -0.08 1.57 -0.05 0.00 0.04 0.00 0.00 61.00 62.47 3k6a s PRO 42 Cb -0.15 -3.31 0.02 0.00 0.04 0.00 0.00 34.50 31.10 3k6a s PRO 42 CO -0.00 0.24 0.05 0.42 0.04 0.00 0.00 177.00 177.74 3k6a s ILE 43 N -0.42 3.66 -0.07 0.56 1.01 -0.13 -4.92 121.20 120.88 3k6a s ILE 43 Ca 0.46 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 60.32 3k6a s ILE 43 Cb -0.26 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.30 3k6a s ILE 43 CO 0.33 0.08 -0.20 -0.47 0.00 0.00 0.00 174.94 174.67 3k6a s TYR 44 N 1.44 2.10 -0.02 3.97 5.04 -1.26 -0.23 117.35 128.39 3k6a s TYR 44 Ca 0.01 -0.75 -0.01 0.00 -2.44 0.00 0.00 57.07 53.88 3k6a s TYR 44 Cb -0.17 -1.42 0.02 0.00 0.35 0.00 0.00 41.96 40.73 3k6a s TYR 44 CO 0.01 -0.30 0.05 -0.65 -1.34 0.00 0.00 175.55 173.32 3k6a s GLN 45 N 0.26 0.03 -0.23 4.97 -1.52 -0.44 -4.99 119.66 117.73 3k6a s GLN 45 Ca -0.12 0.14 -0.07 0.00 -1.95 0.00 0.00 55.36 53.36 3k6a s GLN 45 Cb -0.15 -0.08 -0.03 0.00 -0.22 0.00 0.00 33.01 32.53 3k6a s GLN 45 CO 0.05 -0.07 0.05 0.08 -0.25 0.00 0.00 175.29 175.15 3k6a s VAL 46 N 0.46 4.23 0.09 1.09 1.01 -1.26 -0.90 120.40 125.13 3k6a s VAL 46 Ca -0.04 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.77 3k6a s VAL 46 Cb -0.05 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 3k6a s VAL 46 CO -0.02 0.37 -0.09 0.27 0.00 0.00 0.00 175.10 175.63 3k6a s ILE 47 N 1.37 0.86 0.80 2.22 -4.36 0.66 -4.94 121.20 117.81 3k6a s ILE 47 Ca 0.05 -1.61 -0.11 0.00 -0.26 0.00 0.00 60.65 58.72 3k6a s ILE 47 Cb -0.15 -1.31 0.07 0.00 1.25 0.00 0.00 42.46 42.33 3k6a s ILE 47 CO 0.03 -0.57 1.09 -2.16 0.24 0.00 0.00 174.94 173.57 3k6a s PRO 48 N -2.77 2.06 -1.51 0.37 0.04 -1.26 -0.87 135.00 131.06 3k6a s PRO 48 Ca 0.04 0.74 -0.12 0.00 0.04 0.00 0.00 61.00 61.71 3k6a s PRO 48 Cb -0.03 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 3k6a s PRO 48 CO -0.01 -1.67 2.64 -0.40 0.04 0.00 0.00 177.00 177.61 3k6a n ASP 49 N -3.48 6.72 -4.14 6.66 5.75 -1.25 -4.62 116.55 122.21 3k6a n ASP 49 Ca 0.07 -2.66 -0.33 0.00 -0.01 0.00 0.00 54.79 51.86 3k6a n ASP 49 Cb 0.55 -1.56 -0.15 0.00 -1.03 0.00 0.00 41.12 38.93 3k6a n ASP 49 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3k6a s GLU 50 N 2.66 2.86 0.25 0.11 2.02 -1.26 -4.91 118.70 120.42 3k6a s GLU 50 Ca 0.60 -0.93 -0.04 0.00 0.02 0.00 0.00 54.97 54.62 3k6a s GLU 50 Cb 0.16 -2.72 0.40 0.00 0.10 0.00 0.00 34.13 32.06 3k6a s GLU 50 CO -0.06 -0.30 1.82 0.37 0.02 0.00 0.00 175.26 177.10 3k6a h GLN 51 N 7.93 0.83 -0.66 1.61 4.15 -1.89 -1.41 115.11 125.67 3k6a h GLN 51 Ca -0.39 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.00 3k6a h GLN 51 Cb 1.12 -0.19 -0.04 0.00 0.21 0.00 0.00 27.48 28.58 3k6a h GLN 51 CO 0.59 0.55 0.42 -0.44 -1.93 0.00 0.00 178.83 178.02 3k6a h ASP 52 N 0.85 0.70 -0.57 -0.69 3.32 -1.97 -0.18 116.42 117.89 3k6a h ASP 52 Ca 0.40 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.40 3k6a h ASP 52 Cb 0.33 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3k6a h ASP 52 CO -0.23 0.50 0.19 0.58 -1.72 0.00 0.00 179.24 178.56 3k6a h VAL 53 N 0.84 1.23 -0.43 -1.35 2.07 -1.64 -1.02 116.25 115.95 3k6a h VAL 53 Ca 0.26 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3k6a h VAL 53 Cb -0.03 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3k6a h VAL 53 CO -0.09 0.29 0.23 0.40 0.02 0.00 0.00 177.57 178.42 3k6a h ILE 54 N 0.79 1.16 -0.18 4.57 2.04 -0.95 -0.33 117.51 124.62 3k6a h ILE 54 Ca 0.19 -0.43 0.03 0.00 1.00 0.00 0.00 64.86 65.65 3k6a h ILE 54 Cb 0.26 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 3k6a h ILE 54 CO -0.01 0.17 -0.03 -0.33 0.00 0.00 0.00 178.15 177.95 3k6a h GLU 55 N 0.55 0.02 -0.52 2.37 5.08 -0.87 -1.47 114.58 119.74 3k6a h GLU 55 Ca 0.15 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 3k6a h GLU 55 Cb 0.07 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 3k6a h GLU 55 CO -0.02 0.01 0.23 1.15 -1.00 0.00 0.00 179.01 179.38 3k6a h THR 56 N 0.02 0.89 -0.17 1.13 2.02 -0.87 -1.47 112.91 114.47 3k6a h THR 56 Ca 0.09 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 3k6a h THR 56 Cb 0.12 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 3k6a h THR 56 CO -0.17 0.08 0.09 0.74 0.37 0.00 0.00 175.52 176.63 3k6a h THR 57 N 0.45 1.10 -0.82 3.16 2.02 -0.71 -1.15 112.91 116.95 3k6a h THR 57 Ca 0.24 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 67.18 3k6a h THR 57 Cb 0.21 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 3k6a h THR 57 CO -0.20 0.09 0.54 -0.07 0.37 0.00 0.00 175.52 176.25 3k6a h LEU 58 N 0.17 0.92 -0.28 2.58 3.38 -1.05 -3.02 115.31 118.01 3k6a h LEU 58 Ca 0.06 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 3k6a h LEU 58 Cb 0.06 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3k6a h LEU 58 CO -0.01 0.66 -0.14 0.40 0.09 0.00 0.00 178.44 179.44 3k6a h ILE 59 N 1.09 1.30 0.00 1.22 2.04 -1.02 -0.55 117.51 121.58 3k6a h ILE 59 Ca 0.31 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.94 3k6a h ILE 59 Cb -0.08 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3k6a h ILE 59 CO -0.08 0.39 0.00 1.17 0.00 0.00 0.00 178.15 179.63 3k6a n LYS 60 N -4.43 0.00 0.00 2.37 4.81 -0.46 -0.11 118.16 120.34 3k6a n LYS 60 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 3k6a n LYS 60 Cb 0.37 -0.93 0.00 0.00 0.02 0.00 0.00 35.03 34.49 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 0.23 0.00 -0.00 3.14 0.00 -0.22 -0.44 120.51 123.22 3k6a n ALA 62 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3k6a n ALA 62 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3k6a n ALA 62 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3k6a n ASP 63 N 0.00 0.50 -0.04 0.00 8.00 0.84 -4.04 116.55 121.82 3k6a n ASP 63 Ca 0.00 0.22 -0.04 0.00 0.71 0.00 0.00 54.79 55.68 3k6a n ASP 63 Cb 0.00 0.70 -0.05 0.00 -0.02 0.00 0.00 41.12 41.75 3k6a n ASP 63 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3k6a n GLU 64 N -2.73 2.10 -0.19 -1.24 1.02 0.42 -4.69 120.64 115.33 3k6a n GLU 64 Ca -0.14 0.01 0.09 0.00 -0.02 0.00 0.00 57.16 57.11 3k6a n GLU 64 Cb 0.85 -1.18 0.19 0.00 -0.02 0.00 0.00 31.44 31.29 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 -2.40 2.36 -3.73 3.49 6.02 -0.51 -4.98 117.38 117.62 3k6a n GLN 65 Ca -0.13 -2.13 -0.27 0.00 -0.01 0.00 0.00 57.00 54.47 3k6a n GLN 65 Cb 0.71 -1.42 0.06 0.00 1.02 0.00 0.00 30.24 30.61 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 1.15 -5.67 -4.65 1.08 2.03 -1.26 -4.90 116.55 104.34 3k6a n ASP 66 Ca 0.16 -0.64 -0.43 0.00 0.52 0.00 0.00 54.79 54.40 3k6a n ASP 66 Cb 0.52 -4.55 -0.02 0.00 -0.72 0.00 0.00 41.12 36.35 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 -7.43 1.87 -0.06 0.00 2.96 -1.26 -1.23 118.68 113.53 3k6a s LEU 69 Ca -0.01 -0.09 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 3k6a s LEU 69 Cb 0.12 -0.28 0.02 0.00 0.50 0.00 0.00 46.19 46.55 3k6a s LEU 69 CO 0.75 0.04 -0.07 -0.63 -1.32 0.00 0.00 176.35 175.12 3k6a s ILE 70 N 0.08 0.77 -0.01 6.68 1.01 0.97 -0.46 121.20 130.25 3k6a s ILE 70 Ca -0.01 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.47 3k6a s ILE 70 Cb -0.04 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.62 3k6a s ILE 70 CO -0.00 0.29 -0.15 0.68 0.00 0.00 0.00 174.94 175.76 3k6a s VAL 71 N 1.07 3.01 0.20 2.92 -7.23 -0.16 -1.12 120.40 119.09 3k6a s VAL 71 Ca -0.08 -0.92 0.09 0.00 -1.81 0.00 0.00 61.98 59.27 3k6a s VAL 71 Cb -0.14 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 3k6a s VAL 71 CO -0.01 0.47 -0.11 0.42 -0.31 0.00 0.00 175.10 175.56 3k6a s THR 72 N -0.84 3.07 -0.02 5.32 -4.23 -0.77 -1.14 115.64 117.03 3k6a s THR 72 Ca 0.13 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 58.88 3k6a s THR 72 Cb -0.11 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.22 3k6a s THR 72 CO 0.03 -0.15 -0.01 0.28 -0.54 0.00 0.00 174.62 174.23 3k6a s THR 73 N -1.81 0.18 0.00 3.99 -1.32 -0.10 -0.28 115.64 116.31 3k6a s THR 73 Ca 0.25 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.75 3k6a s THR 73 Cb -0.08 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.67 3k6a s THR 73 CO 0.15 0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.28 3k6a n GLY 74 N 3.74 2.57 2.18 6.08 0.00 -1.26 -0.90 105.19 117.60 3k6a n GLY 74 Ca -0.22 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 43.92 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 1.05 0.34 0.00 -0.02 0.00 -1.26 -4.68 105.19 100.61 3k6a n GLY 75 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.55 0.75 -2.18 2.61 -2.24 -1.26 -1.56 114.28 106.84 3k6a n THR 76 Ca -0.02 -0.81 -0.08 0.00 -2.27 0.00 0.00 64.05 60.87 3k6a n THR 76 Cb 0.53 0.64 0.04 0.00 -2.10 0.00 0.00 70.33 69.45 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 -0.38 0.41 0.08 3.38 0.00 -1.26 -0.54 105.19 106.88 3k6a n GLY 77 Ca 0.00 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.63 0.17 -1.70 1.61 -0.04 -1.26 -4.70 135.00 127.47 3k6a n PRO 78 Ca 0.05 0.20 -0.40 0.00 -0.04 0.00 0.00 63.50 63.31 3k6a n PRO 78 Cb 0.18 -1.73 0.02 0.00 -0.04 0.00 0.00 33.50 31.94 3k6a n PRO 78 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k6a n ALA 79 N -1.70 1.17 -0.32 0.55 0.00 -1.26 -4.87 120.51 114.08 3k6a n ALA 79 Ca 0.05 0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.82 3k6a n ALA 79 Cb 0.36 -2.26 0.32 0.00 0.00 0.00 0.00 19.45 17.87 3k6a n ALA 79 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3k6a h LYS 80 N 1.71 0.55 0.00 0.00 1.63 -2.03 -1.24 116.57 117.19 3k6a h LYS 80 Ca -0.48 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 3k6a h LYS 80 Cb 1.31 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 3k6a h LYS 80 CO 0.58 0.36 0.00 0.54 -3.45 0.00 0.00 179.45 177.48 3k6a n ARG 81 N -4.91 0.20 -2.67 1.90 5.12 -1.26 -4.57 116.66 110.47 3k6a n ARG 81 Ca 0.23 0.43 -0.42 0.00 -1.93 0.00 0.00 57.85 56.16 3k6a n ARG 81 Cb 0.62 -1.89 -0.03 0.00 -1.16 0.00 0.00 32.46 30.00 3k6a n ARG 81 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3k6a s ASP 82 N -4.29 6.25 -0.05 0.55 1.11 -0.47 -4.81 116.67 114.96 3k6a s ASP 82 Ca 0.04 -0.89 0.07 0.00 0.18 0.00 0.00 52.55 51.96 3k6a s ASP 82 Cb 0.09 -2.51 0.11 0.00 1.07 0.00 0.00 42.92 41.69 3k6a s ASP 82 CO 0.40 -1.61 1.06 1.33 1.18 0.00 0.00 175.17 177.52 3k6a n VAL 83 N 6.26 1.34 -0.17 -1.27 0.24 -1.12 -4.75 118.33 118.86 3k6a n VAL 83 Ca 0.07 -1.47 -0.08 0.00 -2.04 0.00 0.00 64.34 60.81 3k6a n VAL 83 Cb 0.48 0.22 0.01 0.00 -1.47 0.00 0.00 33.84 33.08 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 0.03 1.21 -0.55 3.34 2.02 -1.56 -2.12 112.91 115.28 3k6a h THR 84 Ca 0.00 -0.64 -0.05 0.00 0.77 0.00 0.00 66.41 66.49 3k6a h THR 84 Cb 0.69 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3k6a h THR 84 CO 0.00 0.24 0.14 -0.65 0.37 0.00 0.00 175.52 175.62 3k6a h PRO 85 N 0.64 0.84 -0.62 6.66 0.11 -1.84 -1.47 132.00 136.31 3k6a h PRO 85 Ca 0.16 -0.17 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 3k6a h PRO 85 Cb 0.19 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.14 3k6a h PRO 85 CO -0.01 0.75 0.31 0.93 -0.21 0.00 0.00 178.00 179.77 3k6a h GLU 86 N 0.81 0.89 -0.86 1.05 3.07 -1.85 0.26 114.58 117.95 3k6a h GLU 86 Ca 0.18 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.36 58.91 3k6a h GLU 86 Cb 0.29 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 27.99 3k6a h GLU 86 CO -0.00 0.71 0.51 0.00 -1.40 0.00 0.00 179.01 178.83 3k6a h ALA 87 N 1.14 1.09 -0.13 3.43 0.00 -1.13 -0.04 119.26 123.62 3k6a h ALA 87 Ca 0.22 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3k6a h ALA 87 Cb 0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3k6a h ALA 87 CO -0.03 0.56 -0.03 1.15 0.00 0.00 0.00 179.25 180.90 3k6a h THR 88 N 1.18 1.29 -0.98 0.00 2.02 -0.75 -1.88 112.91 113.80 3k6a h THR 88 Ca 0.31 -0.96 0.05 0.00 0.77 0.00 0.00 66.41 66.57 3k6a h THR 88 Cb -0.04 1.67 -0.06 0.00 -1.74 0.00 0.00 68.15 67.97 3k6a h THR 88 CO -0.06 0.28 0.63 -0.33 0.37 0.00 0.00 175.52 176.42 3k6a h GLU 89 N -0.06 1.16 -0.57 6.66 5.08 -0.39 -1.51 114.58 124.94 3k6a h GLU 89 Ca 0.03 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3k6a h GLU 89 Cb 0.45 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 3k6a h GLU 89 CO 0.01 0.77 0.30 0.00 -1.00 0.00 0.00 179.01 179.10 3k6a h ALA 90 N 1.42 0.73 0.00 3.43 0.00 -0.69 -3.20 119.26 120.95 3k6a h ALA 90 Ca 0.40 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 3k6a h ALA 90 Cb 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3k6a h ALA 90 CO -0.14 0.26 -0.88 -0.39 0.00 0.00 0.00 179.25 178.10 3k6a h VAL 91 N 0.77 0.52 -3.76 0.00 -1.51 -1.07 -3.46 116.25 107.74 3k6a h VAL 91 Ca 0.20 -1.84 -0.49 0.00 -1.23 0.00 0.00 66.70 63.34 3k6a h VAL 91 Cb 0.06 2.10 -0.02 0.00 -2.13 0.00 0.00 31.29 31.30 3k6a h VAL 91 CO -0.03 0.29 0.30 0.00 -1.23 0.00 0.00 177.57 176.90 3k6a n ASP 93 N 1.01 0.81 -3.04 0.00 5.68 0.25 -4.92 116.55 116.33 3k6a n ASP 93 Ca -0.01 0.25 -0.12 0.00 -0.50 0.00 0.00 54.79 54.41 3k6a n ASP 93 Cb 0.49 0.42 -0.01 0.00 -1.14 0.00 0.00 41.12 40.87 3k6a n ASP 93 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k6a s ARG 94 N -3.32 2.09 0.00 0.11 1.70 -1.17 -5.03 118.95 113.33 3k6a s ARG 94 Ca 0.01 -1.65 0.00 0.00 -0.47 0.00 0.00 55.73 53.62 3k6a s ARG 94 Cb 0.11 0.53 0.00 0.00 -0.57 0.00 0.00 34.95 35.01 3k6a s ARG 94 CO 0.78 -0.92 0.00 -0.35 -1.08 0.00 0.00 175.30 173.73 3k6a n PRO 97 N -0.56 0.26 0.17 3.89 -0.04 -1.26 -0.84 135.00 136.61 3k6a n PRO 97 Ca -0.03 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.49 3k6a n PRO 97 Cb 0.61 -0.03 0.53 0.00 -0.04 0.00 0.00 33.50 34.56 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 0.18 0.67 0.55 0.00 -2.00 -2.59 103.07 99.89 3k6a h GLY 98 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 3k6a h GLY 98 CO 0.00 0.08 -0.06 0.74 0.00 0.00 0.00 176.54 177.29 3k6a h PHE 99 N 0.17 -0.16 -0.77 5.60 0.04 -1.97 -2.05 116.94 117.80 3k6a h PHE 99 Ca 0.04 -0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.85 3k6a h PHE 99 Cb 0.09 0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.25 3k6a h PHE 99 CO 0.00 0.16 0.48 0.78 -0.60 0.00 0.00 178.31 179.13 3k6a h GLY 100 N -0.50 1.12 0.69 -1.45 0.00 -1.77 -2.58 103.07 98.58 3k6a h GLY 100 Ca -0.02 -0.36 0.01 0.00 0.00 0.00 0.00 47.33 46.97 3k6a h GLY 100 CO 0.03 0.29 -0.21 0.83 0.00 0.00 0.00 176.54 177.48 3k6a h GLU 101 N 0.92 -0.40 -1.22 4.80 5.08 -1.47 -1.78 114.58 120.51 3k6a h GLU 101 Ca 0.31 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3k6a h GLU 101 Cb 0.06 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3k6a h GLU 101 CO -0.13 -0.27 0.00 -0.11 -1.00 0.00 0.00 179.01 177.50 3k6a n LEU 102 N -5.33 0.52 0.00 1.33 7.94 -0.77 -1.19 117.00 119.49 3k6a n LEU 102 Ca -0.07 -0.26 0.00 0.00 -1.11 0.00 0.00 56.01 54.57 3k6a n LEU 102 Cb 0.25 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.08 3k6a n LEU 102 CO 0.28 0.09 0.00 0.54 -1.11 0.00 0.00 177.39 177.19 3k6a n ARG 104 N 0.71 0.00 -0.15 1.96 1.74 -0.67 -0.75 116.66 119.50 3k6a n ARG 104 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 3k6a n ARG 104 Cb 0.09 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.54 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 0.57 -0.79 7.54 0.00 -1.39 0.17 119.26 125.35 3k6a h ALA 105 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3k6a h ALA 105 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3k6a h ALA 105 CO 0.00 0.07 0.39 0.93 0.00 0.00 0.00 179.25 180.64 3k6a h GLU 106 N 0.59 1.13 -0.28 0.00 4.39 -1.21 -3.08 114.58 116.12 3k6a h GLU 106 Ca 0.16 -0.16 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 3k6a h GLU 106 Cb 0.01 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 3k6a h GLU 106 CO -0.03 0.87 -0.41 1.03 -1.16 0.00 0.00 179.01 179.30 3k6a h SER 107 N 1.11 0.74 0.51 1.42 0.87 -1.75 -3.07 113.55 113.38 3k6a h SER 107 Ca 0.27 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 3k6a h SER 107 Cb 0.10 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.85 3k6a h SER 107 CO -0.04 1.06 0.00 -0.11 -0.53 0.00 0.00 176.83 177.21 3k6a n LEU 108 N -4.03 0.50 0.24 2.23 7.94 0.56 -1.17 117.00 123.27 3k6a n LEU 108 Ca -0.02 0.65 0.13 0.00 -1.11 0.00 0.00 56.01 55.65 3k6a n LEU 108 Cb 0.54 -0.61 0.76 0.00 0.53 0.00 0.00 43.42 44.64 3k6a n LEU 108 CO 0.46 -0.58 1.11 0.11 -1.11 0.00 0.00 177.39 177.38 3k6a h LYS 109 N 0.00 0.00 0.00 1.96 1.57 -1.48 -3.35 116.57 115.28 3k6a h LYS 109 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 3k6a h LYS 109 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3k6a h LYS 109 CO 0.00 0.00 -1.50 1.19 -0.57 0.00 0.00 179.45 178.57 3k6a n PHE 110 N -4.20 0.00 -3.95 -1.35 3.72 -0.32 -5.06 117.46 106.30 3k6a n PHE 110 Ca -0.01 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.24 3k6a n PHE 110 Cb 0.16 -0.34 -0.15 0.00 -0.94 0.00 0.00 39.48 38.21 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 -2.18 0.15 -0.83 -4.37 -7.23 -0.97 -5.03 120.40 99.96 3k6a s VAL 111 Ca -0.10 0.00 0.22 0.00 -1.81 0.00 0.00 61.98 60.29 3k6a s VAL 111 Cb 0.03 -0.19 0.21 0.00 0.56 0.00 0.00 36.38 36.98 3k6a s VAL 111 CO 0.23 0.09 1.69 -0.81 -0.31 0.00 0.00 175.10 175.98 3k6a n PRO 112 N 3.55 0.09 0.00 4.82 -0.04 -1.26 -2.05 135.00 140.11 3k6a n PRO 112 Ca -0.19 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 3k6a n PRO 112 Cb 0.55 -1.64 0.70 0.00 -0.04 0.00 0.00 33.50 33.07 3k6a n PRO 112 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3k6a n THR 113 N -1.80 0.00 -0.22 0.52 -2.24 -1.26 -3.46 114.28 105.82 3k6a n THR 113 Ca 0.04 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 62.01 3k6a n THR 113 Cb 0.27 -0.52 0.53 0.00 -2.10 0.00 0.00 70.33 68.50 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 3.55 2.23 0.00 6.98 0.00 -1.71 -0.45 119.26 129.86 3k6a h ALA 114 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3k6a h ALA 114 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3k6a h ALA 114 CO 0.00 -0.50 0.00 0.44 0.00 0.00 0.00 179.25 179.19 3k6a n ILE 115 N -4.48 0.89 0.69 0.00 -5.35 -1.22 -1.96 119.36 107.92 3k6a n ILE 115 Ca 0.18 0.22 0.13 0.00 -0.27 0.00 0.00 62.75 63.01 3k6a n ILE 115 Cb 0.68 -0.97 0.45 0.00 -1.74 0.00 0.00 39.64 38.05 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 -1.60 0.65 -4.73 7.28 4.77 -0.18 -4.87 117.00 118.32 3k6a n LEU 116 Ca 0.04 0.56 -0.42 0.00 -0.03 0.00 0.00 56.01 56.16 3k6a n LEU 116 Cb 0.20 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 3k6a n LEU 116 CO 0.16 -0.15 0.95 -0.55 -1.33 0.00 0.00 177.39 176.47 3k6a s SER 117 N -4.23 6.97 -0.08 -1.43 0.15 -0.83 -4.07 113.70 110.18 3k6a s SER 117 Ca 0.11 2.26 0.15 0.00 0.70 0.00 0.00 55.95 59.17 3k6a s SER 117 Cb 0.14 -2.60 0.48 0.00 -1.71 0.00 0.00 66.02 62.32 3k6a s SER 117 CO 0.58 -0.50 1.40 0.54 1.20 0.00 0.00 173.24 176.46 3k6a n ARG 118 N 3.12 3.08 -1.63 5.44 1.74 0.30 -5.02 116.66 123.70 3k6a n ARG 118 Ca 0.07 -2.50 -0.47 0.00 -0.77 0.00 0.00 57.85 54.19 3k6a n ARG 118 Cb 0.44 -1.59 -0.04 0.00 -1.02 0.00 0.00 32.46 30.25 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 0.37 1.62 -2.19 5.56 6.02 -1.25 -4.71 117.38 122.79 3k6a n GLN 119 Ca 0.18 0.58 -0.02 0.00 -0.01 0.00 0.00 57.00 57.73 3k6a n GLN 119 Cb 0.68 -2.17 -0.01 0.00 1.02 0.00 0.00 30.24 29.76 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 1.88 0.00 -3.58 5.09 5.66 -1.26 -4.56 114.28 117.50 3k6a n THR 120 Ca 0.14 -0.21 -0.16 0.00 -3.05 0.00 0.00 64.05 60.77 3k6a n THR 120 Cb 0.28 0.09 -0.07 0.00 -1.55 0.00 0.00 70.33 69.08 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 -2.11 -1.66 0.39 1.79 0.00 -1.26 -0.73 121.76 118.19 3k6a s ALA 121 Ca 0.03 1.40 -0.15 0.00 0.00 0.00 0.00 51.96 53.23 3k6a s ALA 121 Cb 0.00 -0.31 0.06 0.00 0.00 0.00 0.00 23.12 22.87 3k6a s ALA 121 CO 0.02 -0.35 0.79 0.20 0.00 0.00 0.00 175.76 176.43 3k6a s GLY 122 N -0.76 0.40 -0.09 0.00 0.00 -0.08 -4.56 107.32 102.24 3k6a s GLY 122 Ca -0.08 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 43.89 3k6a s GLY 122 CO 0.07 -0.33 -0.18 1.08 0.00 0.00 0.00 173.10 173.74 3k6a s LEU 123 N -3.08 2.48 -0.31 0.66 1.43 -0.02 -0.75 118.68 119.09 3k6a s LEU 123 Ca 0.16 -0.37 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3k6a s LEU 123 Cb -0.05 -1.51 0.05 0.00 0.03 0.00 0.00 46.19 44.71 3k6a s LEU 123 CO 0.12 0.23 0.02 -0.60 0.23 0.00 0.00 176.35 176.35 3k6a s ARG 124 N -0.07 2.40 7.94 1.70 3.52 -0.47 -0.58 118.95 133.37 3k6a s ARG 124 Ca -0.04 -1.31 0.00 0.00 -0.13 0.00 0.00 55.73 54.25 3k6a s ARG 124 Cb -0.14 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 30.02 3k6a s ARG 124 CO 0.04 -0.66 0.00 0.41 -0.81 0.00 0.00 175.30 174.28 3k6a n GLY 125 N 4.63 3.68 1.59 8.12 0.00 -1.26 -1.47 105.19 120.47 3k6a n GLY 125 Ca -0.12 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 45.90 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 6.00 4.71 -4.56 1.61 5.68 -1.26 -4.90 116.55 123.82 3k6a n ASP 126 Ca 0.00 -2.66 -0.35 0.00 -0.50 0.00 0.00 54.79 51.29 3k6a n ASP 126 Cb 0.00 -0.62 -0.11 0.00 -1.14 0.00 0.00 41.12 39.25 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 -0.70 5.33 -0.10 -1.12 0.01 -0.54 -4.81 113.70 111.76 3k6a s SER 127 Ca 0.45 -0.03 -0.19 0.00 1.31 0.00 0.00 55.95 57.48 3k6a s SER 127 Cb 0.33 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.60 3k6a s SER 127 CO 0.16 0.13 0.53 -0.22 0.41 0.00 0.00 173.24 174.25 3k6a s LEU 128 N 0.65 4.29 -0.17 2.44 2.96 -0.37 -1.37 118.68 127.11 3k6a s LEU 128 Ca 0.02 0.91 0.01 0.00 -0.22 0.00 0.00 54.13 54.85 3k6a s LEU 128 Cb -0.13 -2.79 0.01 0.00 0.50 0.00 0.00 46.19 43.77 3k6a s LEU 128 CO 0.02 -0.03 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.22 3k6a s ILE 129 N 0.65 2.42 -0.07 6.68 1.01 0.07 -0.02 121.20 131.94 3k6a s ILE 129 Ca 0.29 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 60.12 3k6a s ILE 129 Cb -0.16 -2.02 0.02 0.00 0.01 0.00 0.00 42.46 40.31 3k6a s ILE 129 CO 0.12 0.52 -0.11 -0.69 0.00 0.00 0.00 174.94 174.78 3k6a s VAL 130 N 1.04 1.09 -0.15 2.92 1.01 -0.28 -0.90 120.40 125.12 3k6a s VAL 130 Ca -0.01 -0.43 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 3k6a s VAL 130 Cb -0.15 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 3k6a s VAL 130 CO -0.05 0.35 0.80 0.20 0.00 0.00 0.00 175.10 176.40 3k6a s ASN 131 N 0.86 6.94 0.37 3.32 0.02 0.10 -1.85 114.94 124.71 3k6a s ASN 131 Ca -0.11 1.16 0.07 0.00 -1.02 0.00 0.00 52.86 52.96 3k6a s ASN 131 Cb -0.15 -2.44 -0.02 0.00 0.02 0.00 0.00 41.25 38.66 3k6a s ASN 131 CO 0.01 -0.35 0.38 -0.76 0.02 0.00 0.00 177.10 176.41 3k6a s LEU 132 N 1.93 3.59 0.00 0.60 1.43 0.62 -4.55 118.68 122.30 3k6a s LEU 132 Ca 0.38 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 3k6a s LEU 132 Cb -0.17 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.75 3k6a s LEU 132 CO 0.13 -0.51 0.00 -0.81 0.23 0.00 0.00 176.35 175.39 3k6a n PRO 133 N -1.53 0.70 -0.13 1.29 -0.04 -1.26 -3.99 135.00 130.03 3k6a n PRO 133 Ca 0.01 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.21 3k6a n PRO 133 Cb 0.60 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.96 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 4.66 -0.42 3.75 0.55 0.00 -1.26 -4.10 105.19 108.37 3k6a n GLY 134 Ca 0.00 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 3k6a n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k6a s LYS 135 N -2.50 4.48 0.27 1.61 1.02 -1.26 -4.50 119.74 118.86 3k6a s LYS 135 Ca -0.37 1.97 -0.01 0.00 0.02 0.00 0.00 55.97 57.58 3k6a s LYS 135 Cb 0.13 -3.18 0.57 0.00 -0.52 0.00 0.00 37.83 34.83 3k6a s LYS 135 CO 0.50 -0.07 1.72 -1.35 -0.92 0.00 0.00 175.35 175.23 3k6a h PRO 136 N 4.57 0.45 -0.01 -1.68 0.11 -1.91 0.78 132.00 134.30 3k6a h PRO 136 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3k6a h PRO 136 Cb 1.22 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3k6a h PRO 136 CO 0.72 0.29 0.01 -0.22 -0.21 0.00 0.00 178.00 178.59 3k6a h LYS 137 N 0.46 0.01 -0.79 1.05 3.64 -1.99 -0.37 116.57 118.58 3k6a h LYS 137 Ca 0.48 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.81 3k6a h LYS 137 Cb 0.80 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.58 3k6a h LYS 137 CO -0.45 0.02 0.32 0.77 -2.27 0.00 0.00 179.45 177.84 3k6a h SER 138 N 0.01 1.08 -0.24 4.20 0.02 -1.71 -1.76 113.55 115.16 3k6a h SER 138 Ca 0.00 -0.16 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 3k6a h SER 138 Cb 0.00 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 3k6a h SER 138 CO -0.00 0.95 0.01 0.40 -1.14 0.00 0.00 176.83 177.06 3k6a h ILE 139 N 1.15 0.85 -0.70 3.27 2.04 0.77 -0.47 117.51 124.42 3k6a h ILE 139 Ca 0.26 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 66.06 3k6a h ILE 139 Cb 0.20 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 3k6a h ILE 139 CO -0.02 0.02 0.29 -0.09 0.00 0.00 0.00 178.15 178.35 3k6a h ARG 140 N 0.09 1.03 -0.56 2.37 9.65 -0.94 -1.38 114.38 124.65 3k6a h ARG 140 Ca 0.11 -0.18 -0.08 0.00 -1.10 0.00 0.00 59.98 58.73 3k6a h ARG 140 Cb 0.13 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.52 3k6a h ARG 140 CO -0.18 0.84 0.03 0.93 2.80 0.00 0.00 179.97 184.39 3k6a h GLU 141 N 0.99 0.95 0.26 0.20 5.08 -1.08 -0.45 114.58 120.52 3k6a h GLU 141 Ca 0.23 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3k6a h GLU 141 Cb 0.19 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3k6a h GLU 141 CO -0.02 0.92 -0.13 0.00 -1.00 0.00 0.00 179.01 178.78 3k6a h LEU 143 N -0.61 0.71 -1.30 0.00 3.38 -1.14 -1.12 115.31 115.24 3k6a h LEU 143 Ca -0.04 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.08 3k6a h LEU 143 Cb 0.44 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 3k6a h LEU 143 CO 0.06 0.47 0.56 0.44 0.09 0.00 0.00 178.44 180.06 3k6a h ASP 144 N 0.85 0.67 0.02 -0.43 3.32 -1.01 0.19 116.42 120.02 3k6a h ASP 144 Ca 0.32 0.03 -0.16 0.00 0.02 0.00 0.00 57.03 57.24 3k6a h ASP 144 Cb 0.12 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.58 3k6a h ASP 144 CO -0.15 0.36 -0.65 0.00 -1.72 0.00 0.00 179.24 177.08 3k6a h ALA 145 N 1.59 0.06 0.00 3.45 0.00 -0.84 -3.40 119.26 120.12 3k6a h ALA 145 Ca 0.43 -0.59 -0.22 0.00 0.00 0.00 0.00 54.91 54.53 3k6a h ALA 145 Cb 0.63 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 3k6a h ALA 145 CO -0.19 0.37 -2.01 1.33 0.00 0.00 0.00 179.25 178.75 3k6a n VAL 146 N -4.19 0.97 0.17 0.00 0.24 -0.59 -4.42 118.33 110.50 3k6a n VAL 146 Ca -0.11 -0.72 0.04 0.00 -2.04 0.00 0.00 64.34 61.52 3k6a n VAL 146 Cb 0.70 -0.43 0.47 0.00 -1.47 0.00 0.00 33.84 33.11 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 0.15 -0.25 6.34 3.57 -0.82 -2.40 116.94 123.53 3k6a h PHE 147 Ca -0.29 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.27 3k6a h PHE 147 Cb 1.73 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.42 3k6a h PHE 147 CO 0.00 0.24 0.31 -1.35 -2.23 0.00 0.00 178.31 175.29 3k6a h PRO 148 N 0.14 0.00 0.00 6.41 0.11 -1.78 0.11 132.00 136.99 3k6a h PRO 148 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3k6a h PRO 148 Cb 0.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3k6a h PRO 148 CO 0.01 0.00 -0.44 0.00 -0.21 0.00 0.00 178.00 177.36 3k6a n ALA 149 N -2.28 3.20 -0.02 -0.75 0.00 -0.90 -1.23 120.51 118.52 3k6a n ALA 149 Ca 0.03 -0.28 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 3k6a n ALA 149 Cb 0.45 -1.19 -0.10 0.00 0.00 0.00 0.00 19.45 18.60 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 1.46 -0.99 0.00 2.04 -1.03 -2.76 117.51 116.23 3k6a h ILE 150 Ca 0.00 -1.83 0.09 0.00 1.00 0.00 0.00 64.86 64.12 3k6a h ILE 150 Cb 0.56 2.51 -0.08 0.00 -0.74 0.00 0.00 36.82 39.07 3k6a h ILE 150 CO 0.00 0.52 0.63 -0.65 0.00 0.00 0.00 178.15 178.64 3k6a h PRO 151 N -0.27 1.03 -0.29 2.37 0.11 -1.80 -0.74 132.00 132.40 3k6a h PRO 151 Ca -0.03 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.94 3k6a h PRO 151 Cb 1.01 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.88 3k6a h PRO 151 CO 0.07 0.68 -0.13 -0.92 -0.21 0.00 0.00 178.00 177.48 3k6a h TYR 152 N 1.06 0.54 -0.46 0.65 3.20 -1.78 -1.04 116.97 119.13 3k6a h TYR 152 Ca 0.46 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.24 3k6a h TYR 152 Cb 0.33 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3k6a h TYR 152 CO -0.01 0.62 0.26 0.00 -1.64 0.00 0.00 178.16 177.39 3k6a h ILE 154 N 0.61 1.25 -0.65 0.00 2.04 -0.94 -2.22 117.51 117.61 3k6a h ILE 154 Ca 0.16 -0.93 0.13 0.00 1.00 0.00 0.00 64.86 65.23 3k6a h ILE 154 Cb 0.04 0.81 -0.09 0.00 -0.74 0.00 0.00 36.82 36.83 3k6a h ILE 154 CO -0.03 0.34 0.13 0.44 0.00 0.00 0.00 178.15 179.03 3k6a h ASP 155 N 0.77 -0.02 0.00 1.72 3.32 -0.87 0.44 116.42 121.79 3k6a h ASP 155 Ca 0.17 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3k6a h ASP 155 Cb 0.38 0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3k6a h ASP 155 CO 0.01 -0.01 0.00 0.18 -1.72 0.00 0.00 179.24 177.69 3k6a n LEU 156 N -5.15 1.89 -1.47 1.55 4.77 -0.52 -4.27 117.00 113.81 3k6a n LEU 156 Ca 0.11 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 3k6a n LEU 156 Cb 0.37 -0.39 -0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3k6a n LEU 156 CO 0.15 0.35 0.16 -0.62 -1.33 0.00 0.00 177.39 176.10 3k6a n GLU 158 N 1.65 0.14 -0.28 3.23 1.02 -0.97 -5.11 120.64 120.32 3k6a n GLU 158 Ca 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 57.16 55.36 3k6a n GLU 158 Cb 0.19 0.06 0.00 0.00 -0.02 0.00 0.00 31.44 31.67 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 0.23 -0.22 3.75 0.62 0.00 0.11 -4.29 105.19 105.40 3k6a n GLY 159 Ca -0.05 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.83 3k6a n GLY 159 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k6a s PRO 160 N -2.49 2.69 -0.57 1.61 0.02 -1.26 -3.51 135.00 131.48 3k6a s PRO 160 Ca 0.00 1.57 -0.24 0.00 0.02 0.00 0.00 61.00 62.35 3k6a s PRO 160 Cb 0.00 -1.92 0.05 0.00 0.02 0.00 0.00 34.50 32.65 3k6a s PRO 160 CO 0.00 -1.37 0.93 -0.47 -0.33 0.00 0.00 177.00 175.76 3k6a s TYR 161 N -2.10 2.78 0.16 6.54 5.04 -0.68 -4.51 117.35 124.57 3k6a s TYR 161 Ca 0.71 -0.16 -0.30 0.00 -2.44 0.00 0.00 57.07 54.88 3k6a s TYR 161 Cb -0.24 -4.09 -0.07 0.00 0.35 0.00 0.00 41.96 37.91 3k6a s TYR 161 CO 0.40 -1.40 0.97 -0.51 -1.34 0.00 0.00 175.55 173.67 3k6a s LEU 162 N 3.92 4.54 -0.05 6.97 1.43 -1.26 -4.99 118.68 129.24 3k6a s LEU 162 Ca 0.28 1.88 0.06 0.00 -1.03 0.00 0.00 54.13 55.32 3k6a s LEU 162 Cb -0.14 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 3k6a s LEU 162 CO 0.17 -0.02 -0.24 -1.61 0.23 0.00 0.00 176.35 174.88 3k6a s GLU 163 N -0.41 2.52 0.16 1.70 2.02 -1.26 -4.97 118.70 118.46 3k6a s GLU 163 Ca 0.45 -0.89 0.09 0.00 0.02 0.00 0.00 54.97 54.65 3k6a s GLU 163 Cb -0.25 -2.18 -0.04 0.00 0.10 0.00 0.00 34.13 31.76 3k6a s GLU 163 CO 0.31 0.41 -0.13 0.00 0.02 0.00 0.00 175.26 175.87 3k6a s ASN 165 N -2.63 5.58 0.02 0.00 2.47 0.11 -4.66 114.94 115.82 3k6a s ASN 165 Ca 0.23 -0.34 0.08 0.00 0.42 0.00 0.00 52.86 53.25 3k6a s ASN 165 Cb -0.09 -2.55 0.35 0.00 -1.45 0.00 0.00 41.25 37.51 3k6a s ASN 165 CO 0.13 -2.26 1.25 -0.62 -3.72 0.00 0.00 177.10 171.89 3k6a n GLU 166 N 9.10 0.01 0.20 0.43 1.02 -1.23 -0.63 120.64 129.54 3k6a n GLU 166 Ca 0.24 0.40 0.15 0.00 -0.02 0.00 0.00 57.16 57.93 3k6a n GLU 166 Cb 0.50 -1.54 0.60 0.00 -0.02 0.00 0.00 31.44 30.99 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 2.22 1.00 0.00 0.62 0.00 -1.97 -3.36 119.26 117.77 3k6a h ALA 167 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3k6a h ALA 167 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3k6a h ALA 167 CO 0.00 0.00 -1.13 0.28 0.00 0.00 0.00 179.25 178.40 3k6a n VAL 168 N -2.65 0.14 -3.71 0.00 0.31 0.20 -5.07 118.33 107.56 3k6a n VAL 168 Ca 0.01 -0.06 -0.13 0.00 -0.01 0.00 0.00 64.34 64.15 3k6a n VAL 168 Cb 0.26 -0.68 -0.09 0.00 -0.91 0.00 0.00 33.84 32.42 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 -2.05 0.00 -0.33 2.52 2.07 -0.51 -5.05 121.20 117.86 3k6a s ILE 169 Ca -0.03 -0.02 0.04 0.00 -1.41 0.00 0.00 60.65 59.23 3k6a s ILE 169 Cb 0.01 -0.68 0.09 0.00 0.13 0.00 0.00 42.46 42.01 3k6a s ILE 169 CO 0.06 -0.01 0.04 -1.59 -1.91 0.00 0.00 174.94 171.52 3k6a s LYS 170 N 0.14 1.61 0.53 3.50 -2.85 -1.26 -3.55 119.74 117.86 3k6a s LYS 170 Ca -0.01 -1.80 -0.21 0.00 -1.00 0.00 0.00 55.97 52.94 3k6a s LYS 170 Cb -0.03 -3.18 -0.05 0.00 -2.06 0.00 0.00 37.83 32.50 3k6a s LYS 170 CO 0.01 -0.89 1.28 -2.14 0.10 0.00 0.00 175.35 173.71 3k6a s PRO 171 N 0.94 3.27 -0.22 1.78 0.02 -1.26 -4.78 135.00 134.75 3k6a s PRO 171 Ca 0.08 2.04 -0.09 0.00 0.02 0.00 0.00 61.00 63.06 3k6a s PRO 171 Cb -0.19 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 32.05 3k6a s PRO 171 CO -0.07 -1.03 0.10 0.12 -0.33 0.00 0.00 177.00 175.79 3k6a s PHE 172 N -1.41 3.24 -0.23 6.54 5.36 -0.36 -5.05 117.98 126.06 3k6a s PHE 172 Ca 0.71 0.04 -0.01 0.00 -0.96 0.00 0.00 56.93 56.70 3k6a s PHE 172 Cb -0.36 -2.19 0.06 0.00 -0.34 0.00 0.00 43.02 40.20 3k6a s PHE 172 CO 0.42 0.01 -0.00 1.03 -1.46 0.00 0.00 175.22 175.21 3k6a s ARG 173 N 0.91 1.15 0.60 10.12 0.52 -1.26 -4.46 118.95 126.54 3k6a s ARG 173 Ca 0.05 -0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 54.47 3k6a s ARG 173 Cb -0.13 -2.36 0.04 0.00 0.52 0.00 0.00 34.95 33.02 3k6a s ARG 173 CO 0.03 -0.65 0.85 -1.25 0.02 0.00 0.00 175.30 174.30 3k6a s PRO 174 N 1.59 2.43 0.00 3.54 0.04 -1.26 -5.17 135.00 136.17 3k6a s PRO 174 Ca -0.02 -0.62 0.19 0.00 0.04 0.00 0.00 61.00 60.58 3k6a s PRO 174 Cb -0.18 -2.39 1.12 0.00 0.04 0.00 0.00 34.50 33.09 3k6a s PRO 174 CO -0.08 -0.88 1.51 0.36 0.04 0.00 0.00 177.00 177.95