#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i6m s TYR 2 N 0.00 0.81 -0.13 1.12 1.13 -0.04 -4.99 117.35 115.25 2i6m s TYR 2 Ca 0.00 -0.49 -0.06 0.00 -1.41 0.00 0.00 57.07 55.11 2i6m s TYR 2 Cb 0.00 -0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 40.35 2i6m s TYR 2 CO 0.00 -0.05 0.10 -1.58 -2.51 0.00 0.00 175.55 171.51 2i6m s TRP 3 N -1.37 3.42 -0.17 -3.49 0.52 -1.26 0.05 118.94 116.64 2i6m s TRP 3 Ca -0.08 0.36 -0.00 0.00 0.02 0.00 0.00 56.10 56.40 2i6m s TRP 3 Cb -0.10 -1.95 -0.22 0.00 -1.15 0.00 0.00 33.47 30.05 2i6m s TRP 3 CO 0.01 0.54 0.13 0.28 0.02 0.00 0.00 176.95 177.93 2i6m n VAL 4 N 2.43 1.63 -3.75 4.03 0.31 0.69 -4.74 118.33 118.93 2i6m n VAL 4 Ca -0.19 -0.65 -0.29 0.00 -0.01 0.00 0.00 64.34 63.21 2i6m n VAL 4 Cb 0.54 -1.48 -0.16 0.00 -0.91 0.00 0.00 33.84 31.84 2i6m n VAL 4 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2i6m s ARG 5 N -2.54 0.76 -0.21 5.55 1.81 -0.70 -5.01 118.95 118.61 2i6m s ARG 5 Ca -0.25 -0.77 -0.12 0.00 -1.72 0.00 0.00 55.73 52.87 2i6m s ARG 5 Cb 0.08 -2.07 -0.06 0.00 -0.45 0.00 0.00 34.95 32.44 2i6m s ARG 5 CO 0.71 -0.80 0.72 -2.13 -0.68 0.00 0.00 175.30 173.12 2i6m n ARG 6 N 4.93 0.00 -0.58 3.54 3.00 -1.26 0.23 116.66 126.51 2i6m n ARG 6 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 2i6m n ARG 6 Cb 0.44 -0.46 0.00 0.00 0.00 0.00 0.00 32.46 32.44 2i6m n ARG 6 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2i6m n LYS 7 N 2.42 0.00 -0.13 -0.14 4.76 -1.26 -4.75 118.16 119.06 2i6m n LYS 7 Ca 0.18 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.39 2i6m n LYS 7 Cb -0.00 -4.09 -0.11 0.00 -1.84 0.00 0.00 35.03 28.99 2i6m n LYS 7 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2i6m n THR 8 N -2.00 1.53 -3.70 -0.18 -2.24 0.13 0.45 114.28 108.27 2i6m n THR 8 Ca 0.00 -0.47 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 2i6m n THR 8 Cb 0.00 -1.67 -0.10 0.00 -2.10 0.00 0.00 70.33 66.46 2i6m n THR 8 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2i6m s ILE 9 N -2.51 -0.01 0.13 2.28 2.07 -0.78 -1.46 121.20 120.92 2i6m s ILE 9 Ca -0.36 0.04 -0.01 0.00 -1.41 0.00 0.00 60.65 58.91 2i6m s ILE 9 Cb 0.11 -0.66 0.01 0.00 0.13 0.00 0.00 42.46 42.04 2i6m s ILE 9 CO 0.56 0.02 0.19 0.61 -1.91 0.00 0.00 174.94 174.41 2i6m n GLY 10 N 3.63 2.60 3.34 1.50 0.00 -0.53 -0.22 105.19 115.52 2i6m n GLY 10 Ca -0.19 -1.41 -0.17 0.00 0.00 0.00 0.00 46.02 44.25 2i6m n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i6m s GLY 11 N -1.79 2.01 -0.08 -0.02 0.00 0.11 -1.73 107.32 105.83 2i6m s GLY 11 Ca 0.10 -1.88 -0.31 0.00 0.00 0.00 0.00 44.72 42.63 2i6m s GLY 11 CO 0.07 -1.32 1.36 -1.35 0.00 0.00 0.00 173.10 171.86 2i6m s SER 12 N -3.32 -0.00 0.00 1.64 1.04 -0.95 -0.86 113.70 111.26 2i6m s SER 12 Ca 0.37 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.75 2i6m s SER 12 Cb 0.02 0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2i6m s SER 12 CO 0.24 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.99 2i6m n GLY 13 N -0.88 1.92 3.69 7.32 0.00 -1.25 -3.02 105.19 112.95 2i6m n GLY 13 Ca 0.03 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 2i6m n GLY 13 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i6m s LEU 14 N 0.00 4.31 0.40 0.99 2.96 -0.00 -4.67 118.68 122.66 2i6m s LEU 14 Ca 0.00 2.06 -0.26 0.00 -0.22 0.00 0.00 54.13 55.72 2i6m s LEU 14 Cb 0.00 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.04 2i6m s LEU 14 CO 0.00 -0.69 1.20 -2.16 -1.32 0.00 0.00 176.35 173.37 2i6m s PRO 15 N 2.32 4.06 -0.11 0.98 0.04 -1.26 -4.96 135.00 136.07 2i6m s PRO 15 Ca 0.62 1.91 0.04 0.00 0.04 0.00 0.00 61.00 63.61 2i6m s PRO 15 Cb -0.30 -2.71 -0.24 0.00 0.04 0.00 0.00 34.50 31.28 2i6m s PRO 15 CO 0.26 -0.33 0.39 0.66 0.04 0.00 0.00 177.00 178.01 2i6m n TYR 16 N 0.13 0.91 -4.47 0.56 4.01 -1.26 -4.92 117.16 112.12 2i6m n TYR 16 Ca 0.04 0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.80 2i6m n TYR 16 Cb 0.46 -1.14 -0.10 0.00 -0.31 0.00 0.00 39.34 38.25 2i6m n TYR 16 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2i6m s THR 17 N -2.56 0.88 -0.00 -0.72 -4.23 -1.26 -4.94 115.64 102.80 2i6m s THR 17 Ca -0.16 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.51 2i6m s THR 17 Cb 0.07 -2.59 0.08 0.00 1.34 0.00 0.00 72.50 71.41 2i6m s THR 17 CO 0.78 0.00 1.56 -0.08 -0.54 0.00 0.00 174.62 176.34 2i6m h GLU 18 N 2.00 0.00 -0.41 3.99 4.81 -2.00 -3.00 114.58 119.98 2i6m h GLU 18 Ca -0.38 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.78 2i6m h GLU 18 Cb 1.26 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.62 2i6m h GLU 18 CO 0.64 0.47 -0.01 -0.91 -0.73 0.00 0.00 179.01 178.46 2i6m h ASN 19 N 0.00 0.63 0.07 1.04 2.35 -1.99 -1.17 115.58 116.52 2i6m h ASN 19 Ca -0.00 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 2i6m h ASN 19 Cb 1.20 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.39 2i6m h ASN 19 CO 0.06 0.71 -0.20 -0.33 -1.65 0.00 0.00 177.43 176.03 2i6m h GLU 20 N 0.62 0.23 -0.13 0.81 5.08 -1.94 -0.78 114.58 118.47 2i6m h GLU 20 Ca 0.13 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.26 2i6m h GLU 20 Cb 0.41 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2i6m h GLU 20 CO 0.02 0.43 -0.58 0.82 -1.00 0.00 0.00 179.01 178.70 2i6m h ILE 21 N 0.22 1.35 0.00 3.13 2.04 -1.30 -2.42 117.51 120.52 2i6m h ILE 21 Ca 0.04 -1.87 -0.08 0.00 1.00 0.00 0.00 64.86 63.94 2i6m h ILE 21 Cb 0.48 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 2i6m h ILE 21 CO 0.03 0.57 -0.40 -0.07 0.00 0.00 0.00 178.15 178.28 2i6m h LEU 22 N 0.32 0.00 -0.76 1.44 3.38 -0.49 -2.16 115.31 117.04 2i6m h LEU 22 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2i6m h LEU 22 Cb 1.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 2i6m h LEU 22 CO 0.10 0.40 0.09 -0.33 0.09 0.00 0.00 178.44 178.79 2i6m h GLU 23 N 0.00 1.04 -0.24 1.13 5.08 -0.69 -1.47 114.58 119.42 2i6m h GLU 23 Ca -0.00 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2i6m h GLU 23 Cb 0.84 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2i6m h GLU 23 CO 0.05 0.96 0.16 -1.49 -1.00 0.00 0.00 179.01 177.69 2i6m h TRP 24 N 0.97 0.31 -0.81 4.33 6.55 -1.06 -1.91 115.95 124.33 2i6m h TRP 24 Ca 0.19 0.01 0.06 0.00 0.95 0.00 0.00 58.89 60.10 2i6m h TRP 24 Cb 0.43 -0.10 -0.06 0.00 -0.86 0.00 0.00 29.16 28.57 2i6m h TRP 24 CO 0.03 0.20 0.50 -0.09 -1.05 0.00 0.00 178.44 178.03 2i6m h ARG 25 N 0.32 0.89 0.00 0.49 2.43 -1.09 -0.62 114.38 116.81 2i6m h ARG 25 Ca 0.09 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 2i6m h ARG 25 Cb -0.03 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 2i6m h ARG 25 CO -0.02 0.59 -0.27 -0.22 -1.51 0.00 0.00 179.97 178.54 2i6m h LYS 26 N 0.92 0.00 0.00 0.20 3.64 -0.89 -2.20 116.57 118.24 2i6m h LYS 26 Ca 0.35 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 2i6m h LYS 26 Cb 0.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2i6m h LYS 26 CO -0.17 0.27 0.00 0.93 -2.27 0.00 0.00 179.45 178.21 2i6m h GLU 27 N 0.00 0.00 0.00 1.90 4.39 -0.35 -3.47 114.58 117.05 2i6m h GLU 27 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2i6m h GLU 27 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2i6m h GLU 27 CO 0.03 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.29 2i6m n GLY 28 N 0.63 1.11 3.75 -3.84 0.00 -0.83 -4.91 105.19 101.10 2i6m n GLY 28 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2i6m n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i6m s VAL 29 N -2.00 3.16 0.00 1.61 1.01 -0.73 -4.08 120.40 119.37 2i6m s VAL 29 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2i6m s VAL 29 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2i6m s VAL 29 CO 0.00 0.19 0.00 0.29 0.00 0.00 0.00 175.10 175.58 2i6m n LYS 30 N 1.91 2.46 -4.10 2.72 5.02 0.31 -4.43 118.16 122.05 2i6m n LYS 30 Ca 0.03 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.18 2i6m n LYS 30 Cb 0.43 -0.73 -0.14 0.00 -0.02 0.00 0.00 35.03 34.57 2i6m n LYS 30 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2i6m s ARG 31 N -1.23 0.39 -0.10 1.97 0.52 -0.86 -2.54 118.95 117.10 2i6m s ARG 31 Ca 0.00 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 54.91 2i6m s ARG 31 Cb 0.00 -0.31 0.02 0.00 0.52 0.00 0.00 34.95 35.17 2i6m s ARG 31 CO 0.00 0.08 -0.13 0.08 0.02 0.00 0.00 175.30 175.35 2i6m s VAL 32 N -0.45 1.30 -0.40 3.52 1.01 -0.28 -1.11 120.40 124.00 2i6m s VAL 32 Ca -0.02 -0.52 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 2i6m s VAL 32 Cb -0.04 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 35.14 2i6m s VAL 32 CO -0.00 0.40 0.44 -0.22 0.00 0.00 0.00 175.10 175.72 2i6m s LEU 33 N 1.11 4.71 -0.33 3.92 2.96 0.75 -1.50 118.68 130.30 2i6m s LEU 33 Ca -0.05 -0.50 -0.17 0.00 -0.22 0.00 0.00 54.13 53.18 2i6m s LEU 33 Cb -0.14 -2.41 -0.01 0.00 0.50 0.00 0.00 46.19 44.13 2i6m s LEU 33 CO -0.02 -0.53 0.49 -0.69 -1.32 0.00 0.00 176.35 174.28 2i6m s VAL 34 N 2.16 5.05 -0.06 1.68 1.01 0.21 -1.75 120.40 128.70 2i6m s VAL 34 Ca 0.13 0.40 0.19 0.00 0.00 0.00 0.00 61.98 62.70 2i6m s VAL 34 Cb -0.17 -3.91 -0.28 0.00 0.00 0.00 0.00 36.38 32.02 2i6m s VAL 34 CO 0.13 -0.13 0.35 0.18 0.00 0.00 0.00 175.10 175.63 2i6m n LEU 35 N 5.65 0.00 -4.71 3.92 4.77 -0.41 -0.89 117.00 125.32 2i6m n LEU 35 Ca -0.05 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.62 2i6m n LEU 35 Cb 0.49 0.09 0.13 0.00 -2.33 0.00 0.00 43.42 41.81 2i6m n LEU 35 CO 0.43 0.09 0.67 -2.16 -1.33 0.00 0.00 177.39 175.10 2i6m s PRO 36 N -3.15 1.44 0.73 3.23 0.04 -1.26 -0.70 135.00 135.34 2i6m s PRO 36 Ca -0.07 1.07 -0.11 0.00 0.04 0.00 0.00 61.00 61.92 2i6m s PRO 36 Cb 0.11 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.87 2i6m s PRO 36 CO 0.79 -2.18 1.09 -1.21 0.04 0.00 0.00 177.00 175.53 2i6m s GLU 37 N -4.84 2.62 0.17 4.56 2.02 -1.26 -4.50 118.70 117.46 2i6m s GLU 37 Ca 0.63 0.56 -0.21 0.00 0.02 0.00 0.00 54.97 55.97 2i6m s GLU 37 Cb -0.19 -1.99 0.08 0.00 0.10 0.00 0.00 34.13 32.14 2i6m s GLU 37 CO 0.57 -1.23 1.61 -0.44 0.02 0.00 0.00 175.26 175.79 2i6m h ASP 38 N -0.80 -0.93 -0.72 -0.19 3.32 -1.99 -1.46 116.42 113.66 2i6m h ASP 38 Ca -0.46 0.18 0.07 0.00 0.02 0.00 0.00 57.03 56.85 2i6m h ASP 38 Cb 1.25 0.46 -0.05 0.00 0.22 0.00 0.00 39.33 41.22 2i6m h ASP 38 CO 0.62 -0.29 0.47 4.11 -1.72 0.00 0.00 179.24 182.43 2i6m h TRP 39 N -0.20 0.73 -0.22 4.55 5.08 -1.98 0.13 115.95 124.04 2i6m h TRP 39 Ca 0.19 0.02 -0.04 0.00 1.08 0.00 0.00 58.89 60.14 2i6m h TRP 39 Cb 0.51 -0.24 -0.01 0.00 -3.00 0.00 0.00 29.16 26.42 2i6m h TRP 39 CO -0.51 0.38 -0.02 0.93 -1.28 0.00 0.00 178.44 177.94 2i6m h GLU 40 N 0.72 0.40 -0.29 0.12 5.08 -1.66 -2.64 114.58 116.30 2i6m h GLU 40 Ca 0.31 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2i6m h GLU 40 Cb 0.31 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2i6m h GLU 40 CO -0.11 0.61 0.19 0.82 -1.00 0.00 0.00 179.01 179.52 2i6m h ILE 41 N 0.14 1.06 -0.21 3.13 2.04 -0.60 -2.46 117.51 120.62 2i6m h ILE 41 Ca 0.06 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.85 2i6m h ILE 41 Cb 0.44 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2i6m h ILE 41 CO 0.02 0.07 0.23 -0.33 0.00 0.00 0.00 178.15 178.13 2i6m h GLU 42 N 0.39 0.00 -0.32 2.37 5.08 -0.67 -0.65 114.58 120.77 2i6m h GLU 42 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2i6m h GLU 42 Cb -0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2i6m h GLU 42 CO -0.03 0.00 0.20 0.93 -1.00 0.00 0.00 179.01 179.11 2i6m h GLU 43 N 0.00 0.43 0.00 2.33 5.08 -1.06 0.17 114.58 121.52 2i6m h GLU 43 Ca 0.10 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.38 2i6m h GLU 43 Cb 0.55 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2i6m h GLU 43 CO -0.00 0.29 -1.68 0.43 -1.00 0.00 0.00 179.01 177.06 2i6m n SER 44 N -4.48 1.88 0.00 1.42 7.64 -0.67 -4.73 113.62 114.69 2i6m n SER 44 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2i6m n SER 44 Cb 0.08 1.44 0.00 0.00 -1.01 0.00 0.00 64.21 64.72 2i6m n SER 44 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2i6m n TRP 45 N -2.08 0.00 0.00 1.43 7.02 -0.34 -4.97 117.44 118.49 2i6m n TRP 45 Ca -0.07 -0.16 0.00 0.00 -1.02 0.00 0.00 57.50 56.26 2i6m n TRP 45 Cb 0.48 -0.02 0.00 0.00 -2.42 0.00 0.00 31.31 29.35 2i6m n TRP 45 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2i6m n GLY 46 N -0.16 0.82 2.90 6.99 0.00 0.58 -4.67 105.19 111.65 2i6m n GLY 46 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2i6m n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i6m s ASP 47 N 0.00 -0.05 0.16 1.61 -1.08 -1.26 -4.76 116.67 111.28 2i6m s ASP 47 Ca 0.00 0.18 -0.15 0.00 -0.52 0.00 0.00 52.55 52.05 2i6m s ASP 47 Cb 0.00 0.11 0.03 0.00 -1.46 0.00 0.00 42.92 41.60 2i6m s ASP 47 CO 0.00 -0.09 1.80 0.50 0.52 0.00 0.00 175.17 177.89 2i6m h LYS 48 N 6.75 0.60 -0.09 4.34 3.11 -1.87 -1.77 116.57 127.65 2i6m h LYS 48 Ca -0.36 -0.05 -0.07 0.00 -2.81 0.00 0.00 60.65 57.36 2i6m h LYS 48 Cb 1.16 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 32.25 2i6m h LYS 48 CO 0.45 0.43 -0.25 -0.44 -2.81 0.00 0.00 179.45 176.83 2i6m h ASP 49 N 0.60 0.15 -0.46 4.20 3.45 -1.97 -1.82 116.42 120.57 2i6m h ASP 49 Ca 0.16 -0.04 -0.13 0.00 0.43 0.00 0.00 57.03 57.45 2i6m h ASP 49 Cb -0.02 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 2i6m h ASP 49 CO -0.03 0.41 -0.23 0.22 -1.57 0.00 0.00 179.24 178.03 2i6m h TYR 50 N 0.14 1.12 -0.34 4.55 -0.00 -1.80 -1.88 116.97 118.75 2i6m h TYR 50 Ca 0.02 -0.28 -0.00 0.00 -0.00 0.00 0.00 58.73 58.47 2i6m h TYR 50 Cb 0.52 -0.26 -0.02 0.00 -0.00 0.00 0.00 36.73 36.98 2i6m h TYR 50 CO 0.01 1.10 0.20 -0.92 -0.00 0.00 0.00 178.16 178.55 2i6m h TYR 51 N 0.82 0.46 -0.41 -3.82 3.20 -0.82 -1.97 116.97 114.43 2i6m h TYR 51 Ca 0.10 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 2i6m h TYR 51 Cb 0.81 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 2i6m h TYR 51 CO 0.06 0.34 0.14 -0.07 -1.64 0.00 0.00 178.16 176.99 2i6m h LEU 52 N 0.44 0.53 -0.83 2.82 3.38 -1.21 -1.82 115.31 118.62 2i6m h LEU 52 Ca 0.12 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2i6m h LEU 52 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2i6m h LEU 52 CO -0.02 0.50 -0.52 0.77 0.09 0.00 0.00 178.44 179.26 2i6m h SER 53 N 0.58 0.19 -0.48 -0.43 4.64 -1.05 -1.41 113.55 115.58 2i6m h SER 53 Ca 0.14 -0.09 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 2i6m h SER 53 Cb 0.15 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 2i6m h SER 53 CO -0.01 0.68 -0.03 0.40 -0.87 0.00 0.00 176.83 177.00 2i6m h ILE 54 N 0.14 1.27 -0.10 0.95 1.08 -0.58 0.49 117.51 120.74 2i6m h ILE 54 Ca 0.00 -1.11 -0.01 0.00 -0.39 0.00 0.00 64.86 63.36 2i6m h ILE 54 Cb 0.97 1.02 -0.00 0.00 -3.07 0.00 0.00 36.82 35.73 2i6m h ILE 54 CO 0.08 0.39 0.04 -0.07 -0.69 0.00 0.00 178.15 177.89 2i6m h LEU 55 N 0.72 0.14 -1.42 1.44 3.38 -1.19 -1.79 115.31 116.59 2i6m h LEU 55 Ca 0.13 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2i6m h LEU 55 Cb 0.55 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2i6m h LEU 55 CO 0.03 0.28 0.20 0.11 0.09 0.00 0.00 178.44 179.14 2i6m h LYS 56 N -0.00 0.59 0.00 1.13 1.57 -0.99 -1.54 116.57 117.33 2i6m h LYS 56 Ca 0.03 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2i6m h LYS 56 Cb 0.18 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2i6m h LYS 56 CO -0.00 0.47 -0.23 -0.22 -0.57 0.00 0.00 179.45 178.90 2i6m h LYS 57 N 0.59 0.00 -0.63 3.15 3.64 0.27 -2.77 116.57 120.82 2i6m h LYS 57 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2i6m h LYS 57 Cb 0.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2i6m h LYS 57 CO -0.02 0.23 0.00 0.09 -2.27 0.00 0.00 179.45 177.48 2i6m n ASN 58 N -3.42 3.97 0.00 4.20 5.03 -0.66 -4.92 115.26 119.47 2i6m n ASN 58 Ca -0.00 -2.41 0.00 0.00 0.87 0.00 0.00 54.58 53.04 2i6m n ASN 58 Cb 0.42 -0.53 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 2i6m n ASN 58 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2i6m n GLY 59 N 0.89 0.41 3.51 7.41 0.00 -1.04 -5.03 105.19 111.34 2i6m n GLY 59 Ca 0.20 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 2i6m n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i6m s LEU 60 N 0.00 2.94 -0.33 0.99 1.43 -0.75 -4.89 118.68 118.07 2i6m s LEU 60 Ca 0.00 -0.13 -0.18 0.00 -1.03 0.00 0.00 54.13 52.79 2i6m s LEU 60 Cb 0.00 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 2i6m s LEU 60 CO 0.00 0.33 0.49 -1.10 0.23 0.00 0.00 176.35 176.30 2i6m s GLN 61 N -0.61 3.71 0.19 1.70 1.11 -1.05 -3.12 119.66 121.59 2i6m s GLN 61 Ca 0.09 -0.10 0.02 0.00 0.01 0.00 0.00 55.36 55.38 2i6m s GLN 61 Cb -0.11 -3.78 -0.04 0.00 -1.01 0.00 0.00 33.01 28.07 2i6m s GLN 61 CO 0.01 -0.57 0.34 -1.25 0.01 0.00 0.00 175.29 173.83 2i6m s PRO 62 N 2.33 3.46 -0.06 2.91 0.04 -1.26 -1.13 135.00 141.29 2i6m s PRO 62 Ca 0.18 -0.56 -0.02 0.00 0.04 0.00 0.00 61.00 60.64 2i6m s PRO 62 Cb -0.16 -2.91 0.03 0.00 0.04 0.00 0.00 34.50 31.51 2i6m s PRO 62 CO 0.12 0.46 0.05 -1.17 0.04 0.00 0.00 177.00 176.50 2i6m s LEU 63 N -3.45 0.22 -0.31 -3.56 2.96 -0.56 -4.95 118.68 109.03 2i6m s LEU 63 Ca 0.36 -0.00 -0.14 0.00 -0.22 0.00 0.00 54.13 54.12 2i6m s LEU 63 Cb -0.11 -0.19 -0.03 0.00 0.50 0.00 0.00 46.19 46.37 2i6m s LEU 63 CO 0.29 -0.25 0.33 -2.28 -1.32 0.00 0.00 176.35 173.12 2i6m s HIS 64 N 2.14 3.22 -0.43 5.38 5.65 -1.26 -0.62 115.29 129.37 2i6m s HIS 64 Ca 0.05 0.14 0.02 0.00 0.25 0.00 0.00 55.06 55.52 2i6m s HIS 64 Cb -0.12 -2.58 0.14 0.00 -1.18 0.00 0.00 32.58 28.84 2i6m s HIS 64 CO -0.04 -0.31 0.25 0.42 -0.65 0.00 0.00 174.74 174.41 2i6m s ILE 65 N 1.98 1.07 0.05 0.89 -1.09 -0.07 -4.98 121.20 119.05 2i6m s ILE 65 Ca 0.12 -2.45 -0.30 0.00 -2.23 0.00 0.00 60.65 55.79 2i6m s ILE 65 Cb -0.16 -1.75 -0.09 0.00 -1.58 0.00 0.00 42.46 38.87 2i6m s ILE 65 CO 0.11 -0.96 1.95 -2.65 -1.23 0.00 0.00 174.94 172.16 2i6m n PRO 66 N 3.52 2.85 -4.63 2.79 -0.02 -1.26 -4.28 135.00 133.96 2i6m n PRO 66 Ca 0.12 1.04 -0.27 0.00 -2.02 0.00 0.00 63.50 62.38 2i6m n PRO 66 Cb 0.36 -2.99 -0.17 0.00 -0.02 0.00 0.00 33.50 30.69 2i6m n PRO 66 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2i6m s ILE 67 N 4.14 1.35 0.38 4.25 1.01 0.13 -4.97 121.20 127.49 2i6m s ILE 67 Ca 0.88 -0.59 -0.27 0.00 0.00 0.00 0.00 60.65 60.67 2i6m s ILE 67 Cb -0.45 -1.23 -0.09 0.00 0.01 0.00 0.00 42.46 40.70 2i6m s ILE 67 CO 0.41 0.41 1.34 -2.84 0.00 0.00 0.00 174.94 174.26 2i6m s PRO 68 N 0.73 4.08 0.20 2.79 0.02 -1.26 -4.36 135.00 137.19 2i6m s PRO 68 Ca -0.13 2.25 -0.32 0.00 0.02 0.00 0.00 61.00 62.82 2i6m s PRO 68 Cb -0.16 -2.87 -0.15 0.00 0.02 0.00 0.00 34.50 31.34 2i6m s PRO 68 CO 0.03 -0.43 1.24 -3.47 -0.33 0.00 0.00 177.00 174.04 2i6m n ASP 69 N 0.35 1.81 0.00 2.53 2.03 -1.26 -0.05 116.55 121.96 2i6m n ASP 69 Ca 0.02 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.48 2i6m n ASP 69 Cb 0.42 -1.29 0.00 0.00 -0.72 0.00 0.00 41.12 39.53 2i6m n ASP 69 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2i6m n GLY 70 N 2.02 2.53 0.00 0.27 0.00 -1.26 -4.99 105.19 103.76 2i6m n GLY 70 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2i6m n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i6m n GLY 71 N -2.00 1.19 3.20 -0.02 0.00 0.93 -4.52 105.19 103.97 2i6m n GLY 71 Ca 0.00 -2.02 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 2i6m n GLY 71 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i6m s VAL 72 N 0.52 0.76 0.62 1.61 -7.23 -1.26 -4.79 120.40 110.63 2i6m s VAL 72 Ca 0.00 -1.97 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 2i6m s VAL 72 Cb 0.00 -1.82 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 2i6m s VAL 72 CO 0.00 -0.75 1.11 -2.16 -0.31 0.00 0.00 175.10 172.99 2i6m s PRO 73 N -3.84 2.97 0.98 4.82 0.04 -1.26 -4.84 135.00 133.87 2i6m s PRO 73 Ca 0.16 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.52 2i6m s PRO 73 Cb 0.05 -1.97 0.18 0.00 0.04 0.00 0.00 34.50 32.80 2i6m s PRO 73 CO -0.02 -1.12 1.10 -1.54 0.04 0.00 0.00 177.00 175.46 2i6m s SER 74 N -2.36 2.77 0.27 6.66 1.04 -1.26 -4.74 113.70 116.08 2i6m s SER 74 Ca 0.68 1.14 -0.03 0.00 0.48 0.00 0.00 55.95 58.23 2i6m s SER 74 Cb -0.21 -1.79 0.36 0.00 0.10 0.00 0.00 66.02 64.48 2i6m s SER 74 CO 0.37 -3.03 1.88 0.44 0.98 0.00 0.00 173.24 173.87 2i6m h ASP 75 N -1.83 0.92 -0.55 7.02 3.32 -1.99 -0.58 116.42 122.73 2i6m h ASP 75 Ca -0.54 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 56.33 2i6m h ASP 75 Cb 1.33 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 2i6m h ASP 75 CO 0.58 0.78 0.02 0.77 -1.72 0.00 0.00 179.24 179.67 2i6m h SER 76 N 1.02 0.94 -0.55 6.45 4.64 -2.00 -2.18 113.55 121.87 2i6m h SER 76 Ca 0.25 -0.30 -0.07 0.00 -0.47 0.00 0.00 61.79 61.20 2i6m h SER 76 Cb 0.10 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.91 2i6m h SER 76 CO -0.03 1.01 0.10 1.56 -0.87 0.00 0.00 176.83 178.60 2i6m h GLN 77 N 0.84 0.95 -0.37 4.77 4.20 -1.78 -2.56 115.11 121.16 2i6m h GLN 77 Ca 0.16 -0.23 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 2i6m h GLN 77 Cb 0.52 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 2i6m h GLN 77 CO 0.03 0.88 -0.02 0.35 -0.67 0.00 0.00 178.83 179.40 2i6m h PHE 78 N 0.90 0.61 -0.50 2.96 3.57 -0.89 0.26 116.94 123.85 2i6m h PHE 78 Ca 0.19 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 2i6m h PHE 78 Cb 0.38 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 2i6m h PHE 78 CO 0.02 0.60 0.09 1.25 -2.23 0.00 0.00 178.31 178.05 2i6m h LEU 79 N 0.55 0.78 -0.11 0.59 5.85 -1.04 -0.31 115.31 121.63 2i6m h LEU 79 Ca 0.11 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 2i6m h LEU 79 Cb 0.38 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 2i6m h LEU 79 CO 0.01 0.83 -0.01 0.74 -0.34 0.00 0.00 178.44 179.68 2i6m h THR 80 N 0.70 1.26 -0.31 1.05 2.02 -1.03 -0.64 112.91 115.96 2i6m h THR 80 Ca 0.15 -0.85 0.05 0.00 0.77 0.00 0.00 66.41 66.54 2i6m h THR 80 Cb 0.38 1.61 -0.05 0.00 -1.74 0.00 0.00 68.15 68.34 2i6m h THR 80 CO 0.01 0.24 -0.01 0.40 0.37 0.00 0.00 175.52 176.53 2i6m h ILE 81 N -0.08 0.77 -0.15 3.11 2.04 -0.38 -0.84 117.51 121.97 2i6m h ILE 81 Ca 0.03 -0.03 -0.15 0.00 1.00 0.00 0.00 64.86 65.71 2i6m h ILE 81 Cb 0.38 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2i6m h ILE 81 CO 0.01 0.02 -0.53 0.24 0.00 0.00 0.00 178.15 177.88 2i6m h MET 82 N 0.08 0.44 -0.63 2.37 2.86 -1.01 0.13 114.93 119.16 2i6m h MET 82 Ca 0.15 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.48 2i6m h MET 82 Cb 0.20 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 2i6m h MET 82 CO -0.26 0.86 0.22 -0.22 1.06 0.00 0.00 176.91 178.58 2i6m h LYS 83 N 0.34 0.97 0.30 1.72 3.64 -0.81 -0.91 116.57 121.82 2i6m h LYS 83 Ca 0.01 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 2i6m h LYS 83 Cb 1.05 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2i6m h LYS 83 CO 0.09 0.84 -0.14 2.35 -2.27 0.00 0.00 179.45 180.32 2i6m h TRP 84 N 0.90 -0.37 -0.50 1.91 2.91 -0.94 -2.09 115.95 117.77 2i6m h TRP 84 Ca 0.21 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.23 2i6m h TRP 84 Cb 0.26 0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.00 2i6m h TRP 84 CO 0.02 -0.11 0.33 -0.07 -1.03 0.00 0.00 178.44 177.58 2i6m h LEU 85 N -0.58 0.57 0.00 0.65 3.38 -0.89 -2.62 115.31 115.82 2i6m h LEU 85 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2i6m h LEU 85 Cb 0.43 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2i6m h LEU 85 CO 0.07 0.41 -0.27 0.18 0.09 0.00 0.00 178.44 178.93 2i6m n LEU 86 N -4.46 0.68 0.11 1.67 4.32 -0.35 -3.95 117.00 115.01 2i6m n LEU 86 Ca 0.05 0.40 0.00 0.00 -0.02 0.00 0.00 56.01 56.44 2i6m n LEU 86 Cb 0.06 -0.28 0.30 0.00 -1.62 0.00 0.00 43.42 41.88 2i6m n LEU 86 CO 0.35 -0.10 0.75 0.77 -1.22 0.00 0.00 177.39 177.95 2i6m h SER 87 N 0.00 0.23 -3.49 -1.43 4.64 -0.97 -3.42 113.55 109.11 2i6m h SER 87 Ca 0.00 -0.07 -0.31 0.00 -0.47 0.00 0.00 61.79 60.93 2i6m h SER 87 Cb 0.70 -0.06 -0.35 0.00 -0.31 0.00 0.00 62.40 62.39 2i6m h SER 87 CO 0.00 0.52 -0.73 -1.61 -0.87 0.00 0.00 176.83 174.14 2i6m s GLU 88 N -4.39 -0.01 0.06 4.77 0.41 -1.25 -5.07 118.70 113.22 2i6m s GLU 88 Ca -0.05 0.20 0.14 0.00 -0.41 0.00 0.00 54.97 54.85 2i6m s GLU 88 Cb 0.14 -0.31 -0.15 0.00 -1.78 0.00 0.00 34.13 32.03 2i6m s GLU 88 CO 0.75 -0.19 0.90 -0.22 -0.49 0.00 0.00 175.26 176.02 2i6m h LYS 89 N 7.44 0.00 -6.52 1.61 3.64 -1.82 -3.46 116.57 117.46 2i6m h LYS 89 Ca -0.41 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.44 2i6m h LYS 89 Cb 1.12 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 2i6m h LYS 89 CO 0.44 0.47 0.19 -1.21 -2.27 0.00 0.00 179.45 177.07 2i6m s GLU 90 N -2.79 4.58 -1.41 1.90 2.02 -1.26 -4.44 118.70 117.30 2i6m s GLU 90 Ca -0.02 1.17 -0.10 0.00 0.02 0.00 0.00 54.97 56.04 2i6m s GLU 90 Cb 0.08 -3.27 0.03 0.00 0.10 0.00 0.00 34.13 31.08 2i6m s GLU 90 CO 0.81 0.56 1.11 0.41 0.02 0.00 0.00 175.26 178.16 2i6m n GLY 91 N 1.63 -0.52 3.71 -1.39 0.00 0.17 -4.67 105.19 104.11 2i6m n GLY 91 Ca -0.05 0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2i6m n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i6m s ASN 92 N -3.38 7.00 -0.07 1.61 0.01 -0.54 -0.53 114.94 119.05 2i6m s ASN 92 Ca 0.58 1.21 0.05 0.00 -0.71 0.00 0.00 52.86 53.99 2i6m s ASN 92 Cb -0.27 -2.43 -0.01 0.00 0.41 0.00 0.00 41.25 38.96 2i6m s ASN 92 CO 0.76 -0.18 -0.23 -0.22 -1.51 0.00 0.00 177.10 175.73 2i6m s LEU 93 N 1.06 2.04 -0.09 0.60 2.96 -0.26 -1.45 118.68 123.54 2i6m s LEU 93 Ca 0.38 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.84 2i6m s LEU 93 Cb -0.18 -1.30 -0.01 0.00 0.50 0.00 0.00 46.19 45.20 2i6m s LEU 93 CO 0.18 0.20 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.50 2i6m s VAL 94 N 0.04 2.33 0.02 1.68 1.01 -0.71 -0.18 120.40 124.60 2i6m s VAL 94 Ca -0.08 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 2i6m s VAL 94 Cb -0.15 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 2i6m s VAL 94 CO 0.05 0.56 0.06 -1.38 0.00 0.00 0.00 175.10 174.39 2i6m s HIS 95 N 0.08 0.20 0.00 5.22 -0.00 -0.72 -2.24 115.29 117.83 2i6m s HIS 95 Ca -0.10 -0.46 0.00 0.00 -0.00 0.00 0.00 55.06 54.51 2i6m s HIS 95 Cb -0.15 -0.15 0.00 0.00 -0.00 0.00 0.00 32.58 32.28 2i6m s HIS 95 CO 0.06 -0.30 0.00 0.00 -0.00 0.00 0.00 174.74 174.50 2i6m h VAL 97 N 0.00 0.42 0.00 0.00 2.07 -1.90 -1.89 116.25 114.95 2i6m h VAL 97 Ca 0.00 -1.44 0.00 0.00 0.82 0.00 0.00 66.70 66.08 2i6m h VAL 97 Cb 0.00 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2i6m h VAL 97 CO 0.00 0.14 -1.57 0.61 0.02 0.00 0.00 177.57 176.77 2i6m n GLY 98 N 1.61 -1.07 2.04 2.17 0.00 -1.26 -0.82 105.19 107.86 2i6m n GLY 98 Ca -0.12 -0.50 -0.01 0.00 0.00 0.00 0.00 46.02 45.39 2i6m n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i6m n GLY 99 N 1.32 0.48 0.42 -0.02 0.00 -1.24 -3.97 105.19 102.18 2i6m n GLY 99 Ca -0.01 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.13 2i6m n GLY 99 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2i6m n ILE 100 N -2.96 0.46 0.00 -0.61 5.41 -1.26 -4.21 119.36 116.19 2i6m n ILE 100 Ca -0.01 0.28 0.00 0.00 1.00 0.00 0.00 62.75 64.02 2i6m n ILE 100 Cb 0.04 -1.55 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 2i6m n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2i6m n GLY 101 N 2.28 -1.50 0.07 7.39 0.00 -1.26 -1.92 105.19 110.25 2i6m n GLY 101 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 2i6m n GLY 101 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2i6m h ARG 102 N 0.00 0.13 -0.25 1.61 3.08 -1.92 -1.10 114.38 115.94 2i6m h ARG 102 Ca 0.00 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2i6m h ARG 102 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2i6m h ARG 102 CO 0.00 0.11 0.13 1.15 -1.07 0.00 0.00 179.97 180.29 2i6m h THR 103 N 0.11 1.13 -0.73 2.04 2.02 -1.82 -2.18 112.91 113.48 2i6m h THR 103 Ca 0.04 -0.37 0.06 0.00 0.77 0.00 0.00 66.41 66.90 2i6m h THR 103 Cb 0.02 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 2i6m h THR 103 CO -0.01 0.13 0.48 1.23 0.37 0.00 0.00 175.52 177.72 2i6m h GLY 104 N 0.28 0.97 0.84 2.16 0.00 -1.22 -0.61 103.07 105.49 2i6m h GLY 104 Ca 0.09 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 2i6m h GLY 104 CO -0.01 0.24 -0.03 -0.84 0.00 0.00 0.00 176.54 175.90 2i6m h THR 105 N 0.79 1.27 -0.69 4.70 2.02 -0.81 -1.13 112.91 119.06 2i6m h THR 105 Ca 0.31 -0.98 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 2i6m h THR 105 Cb 0.21 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 2i6m h THR 105 CO -0.10 0.31 0.17 0.40 0.37 0.00 0.00 175.52 176.67 2i6m h ILE 106 N 0.19 1.26 -0.33 3.11 1.08 -0.84 -1.45 117.51 120.53 2i6m h ILE 106 Ca 0.06 -0.96 -0.02 0.00 -0.39 0.00 0.00 64.86 63.56 2i6m h ILE 106 Cb 0.47 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 2i6m h ILE 106 CO 0.02 0.37 0.14 -0.07 -0.69 0.00 0.00 178.15 177.92 2i6m h LEU 107 N 1.03 0.45 -0.90 1.44 3.38 -1.03 -1.53 115.31 118.15 2i6m h LEU 107 Ca 0.22 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2i6m h LEU 107 Cb 0.37 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2i6m h LEU 107 CO 0.00 0.47 0.49 0.00 0.09 0.00 0.00 178.44 179.50 2i6m h ALA 108 N 0.99 1.15 -0.77 1.53 0.00 -1.04 -2.19 119.26 118.94 2i6m h ALA 108 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2i6m h ALA 108 Cb 0.16 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2i6m h ALA 108 CO -0.01 0.66 0.44 0.77 0.00 0.00 0.00 179.25 181.11 2i6m h SER 109 N 1.26 0.93 -0.11 0.00 0.02 -0.95 -1.33 113.55 113.37 2i6m h SER 109 Ca 0.32 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2i6m h SER 109 Cb 0.02 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 2i6m h SER 109 CO -0.05 0.73 0.06 0.22 -1.14 0.00 0.00 176.83 176.65 2i6m h TYR 110 N 1.06 0.15 -0.62 3.45 3.20 -0.68 -1.70 116.97 121.83 2i6m h TYR 110 Ca 0.27 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2i6m h TYR 110 Cb -0.01 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2i6m h TYR 110 CO 0.01 0.16 0.40 -0.07 -1.64 0.00 0.00 178.16 177.02 2i6m h LEU 111 N 0.10 0.72 -0.18 2.82 3.38 -1.08 0.34 115.31 121.41 2i6m h LEU 111 Ca 0.04 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2i6m h LEU 111 Cb 0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2i6m h LEU 111 CO -0.01 0.54 -0.05 0.40 0.09 0.00 0.00 178.44 179.41 2i6m h ILE 112 N 0.84 0.81 -0.12 1.22 2.04 -1.01 0.11 117.51 121.40 2i6m h ILE 112 Ca 0.23 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.04 2i6m h ILE 112 Cb -0.08 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2i6m h ILE 112 CO -0.05 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 177.92 2i6m h LEU 113 N -0.01 0.31 -0.17 1.44 3.38 -1.04 -0.75 115.31 118.47 2i6m h LEU 113 Ca 0.09 -0.48 -0.13 0.00 0.09 0.00 0.00 57.88 57.45 2i6m h LEU 113 Cb 0.14 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2i6m h LEU 113 CO -0.18 0.72 -0.60 0.71 0.09 0.00 0.00 178.44 179.18 2i6m h THR 114 N -0.10 1.08 -0.00 0.22 1.35 -0.91 -3.35 112.91 111.20 2i6m h THR 114 Ca 0.02 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 63.49 2i6m h THR 114 Cb 0.63 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 2i6m h THR 114 CO 0.03 0.59 -0.03 -0.62 -0.25 0.00 0.00 175.52 175.24 2i6m n GLU 115 N -3.32 1.24 -1.83 4.72 1.02 0.37 -5.00 120.64 117.84 2i6m n GLU 115 Ca 0.01 -0.50 -0.14 0.00 -0.02 0.00 0.00 57.16 56.52 2i6m n GLU 115 Cb 0.74 -0.94 -0.03 0.00 -0.02 0.00 0.00 31.44 31.19 2i6m n GLU 115 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2i6m n GLY 116 N 0.41 0.64 3.77 0.62 0.00 -0.29 -4.97 105.19 105.36 2i6m n GLY 116 Ca 0.01 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 2i6m n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i6m s LEU 117 N -3.61 3.86 0.48 0.99 1.43 -1.21 -5.00 118.68 115.63 2i6m s LEU 117 Ca 0.00 2.35 -0.20 0.00 -1.03 0.00 0.00 54.13 55.25 2i6m s LEU 117 Cb 0.00 -4.40 -0.09 0.00 0.03 0.00 0.00 46.19 41.74 2i6m s LEU 117 CO 0.00 -1.21 1.03 -1.61 0.23 0.00 0.00 176.35 174.79 2i6m s GLU 118 N -2.99 3.82 0.31 1.70 2.02 -1.26 -4.61 118.70 117.68 2i6m s GLU 118 Ca 0.70 1.34 0.06 0.00 0.02 0.00 0.00 54.97 57.08 2i6m s GLU 118 Cb -0.29 -2.10 0.83 0.00 0.10 0.00 0.00 34.13 32.67 2i6m s GLU 118 CO 0.34 -0.41 1.63 -0.24 0.02 0.00 0.00 175.26 176.60 2i6m h VAL 119 N 1.56 0.24 -0.20 2.63 3.04 -1.94 -1.35 116.25 120.23 2i6m h VAL 119 Ca -0.49 -0.06 -0.12 0.00 -1.01 0.00 0.00 66.70 65.01 2i6m h VAL 119 Cb 1.22 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.53 2i6m h VAL 119 CO 0.59 0.03 -0.39 1.05 -1.01 0.00 0.00 177.57 177.84 2i6m h GLU 120 N 0.17 0.46 -0.30 4.17 9.09 -1.98 -1.93 114.58 124.27 2i6m h GLU 120 Ca 0.61 -0.22 -0.10 0.00 0.05 0.00 0.00 59.36 59.71 2i6m h GLU 120 Cb 1.32 -0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.41 2i6m h GLU 120 CO -0.70 0.78 -0.19 0.77 0.05 0.00 0.00 179.01 179.72 2i6m h SER 121 N 0.38 0.68 -0.95 3.06 0.02 -1.64 -1.66 113.55 113.44 2i6m h SER 121 Ca 0.04 -0.43 0.01 0.00 -0.84 0.00 0.00 61.79 60.57 2i6m h SER 121 Cb 0.86 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.16 2i6m h SER 121 CO 0.07 0.96 0.62 0.00 -1.14 0.00 0.00 176.83 177.35 2i6m h ALA 122 N 0.74 1.20 -0.18 3.77 0.00 -1.26 0.76 119.26 124.29 2i6m h ALA 122 Ca 0.06 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2i6m h ALA 122 Cb 0.73 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2i6m h ALA 122 CO 0.05 0.60 -0.10 0.82 0.00 0.00 0.00 179.25 180.63 2i6m h ILE 123 N 1.29 1.32 -0.87 0.00 2.04 -1.25 -2.61 117.51 117.43 2i6m h ILE 123 Ca 0.35 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 2i6m h ILE 123 Cb -0.14 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 2i6m h ILE 123 CO -0.07 0.35 0.50 -0.78 0.00 0.00 0.00 178.15 178.15 2i6m h ASP 124 N 0.06 1.06 -0.31 1.72 3.58 -1.04 -0.19 116.42 121.30 2i6m h ASP 124 Ca 0.04 -0.08 0.04 0.00 0.42 0.00 0.00 57.03 57.46 2i6m h ASP 124 Cb 0.59 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.33 2i6m h ASP 124 CO 0.03 0.83 0.06 -0.33 -2.88 0.00 0.00 179.24 176.95 2i6m h GLU 125 N 1.20 0.17 -0.20 0.28 4.39 -0.77 -0.74 114.58 118.91 2i6m h GLU 125 Ca 0.31 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.82 2i6m h GLU 125 Cb -0.01 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2i6m h GLU 125 CO -0.05 0.11 -0.61 0.28 -1.16 0.00 0.00 179.01 177.58 2i6m h VAL 126 N 0.17 1.31 0.00 3.13 2.07 -1.07 -3.08 116.25 118.78 2i6m h VAL 126 Ca 0.15 -1.84 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 2i6m h VAL 126 Cb 0.16 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2i6m h VAL 126 CO -0.19 0.58 -0.15 0.03 0.02 0.00 0.00 177.57 177.86 2i6m h ARG 127 N 0.50 0.00 0.00 1.57 3.08 -0.69 0.23 114.38 119.07 2i6m h ARG 127 Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2i6m h ARG 127 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.23 2i6m h ARG 127 CO 0.12 0.15 -0.13 -0.07 -1.07 0.00 0.00 179.97 178.97 2i6m h LEU 128 N 0.00 0.00 0.00 3.04 3.38 -1.05 -2.91 115.31 117.77 2i6m h LEU 128 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2i6m h LEU 128 Cb 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2i6m h LEU 128 CO 0.02 0.13 -1.44 1.33 0.09 0.00 0.00 178.44 178.57 2i6m n VAL 129 N -3.36 0.02 -3.53 1.22 0.24 -0.95 -4.87 118.33 107.10 2i6m n VAL 129 Ca -0.00 -0.22 -0.29 0.00 -2.04 0.00 0.00 64.34 61.78 2i6m n VAL 129 Cb 0.33 0.26 -0.13 0.00 -1.47 0.00 0.00 33.84 32.83 2i6m n VAL 129 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2i6m s ARG 130 N -2.65 0.60 0.24 7.34 6.06 0.77 -4.97 118.95 126.35 2i6m s ARG 130 Ca -0.03 -1.26 -0.31 0.00 -2.50 0.00 0.00 55.73 51.62 2i6m s ARG 130 Cb 0.06 -1.48 -0.13 0.00 0.06 0.00 0.00 34.95 33.46 2i6m s ARG 130 CO 0.39 -1.15 1.45 -2.30 -2.50 0.00 0.00 175.30 171.19 2i6m n PRO 131 N 4.26 2.14 -0.13 5.12 -0.02 -1.11 -2.14 135.00 143.11 2i6m n PRO 131 Ca 0.07 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2i6m n PRO 131 Cb 0.38 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2i6m n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i6m n GLY 132 N 2.26 1.34 3.49 -1.23 0.00 -1.26 -4.99 105.19 104.79 2i6m n GLY 132 Ca 0.12 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.66 2i6m n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i6m n ALA 133 N -0.84 -1.79 -2.22 4.61 0.00 -0.91 -3.93 120.51 115.43 2i6m n ALA 133 Ca 0.00 0.43 -0.01 0.00 0.00 0.00 0.00 53.44 53.86 2i6m n ALA 133 Cb 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2i6m n ALA 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i6m n VAL 134 N 0.27 -7.67 -0.06 0.00 0.31 -0.93 -4.88 118.33 105.38 2i6m n VAL 134 Ca 0.15 0.93 -0.15 0.00 -0.01 0.00 0.00 64.34 65.26 2i6m n VAL 134 Cb 0.27 -5.75 -0.13 0.00 -0.91 0.00 0.00 33.84 27.31 2i6m n VAL 134 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2i6m h GLN 135 N 1.60 0.03 -6.49 5.55 1.08 -1.75 -3.47 115.11 111.65 2i6m h GLN 135 Ca 0.00 -0.05 -0.44 0.00 -1.45 0.00 0.00 58.65 56.72 2i6m h GLN 135 Cb 0.15 0.02 0.02 0.00 -0.05 0.00 0.00 27.48 27.62 2i6m h GLN 135 CO 0.07 1.02 -0.23 0.95 -0.95 0.00 0.00 178.83 179.69 2i6m s THR 136 N -2.25 3.48 0.26 -0.54 -4.23 -1.26 -5.00 115.64 106.10 2i6m s THR 136 Ca -0.19 -0.88 -0.00 0.00 -1.18 0.00 0.00 61.69 59.44 2i6m s THR 136 Cb -0.02 -3.22 0.07 0.00 1.34 0.00 0.00 72.50 70.67 2i6m s THR 136 CO 0.70 -0.10 1.70 1.88 -0.54 0.00 0.00 174.62 178.25 2i6m h TYR 137 N 0.61 0.69 -0.78 3.99 0.99 -1.94 -1.38 116.97 119.15 2i6m h TYR 137 Ca -0.43 -0.14 -0.02 0.00 2.00 0.00 0.00 58.73 60.14 2i6m h TYR 137 Cb 1.27 -0.17 -0.04 0.00 1.00 0.00 0.00 36.73 38.79 2i6m h TYR 137 CO 0.41 0.77 0.40 1.49 -0.00 0.00 0.00 178.16 181.24 2i6m h GLU 138 N 0.55 1.10 -0.25 4.88 4.81 -1.95 0.28 114.58 124.00 2i6m h GLU 138 Ca 0.09 -0.14 -0.19 0.00 -0.13 0.00 0.00 59.36 58.99 2i6m h GLU 138 Cb 0.65 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2i6m h GLU 138 CO 0.05 0.82 -0.59 1.96 -0.73 0.00 0.00 179.01 180.52 2i6m h GLN 139 N 1.10 0.83 -0.53 1.92 4.20 -1.68 -1.58 115.11 119.36 2i6m h GLN 139 Ca 0.27 -0.55 -0.10 0.00 0.06 0.00 0.00 58.65 58.34 2i6m h GLN 139 Cb 0.06 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2i6m h GLN 139 CO -0.04 1.18 -0.04 0.93 -0.67 0.00 0.00 178.83 180.19 2i6m h GLU 140 N 0.62 0.97 -0.36 1.46 5.08 -0.80 -2.29 114.58 119.26 2i6m h GLU 140 Ca 0.00 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 2i6m h GLU 140 Cb 1.20 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2i6m h GLU 140 CO 0.13 1.00 0.14 0.52 -1.00 0.00 0.00 179.01 179.79 2i6m h MET 141 N 0.84 0.55 -0.70 2.33 2.86 -0.42 -2.80 114.93 117.59 2i6m h MET 141 Ca 0.15 -0.11 0.11 0.00 -2.06 0.00 0.00 59.70 57.79 2i6m h MET 141 Cb 0.58 -0.09 -0.08 0.00 0.06 0.00 0.00 31.60 32.08 2i6m h MET 141 CO 0.04 0.55 0.30 0.35 1.06 0.00 0.00 176.91 179.20 2i6m h PHE 142 N 0.44 0.53 -0.64 -0.22 3.57 -1.13 -1.86 116.94 117.63 2i6m h PHE 142 Ca 0.12 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 2i6m h PHE 142 Cb 0.21 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 2i6m h PHE 142 CO 0.00 0.13 0.18 -0.07 -2.23 0.00 0.00 178.31 176.33 2i6m h LEU 143 N 0.50 0.92 -0.81 0.59 3.38 -1.16 -0.15 115.31 118.58 2i6m h LEU 143 Ca 0.36 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2i6m h LEU 143 Cb 0.47 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2i6m h LEU 143 CO -0.33 0.88 -0.15 0.25 0.09 0.00 0.00 178.44 179.18 2i6m h LEU 144 N 0.95 0.73 -0.75 1.67 5.85 -1.21 -2.09 115.31 120.46 2i6m h LEU 144 Ca 0.21 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 2i6m h LEU 144 Cb 0.30 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2i6m h LEU 144 CO -0.00 0.89 0.22 -0.09 -0.34 0.00 0.00 178.44 179.11 2i6m h ARG 145 N 0.66 1.16 -0.63 1.25 2.43 -0.76 -1.23 114.38 117.27 2i6m h ARG 145 Ca 0.11 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2i6m h ARG 145 Cb 0.62 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 2i6m h ARG 145 CO 0.04 0.99 0.34 0.28 -1.51 0.00 0.00 179.97 180.12 2i6m h VAL 146 N 1.11 1.20 -0.59 0.20 2.07 -0.59 0.94 116.25 120.59 2i6m h VAL 146 Ca 0.24 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 2i6m h VAL 146 Cb 0.33 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2i6m h VAL 146 CO -0.00 0.22 0.24 -0.08 0.02 0.00 0.00 177.57 177.97 2i6m h GLU 147 N 0.85 0.89 -0.43 1.57 4.81 -1.09 0.10 114.58 121.28 2i6m h GLU 147 Ca 0.22 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.24 2i6m h GLU 147 Cb 0.04 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2i6m h GLU 147 CO -0.04 0.75 0.03 0.78 -0.73 0.00 0.00 179.01 179.81 2i6m h GLY 148 N 0.82 0.73 -3.01 1.92 0.00 -0.70 -2.83 103.07 100.00 2i6m h GLY 148 Ca 0.20 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2i6m h GLY 148 CO -0.02 0.41 0.00 1.03 0.00 0.00 0.00 176.54 177.97 2i6m n MET 149 N -4.26 3.58 -0.24 4.80 2.81 0.28 -4.71 117.12 119.38 2i6m n MET 149 Ca 0.02 -2.86 -0.03 0.00 -1.81 0.00 0.00 57.70 53.02 2i6m n MET 149 Cb 0.26 -1.84 0.03 0.00 -0.71 0.00 0.00 33.22 30.96 2i6m n MET 149 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2i6m h ARG 150 N 4.14 -0.09 -0.91 0.03 2.43 -0.54 0.61 114.38 120.05 2i6m h ARG 150 Ca 0.00 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2i6m h ARG 150 Cb 1.38 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.91 2i6m h ARG 150 CO 0.19 -0.06 0.52 0.87 -1.51 0.00 0.00 179.97 179.98 2i6m h LYS 151 N -0.10 1.26 -0.60 0.20 1.79 -1.85 -1.58 116.57 115.70 2i6m h LYS 151 Ca 0.28 -0.14 -0.10 0.00 -2.18 0.00 0.00 60.65 58.52 2i6m h LYS 151 Cb 0.56 -0.25 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 2i6m h LYS 151 CO -0.74 0.91 -0.02 1.03 -1.08 0.00 0.00 179.45 179.55 2i6m h SER 152 N 1.27 1.05 -0.19 0.86 0.87 -1.50 -1.60 113.55 114.31 2i6m h SER 152 Ca 0.32 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2i6m h SER 152 Cb -0.00 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.67 2i6m h SER 152 CO -0.06 1.11 0.06 -0.50 -0.53 0.00 0.00 176.83 176.91 2i6m h TRP 153 N 0.96 0.30 -0.74 2.24 -0.00 -0.60 -1.25 115.95 116.86 2i6m h TRP 153 Ca 0.17 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 59.03 2i6m h TRP 153 Cb 0.58 -0.09 -0.04 0.00 -0.00 0.00 0.00 29.16 29.62 2i6m h TRP 153 CO 0.04 0.38 0.46 -0.07 -0.00 0.00 0.00 178.44 179.25 2i6m h LEU 154 N 0.13 0.87 -0.43 -4.49 3.38 -1.23 0.14 115.31 113.68 2i6m h LEU 154 Ca 0.06 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2i6m h LEU 154 Cb 0.22 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2i6m h LEU 154 CO -0.00 0.66 0.27 0.50 0.09 0.00 0.00 178.44 179.96 2i6m h LYS 155 N 1.00 0.58 -0.17 1.13 3.64 -1.13 -1.89 116.57 119.74 2i6m h LYS 155 Ca 0.27 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.45 2i6m h LYS 155 Cb -0.06 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2i6m h LYS 155 CO -0.05 0.42 -0.51 -0.91 -2.27 0.00 0.00 179.45 176.12 2i6m h ASN 156 N 0.58 0.53 -0.68 4.20 2.35 -0.85 -2.53 115.58 119.17 2i6m h ASN 156 Ca 0.16 -0.27 -0.06 0.00 -0.55 0.00 0.00 56.30 55.58 2i6m h ASN 156 Cb -0.02 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 2i6m h ASN 156 CO -0.03 0.95 0.21 0.40 -1.65 0.00 0.00 177.43 177.31 2i6m h ILE 157 N 0.38 1.25 -0.58 2.81 2.04 -0.54 -3.11 117.51 119.77 2i6m h ILE 157 Ca 0.01 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 2i6m h ILE 157 Cb 1.03 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2i6m h ILE 157 CO 0.09 0.35 0.04 -1.22 0.00 0.00 0.00 178.15 177.41 2i6m n TYR 158 N -4.25 2.08 -1.94 1.37 4.02 -0.73 -4.94 117.16 112.77 2i6m n TYR 158 Ca 0.06 -0.82 -0.43 0.00 -0.01 0.00 0.00 57.90 56.70 2i6m n TYR 158 Cb 0.23 -0.53 -0.03 0.00 -0.02 0.00 0.00 39.34 38.99 2i6m n TYR 158 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2i6m s SER 159 N -0.91 6.12 0.34 7.72 0.01 -0.96 -4.94 113.70 121.08 2i6m s SER 159 Ca 0.54 1.75 0.04 0.00 1.31 0.00 0.00 55.95 59.60 2i6m s SER 159 Cb 0.42 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 64.10 2i6m s SER 159 CO 0.15 -1.45 0.16 -0.46 0.41 0.00 0.00 173.24 172.05 2i6m n ASN 160 N 9.28 0.69 0.00 2.44 6.94 -1.26 -5.09 115.26 128.27 2i6m n ASN 160 Ca 0.22 -2.92 0.08 0.00 -0.02 0.00 0.00 54.58 51.94 2i6m n ASN 160 Cb 0.45 1.06 0.46 0.00 -2.36 0.00 0.00 39.78 39.39 2i6m n ASN 160 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69