#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cde s GLN 3 N 0.00 2.48 -0.32 3.52 -0.44 -1.23 -4.94 119.66 118.74 2cde s GLN 3 Ca 0.00 -1.18 -0.09 0.00 -2.50 0.00 0.00 55.36 51.59 2cde s GLN 3 Cb 0.00 -2.79 0.01 0.00 -1.64 0.00 0.00 33.01 28.58 2cde s GLN 3 CO 0.00 -0.46 0.14 0.08 0.50 0.00 0.00 175.29 175.55 2cde s VAL 4 N 1.16 4.36 -0.23 1.34 1.01 -1.26 -0.90 120.40 125.88 2cde s VAL 4 Ca -0.04 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 2cde s VAL 4 Cb -0.18 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 2cde s VAL 4 CO -0.07 -0.01 0.04 -1.61 0.00 0.00 0.00 175.10 173.45 2cde s GLU 5 N 1.55 3.64 0.08 2.72 2.02 0.28 -4.58 118.70 124.41 2cde s GLU 5 Ca 0.03 -0.49 0.10 0.00 0.02 0.00 0.00 54.97 54.62 2cde s GLU 5 Cb -0.18 -3.23 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 2cde s GLU 5 CO 0.05 -0.11 -0.25 -0.65 0.02 0.00 0.00 175.26 174.31 2cde s GLN 6 N 1.38 1.70 -0.10 1.61 -0.21 -1.26 0.27 119.66 123.04 2cde s GLN 6 Ca 0.05 -1.18 -0.28 0.00 0.02 0.00 0.00 55.36 53.97 2cde s GLN 6 Cb -0.15 -1.98 0.07 0.00 1.00 0.00 0.00 33.01 31.95 2cde s GLN 6 CO 0.02 0.49 0.67 -1.54 -2.12 0.00 0.00 175.29 172.81 2cde s SER 7 N -1.57 -0.65 0.39 5.90 1.04 -1.10 -4.60 113.70 113.10 2cde s SER 7 Ca 0.13 0.87 0.00 0.00 0.48 0.00 0.00 55.95 57.43 2cde s SER 7 Cb -0.10 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.78 2cde s SER 7 CO 0.04 -0.50 0.00 -0.81 0.98 0.00 0.00 173.24 172.95 2cde n PRO 8 N 1.40 0.04 -0.00 4.02 -0.04 -1.26 -2.14 135.00 137.03 2cde n PRO 8 Ca -0.18 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.30 2cde n PRO 8 Cb 0.56 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.00 2cde n PRO 8 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2cde n GLN 9 N -0.67 1.52 -3.69 0.54 6.02 -1.26 -4.51 117.38 115.32 2cde n GLN 9 Ca 0.00 -0.03 -0.14 0.00 -0.01 0.00 0.00 57.00 56.82 2cde n GLN 9 Cb 0.00 -0.99 -0.08 0.00 1.02 0.00 0.00 30.24 30.19 2cde n GLN 9 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2cde s SER 10 N -2.17 -0.43 0.02 1.08 1.04 -1.26 -1.77 113.70 110.21 2cde s SER 10 Ca -0.01 0.61 -0.28 0.00 0.48 0.00 0.00 55.95 56.75 2cde s SER 10 Cb 0.03 0.65 0.08 0.00 0.10 0.00 0.00 66.02 66.87 2cde s SER 10 CO 0.16 -0.36 0.68 -0.22 0.98 0.00 0.00 173.24 174.48 2cde s LEU 11 N -0.61 -0.59 -0.09 2.42 2.96 -0.26 -4.90 118.68 117.61 2cde s LEU 11 Ca -0.07 0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 54.20 2cde s LEU 11 Cb -0.03 2.49 0.05 0.00 0.50 0.00 0.00 46.19 49.20 2cde s LEU 11 CO 0.04 -0.73 0.19 -0.63 -1.32 0.00 0.00 176.35 173.90 2cde s ILE 12 N -2.23 -0.14 0.25 6.68 1.01 -1.26 -0.91 121.20 124.60 2cde s ILE 12 Ca -0.05 0.22 -0.00 0.00 0.00 0.00 0.00 60.65 60.81 2cde s ILE 12 Cb -0.00 -0.32 -0.03 0.00 0.01 0.00 0.00 42.46 42.12 2cde s ILE 12 CO 0.00 0.09 0.23 -0.63 0.00 0.00 0.00 174.94 174.63 2cde s ILE 13 N 1.59 0.00 0.38 2.92 1.01 0.93 -4.96 121.20 123.07 2cde s ILE 13 Ca -0.05 -1.91 0.08 0.00 0.00 0.00 0.00 60.65 58.77 2cde s ILE 13 Cb -0.11 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 2cde s ILE 13 CO -0.07 0.00 0.34 -0.76 0.00 0.00 0.00 174.94 174.45 2cde s LEU 14 N -3.20 3.50 1.14 2.97 1.43 -1.26 -0.17 118.68 123.09 2cde s LEU 14 Ca 0.37 -0.62 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 2cde s LEU 14 Cb 0.05 -2.15 0.26 0.00 0.03 0.00 0.00 46.19 44.38 2cde s LEU 14 CO 0.16 -0.52 0.98 -0.62 0.23 0.00 0.00 176.35 176.59 2cde n GLU 15 N -1.48 -2.18 0.00 1.70 1.02 -1.09 -3.12 120.64 115.49 2cde n GLU 15 Ca 0.01 -0.60 0.00 0.00 -0.02 0.00 0.00 57.16 56.55 2cde n GLU 15 Cb 0.61 -2.17 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 2cde n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cde n GLY 16 N 0.97 0.80 3.78 0.62 0.00 -0.68 -4.78 105.19 105.90 2cde n GLY 16 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2cde n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cde s LYS 17 N 0.00 4.37 -0.60 1.61 1.02 -1.18 -4.24 119.74 120.72 2cde s LYS 17 Ca 0.00 0.90 -0.18 0.00 0.02 0.00 0.00 55.97 56.71 2cde s LYS 17 Cb 0.00 -3.29 0.11 0.00 -0.52 0.00 0.00 37.83 34.14 2cde s LYS 17 CO 0.00 0.51 0.67 -0.80 -0.92 0.00 0.00 175.35 174.81 2cde s ASN 18 N -0.76 6.22 0.69 2.83 -0.87 -1.26 -1.63 114.94 120.16 2cde s ASN 18 Ca 0.33 -1.58 -0.01 0.00 -1.57 0.00 0.00 52.86 50.02 2cde s ASN 18 Cb -0.20 -2.28 0.11 0.00 -0.02 0.00 0.00 41.25 38.85 2cde s ASN 18 CO 0.21 -1.04 0.96 0.00 -2.57 0.00 0.00 177.10 174.67 2cde s THR 20 N -3.10 0.00 0.11 0.00 -4.23 -1.26 -0.60 115.64 106.56 2cde s THR 20 Ca 0.64 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 61.02 2cde s THR 20 Cb -0.07 -1.00 0.02 0.00 1.34 0.00 0.00 72.50 72.79 2cde s THR 20 CO 0.43 0.00 0.32 -1.48 -0.54 0.00 0.00 174.62 173.36 2cde s LEU 21 N -1.62 0.78 0.42 4.79 2.34 -1.04 -4.91 118.68 119.43 2cde s LEU 21 Ca -0.05 -0.44 0.05 0.00 0.06 0.00 0.00 54.13 53.75 2cde s LEU 21 Cb -0.00 1.54 -0.05 0.00 -0.56 0.00 0.00 46.19 47.11 2cde s LEU 21 CO 0.02 -0.81 0.03 -1.10 -1.06 0.00 0.00 176.35 173.43 2cde s GLN 22 N -3.82 1.95 -0.03 1.48 -0.21 -0.91 -0.94 119.66 117.19 2cde s GLN 22 Ca 0.04 -2.15 -0.03 0.00 0.02 0.00 0.00 55.36 53.24 2cde s GLN 22 Cb 0.03 -1.35 0.01 0.00 1.00 0.00 0.00 33.01 32.70 2cde s GLN 22 CO -0.12 -0.20 0.07 0.00 -2.12 0.00 0.00 175.29 172.93 2cde s ASN 24 N -0.03 0.55 0.13 0.00 -0.87 0.14 -0.73 114.94 114.13 2cde s ASN 24 Ca -0.01 -1.13 -0.17 0.00 -1.57 0.00 0.00 52.86 49.98 2cde s ASN 24 Cb -0.01 0.23 0.06 0.00 -0.02 0.00 0.00 41.25 41.51 2cde s ASN 24 CO 0.00 -0.65 0.80 0.00 -2.57 0.00 0.00 177.10 174.68 2cde n TYR 25 N -0.06 -1.14 -3.35 2.20 0.18 -1.23 0.99 117.16 114.77 2cde n TYR 25 Ca -0.08 -0.96 -0.26 0.00 1.88 0.00 0.00 57.90 58.48 2cde n TYR 25 Cb 0.63 0.47 -0.09 0.00 -0.38 0.00 0.00 39.34 39.96 2cde n TYR 25 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 2cde n THR 26 N -0.57 -0.97 -5.14 -3.48 -1.04 -0.08 -4.92 114.28 98.09 2cde n THR 26 Ca -0.01 -3.64 -0.29 0.00 -2.04 0.00 0.00 64.05 58.06 2cde n THR 26 Cb 0.45 -1.76 -0.16 0.00 -1.82 0.00 0.00 70.33 67.04 2cde n THR 26 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2cde s VAL 27 N -0.36 1.81 0.05 12.58 -7.23 -1.26 -0.90 120.40 125.09 2cde s VAL 27 Ca 0.33 -0.98 -0.20 0.00 -1.81 0.00 0.00 61.98 59.33 2cde s VAL 27 Cb 0.08 -1.51 -0.10 0.00 0.56 0.00 0.00 36.38 35.41 2cde s VAL 27 CO -0.17 0.51 1.31 0.77 -0.31 0.00 0.00 175.10 177.21 2cde h SER 28 N 5.62 -0.77 -2.43 4.85 4.64 -1.99 -3.44 113.55 120.03 2cde h SER 28 Ca -0.40 0.06 -0.62 0.00 -0.47 0.00 0.00 61.79 60.36 2cde h SER 28 Cb 1.13 0.25 -0.15 0.00 -0.31 0.00 0.00 62.40 63.32 2cde h SER 28 CO 0.47 -0.39 -0.77 -2.16 -0.87 0.00 0.00 176.83 173.12 2cde s PRO 29 N -4.60 1.67 0.23 4.77 0.04 -1.26 -5.13 135.00 130.72 2cde s PRO 29 Ca -0.10 -1.70 0.04 0.00 0.04 0.00 0.00 61.00 59.28 2cde s PRO 29 Cb 0.02 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.70 2cde s PRO 29 CO 0.34 0.35 -0.03 -0.06 0.04 0.00 0.00 177.00 177.63 2cde s PHE 30 N -2.31 1.58 0.00 0.56 0.40 -1.26 -4.09 117.98 112.86 2cde s PHE 30 Ca 0.28 -0.86 0.00 0.00 -0.60 0.00 0.00 56.93 55.75 2cde s PHE 30 Cb -0.06 -0.89 0.00 0.00 0.51 0.00 0.00 43.02 42.58 2cde s PHE 30 CO 0.14 0.03 0.00 -1.13 0.70 0.00 0.00 175.22 174.96 2cde n SER 31 N -0.41 0.00 -4.24 1.36 3.41 -1.23 -4.50 113.62 108.01 2cde n SER 31 Ca -0.06 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.29 2cde n SER 31 Cb 0.63 0.15 -0.15 0.00 -0.26 0.00 0.00 64.21 64.58 2cde n SER 31 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2cde s ASN 32 N -1.30 2.44 -0.06 4.04 0.01 -1.25 -3.88 114.94 114.94 2cde s ASN 32 Ca 0.00 -0.47 -0.01 0.00 -0.71 0.00 0.00 52.86 51.67 2cde s ASN 32 Cb 0.00 -0.23 0.03 0.00 0.41 0.00 0.00 41.25 41.46 2cde s ASN 32 CO 0.00 0.19 0.01 -0.22 -1.51 0.00 0.00 177.10 175.57 2cde s LEU 33 N -0.92 0.65 0.10 0.60 2.96 -0.39 -2.90 118.68 118.78 2cde s LEU 33 Ca 0.08 -0.06 0.07 0.00 -0.22 0.00 0.00 54.13 54.00 2cde s LEU 33 Cb -0.08 -0.38 -0.03 0.00 0.50 0.00 0.00 46.19 46.20 2cde s LEU 33 CO 0.01 -0.18 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.55 2cde s ARG 34 N 1.81 1.02 -0.11 1.98 0.52 0.66 -0.08 118.95 124.76 2cde s ARG 34 Ca 0.02 -1.13 0.02 0.00 -0.52 0.00 0.00 55.73 54.13 2cde s ARG 34 Cb -0.13 -1.14 0.01 0.00 0.52 0.00 0.00 34.95 34.22 2cde s ARG 34 CO -0.04 0.25 -0.18 -1.58 0.02 0.00 0.00 175.30 173.77 2cde s TRP 35 N -1.40 2.15 0.41 -0.53 0.52 -0.99 -0.22 118.94 118.87 2cde s TRP 35 Ca 0.05 -0.99 0.07 0.00 0.02 0.00 0.00 56.10 55.25 2cde s TRP 35 Cb -0.09 -1.51 -0.06 0.00 -1.15 0.00 0.00 33.47 30.66 2cde s TRP 35 CO 0.04 -0.47 0.15 0.71 0.02 0.00 0.00 176.95 177.40 2cde s TYR 36 N 0.80 2.59 -0.46 -1.98 1.51 0.08 -0.86 117.35 119.04 2cde s TYR 36 Ca -0.10 -0.60 0.08 0.00 -1.01 0.00 0.00 57.07 55.44 2cde s TYR 36 Cb -0.16 -1.92 0.27 0.00 -0.11 0.00 0.00 41.96 40.04 2cde s TYR 36 CO 0.01 0.23 0.64 1.17 -1.11 0.00 0.00 175.55 176.49 2cde n LYS 37 N -1.19 1.36 -2.08 -0.62 4.81 -1.08 -2.54 118.16 116.83 2cde n LYS 37 Ca -0.02 -3.71 -0.42 0.00 -0.87 0.00 0.00 58.31 53.29 2cde n LYS 37 Cb 0.65 -1.61 -0.03 0.00 0.02 0.00 0.00 35.03 34.06 2cde n LYS 37 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 2cde s GLN 38 N -1.83 4.29 0.23 1.64 0.74 -0.79 -4.24 119.66 119.70 2cde s GLN 38 Ca 0.38 2.21 0.06 0.00 0.05 0.00 0.00 55.36 58.06 2cde s GLN 38 Cb 0.20 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 31.10 2cde s GLN 38 CO -0.08 -0.44 0.20 -0.51 -0.55 0.00 0.00 175.29 173.91 2cde s ASP 39 N 0.76 5.61 -0.46 6.67 1.01 -1.26 -2.83 116.67 126.17 2cde s ASP 39 Ca 0.63 -0.19 -0.43 0.00 0.71 0.00 0.00 52.55 53.27 2cde s ASP 39 Cb -0.40 -1.46 -0.18 0.00 1.01 0.00 0.00 42.92 41.89 2cde s ASP 39 CO 0.36 -0.02 2.06 0.41 0.21 0.00 0.00 175.17 178.18 2cde n THR 40 N -1.05 0.05 -0.48 -1.27 -1.04 -1.26 0.73 114.28 109.94 2cde n THR 40 Ca -0.08 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2cde n THR 40 Cb 0.57 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 68.36 2cde n THR 40 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2cde n GLY 41 N 6.72 1.08 3.92 3.41 0.00 -1.26 -4.98 105.19 114.08 2cde n GLY 41 Ca 0.48 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.30 2cde n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cde s ARG 42 N -0.24 2.80 0.21 1.61 0.52 0.22 -5.11 118.95 118.97 2cde s ARG 42 Ca 0.00 -1.26 -0.16 0.00 -0.52 0.00 0.00 55.73 53.79 2cde s ARG 42 Cb 0.00 -2.59 -0.08 0.00 0.52 0.00 0.00 34.95 32.81 2cde s ARG 42 CO 0.00 -0.02 0.64 0.20 0.02 0.00 0.00 175.30 176.14 2cde s GLY 43 N -4.12 2.48 1.02 -3.53 0.00 -1.26 -4.01 107.32 97.90 2cde s GLY 43 Ca 0.45 -0.01 -0.26 0.00 0.00 0.00 0.00 44.72 44.90 2cde s GLY 43 CO 0.29 0.28 -1.29 -1.05 0.00 0.00 0.00 173.10 171.32 2cde n PRO 44 N 0.53 -0.27 -3.80 2.90 -0.02 -1.26 -4.53 135.00 128.55 2cde n PRO 44 Ca -0.02 -0.08 -0.14 0.00 -2.02 0.00 0.00 63.50 61.24 2cde n PRO 44 Cb 0.52 -1.12 -0.15 0.00 -0.02 0.00 0.00 33.50 32.73 2cde n PRO 44 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2cde s VAL 45 N -2.04 -0.04 -0.43 -1.45 1.01 -1.26 -4.84 120.40 111.35 2cde s VAL 45 Ca 0.39 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 2cde s VAL 45 Cb 0.07 -0.10 0.01 0.00 0.00 0.00 0.00 36.38 36.35 2cde s VAL 45 CO 0.66 0.05 1.40 -0.94 0.00 0.00 0.00 175.10 176.27 2cde s SER 46 N 0.70 6.32 -0.15 3.32 1.04 -1.26 -2.64 113.70 121.03 2cde s SER 46 Ca -0.06 0.74 -0.04 0.00 0.48 0.00 0.00 55.95 57.07 2cde s SER 46 Cb -0.08 -2.54 -0.24 0.00 0.10 0.00 0.00 66.02 63.26 2cde s SER 46 CO -0.02 -1.46 0.24 0.18 0.98 0.00 0.00 173.24 173.16 2cde n LEU 47 N 8.87 2.69 -3.52 2.42 4.77 -0.04 -5.02 117.00 127.17 2cde n LEU 47 Ca 0.16 0.14 -0.11 0.00 -0.03 0.00 0.00 56.01 56.16 2cde n LEU 47 Cb 0.48 -1.05 -0.04 0.00 -2.33 0.00 0.00 43.42 40.48 2cde n LEU 47 CO 0.71 0.87 0.63 -0.89 -1.33 0.00 0.00 177.39 177.38 2cde s THR 48 N -2.55 0.00 -0.12 -5.08 2.01 -1.22 -4.95 115.64 103.73 2cde s THR 48 Ca -0.25 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 61.72 2cde s THR 48 Cb 0.07 -1.00 0.05 0.00 0.01 0.00 0.00 72.50 71.63 2cde s THR 48 CO 0.73 0.00 0.06 -0.63 -0.69 0.00 0.00 174.62 174.09 2cde s ILE 49 N -2.26 0.06 0.21 1.82 1.01 -1.25 -2.36 121.20 118.43 2cde s ILE 49 Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.71 2cde s ILE 49 Cb -0.01 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.93 2cde s ILE 49 CO -0.03 -0.05 0.22 -0.04 0.00 0.00 0.00 174.94 175.05 2cde s MET 50 N 2.08 3.08 0.00 2.79 -1.94 0.89 -4.83 119.30 121.37 2cde s MET 50 Ca 0.03 -0.89 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2cde s MET 50 Cb -0.14 -2.70 0.00 0.00 2.01 0.00 0.00 34.83 34.00 2cde s MET 50 CO -0.06 0.45 0.00 2.41 -0.01 0.00 0.00 175.02 177.80 2cde n THR 51 N -0.90 0.00 0.00 2.05 -1.04 -1.25 -1.26 114.28 111.87 2cde n THR 51 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2cde n THR 51 Cb 0.56 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 2cde n THR 51 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2cde n PHE 52 N 0.00 0.00 -2.77 -1.42 3.01 -1.26 -4.38 117.46 110.63 2cde n PHE 52 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 2cde n PHE 52 Cb 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 2cde n PHE 52 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2cde s SER 53 N -1.82 6.36 0.00 4.37 1.04 -1.26 -4.98 113.70 117.41 2cde s SER 53 Ca 0.00 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.17 2cde s SER 53 Cb 0.00 -2.47 0.00 0.00 0.10 0.00 0.00 66.02 63.65 2cde s SER 53 CO 0.00 -1.31 0.00 -0.62 0.98 0.00 0.00 173.24 172.29 2cde n GLU 54 N 7.74 0.00 -0.27 4.02 1.02 -1.26 -4.59 120.64 127.29 2cde n GLU 54 Ca 0.03 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.26 2cde n GLU 54 Cb 0.48 0.00 0.16 0.00 -0.02 0.00 0.00 31.44 32.06 2cde n GLU 54 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2cde n ASN 55 N -2.36 2.09 -3.66 1.62 6.94 -1.23 -3.81 115.26 114.85 2cde n ASN 55 Ca 0.00 -3.36 -0.12 0.00 -0.02 0.00 0.00 54.58 51.08 2cde n ASN 55 Cb 0.00 -0.46 -0.12 0.00 -2.36 0.00 0.00 39.78 36.84 2cde n ASN 55 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2cde s THR 56 N -2.96 -0.49 -0.16 5.53 2.01 -1.25 -3.21 115.64 115.10 2cde s THR 56 Ca 0.34 0.25 -0.07 0.00 0.31 0.00 0.00 61.69 62.51 2cde s THR 56 Cb 0.31 -0.51 0.07 0.00 0.01 0.00 0.00 72.50 72.37 2cde s THR 56 CO -0.01 0.10 0.36 -0.54 -0.69 0.00 0.00 174.62 173.85 2cde s LYS 57 N 2.48 0.30 0.30 4.92 1.02 -1.18 -5.00 119.74 122.58 2cde s LYS 57 Ca 0.00 0.81 0.08 0.00 0.02 0.00 0.00 55.97 56.88 2cde s LYS 57 Cb -0.12 0.05 -0.04 0.00 -0.52 0.00 0.00 37.83 37.21 2cde s LYS 57 CO -0.10 -0.20 0.18 -1.54 -0.92 0.00 0.00 175.35 172.77 2cde s SER 58 N 1.87 5.10 -0.44 2.83 1.04 -1.26 -1.48 113.70 121.36 2cde s SER 58 Ca -0.06 -0.50 0.04 0.00 0.48 0.00 0.00 55.95 55.90 2cde s SER 58 Cb -0.10 -1.03 0.19 0.00 0.10 0.00 0.00 66.02 65.18 2cde s SER 58 CO -0.11 -0.18 0.78 0.21 0.98 0.00 0.00 173.24 174.92 2cde s ASN 59 N -3.86 -1.19 1.51 7.02 3.84 -0.79 -5.01 114.94 116.45 2cde s ASN 59 Ca 0.36 -1.06 0.00 0.00 0.21 0.00 0.00 52.86 52.37 2cde s ASN 59 Cb -0.06 1.54 0.00 0.00 -0.55 0.00 0.00 41.25 42.19 2cde s ASN 59 CO 0.24 -0.08 0.00 0.61 -2.79 0.00 0.00 177.10 175.08 2cde n GLY 60 N 3.45 2.21 0.84 1.21 0.00 -1.26 -2.43 105.19 109.21 2cde n GLY 60 Ca 0.13 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.82 2cde n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cde n ARG 61 N 13.01 2.01 -4.94 1.61 1.74 -1.26 -4.83 116.66 124.00 2cde n ARG 61 Ca 0.00 -0.84 -0.31 0.00 -0.77 0.00 0.00 57.85 55.93 2cde n ARG 61 Cb 0.00 -1.67 -0.14 0.00 -1.02 0.00 0.00 32.46 29.63 2cde n ARG 61 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2cde s TYR 62 N -1.49 2.52 -0.20 -1.55 2.02 -1.02 -1.45 117.35 116.19 2cde s TYR 62 Ca 0.15 -0.29 -0.04 0.00 -0.37 0.00 0.00 57.07 56.52 2cde s TYR 62 Cb 0.11 -1.52 0.09 0.00 -0.40 0.00 0.00 41.96 40.23 2cde s TYR 62 CO 0.05 0.14 0.19 0.99 -1.57 0.00 0.00 175.55 175.34 2cde s THR 63 N -0.76 -0.27 0.52 -0.71 2.01 0.29 -1.89 115.64 114.83 2cde s THR 63 Ca 0.12 -0.14 -0.06 0.00 0.31 0.00 0.00 61.69 61.92 2cde s THR 63 Cb -0.10 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 2cde s THR 63 CO 0.02 -0.23 0.84 0.00 -0.69 0.00 0.00 174.62 174.55 2cde s ALA 64 N 2.28 3.34 -0.21 7.40 0.00 -0.55 0.22 121.76 134.25 2cde s ALA 64 Ca 0.06 -0.46 -0.05 0.00 0.00 0.00 0.00 51.96 51.51 2cde s ALA 64 Cb -0.16 -2.67 0.10 0.00 0.00 0.00 0.00 23.12 20.40 2cde s ALA 64 CO -0.12 -0.46 0.36 0.99 0.00 0.00 0.00 175.76 176.53 2cde s THR 65 N -2.84 -0.57 -0.18 0.00 2.01 0.55 -3.08 115.64 111.53 2cde s THR 65 Ca 0.49 0.07 -0.09 0.00 0.31 0.00 0.00 61.69 62.47 2cde s THR 65 Cb -0.10 -0.69 -0.05 0.00 0.01 0.00 0.00 72.50 71.67 2cde s THR 65 CO 0.46 -0.02 0.12 -0.22 -0.69 0.00 0.00 174.62 174.27 2cde s LEU 66 N 2.54 4.17 0.54 4.42 2.96 -1.20 -0.73 118.68 131.37 2cde s LEU 66 Ca 0.05 0.25 -0.22 0.00 -0.22 0.00 0.00 54.13 53.99 2cde s LEU 66 Cb -0.14 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 2cde s LEU 66 CO -0.13 0.22 1.33 -0.67 -1.32 0.00 0.00 176.35 175.78 2cde n ASP 67 N 3.22 2.58 0.00 3.68 -0.08 0.63 -3.49 116.55 123.09 2cde n ASP 67 Ca -0.17 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.09 2cde n ASP 67 Cb 0.53 -1.56 0.00 0.00 2.34 0.00 0.00 41.12 42.43 2cde n ASP 67 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2cde n ALA 68 N -0.99 -0.23 0.42 -1.67 0.00 -1.26 -0.78 120.51 116.00 2cde n ALA 68 Ca 0.10 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.59 2cde n ALA 68 Cb 0.44 0.22 0.25 0.00 0.00 0.00 0.00 19.45 20.36 2cde n ALA 68 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2cde n ASP 69 N -2.26 0.00 -2.15 0.00 5.75 -1.26 -4.88 116.55 111.75 2cde n ASP 69 Ca 0.00 0.39 -0.02 0.00 -0.01 0.00 0.00 54.79 55.14 2cde n ASP 69 Cb 0.00 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.66 2cde n ASP 69 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2cde n THR 70 N -1.44 -5.85 0.00 2.12 -1.04 0.04 -4.99 114.28 103.12 2cde n THR 70 Ca 0.03 0.24 0.00 0.00 -2.04 0.00 0.00 64.05 62.29 2cde n THR 70 Cb 0.12 -5.37 0.00 0.00 -1.82 0.00 0.00 70.33 63.26 2cde n THR 70 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2cde n LYS 71 N -0.71 2.08 -3.60 -2.82 2.85 -1.26 -4.97 118.16 109.72 2cde n LYS 71 Ca 0.04 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.20 2cde n LYS 71 Cb 0.30 -0.18 -0.06 0.00 -0.65 0.00 0.00 35.03 34.44 2cde n LYS 71 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 2cde s GLN 72 N -0.28 0.57 0.15 -1.58 -2.07 -1.26 -3.50 119.66 111.69 2cde s GLN 72 Ca 0.00 0.30 0.05 0.00 -1.82 0.00 0.00 55.36 53.88 2cde s GLN 72 Cb 0.00 0.27 -0.04 0.00 -1.09 0.00 0.00 33.01 32.15 2cde s GLN 72 CO 0.00 -0.14 -0.10 0.45 -1.32 0.00 0.00 175.29 174.18 2cde s SER 73 N -0.65 1.83 -0.02 12.60 0.15 0.09 -0.27 113.70 127.44 2cde s SER 73 Ca -0.00 -1.02 0.01 0.00 0.70 0.00 0.00 55.95 55.63 2cde s SER 73 Cb -0.02 -0.01 0.02 0.00 -1.71 0.00 0.00 66.02 64.29 2cde s SER 73 CO -0.01 -0.33 -0.01 -0.94 1.20 0.00 0.00 173.24 173.15 2cde s SER 74 N -3.18 0.33 -0.40 5.45 1.04 0.09 0.17 113.70 117.20 2cde s SER 74 Ca 0.17 -0.03 -0.12 0.00 0.48 0.00 0.00 55.95 56.46 2cde s SER 74 Cb 0.03 -0.14 0.04 0.00 0.10 0.00 0.00 66.02 66.04 2cde s SER 74 CO 0.01 -0.06 0.26 -0.22 0.98 0.00 0.00 173.24 174.21 2cde s LEU 75 N 0.63 4.97 -0.23 2.42 2.96 -0.11 -0.33 118.68 128.98 2cde s LEU 75 Ca -0.06 -1.07 -0.17 0.00 -0.22 0.00 0.00 54.13 52.61 2cde s LEU 75 Cb -0.09 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 2cde s LEU 75 CO -0.01 -0.45 0.45 -2.28 -1.32 0.00 0.00 176.35 172.74 2cde s HIS 76 N 1.58 3.31 -0.07 5.38 5.65 0.60 -2.51 115.29 129.23 2cde s HIS 76 Ca 0.03 0.61 0.02 0.00 0.25 0.00 0.00 55.06 55.97 2cde s HIS 76 Cb -0.20 -2.63 -0.03 0.00 -1.18 0.00 0.00 32.58 28.55 2cde s HIS 76 CO 0.07 -0.16 -0.11 0.42 -0.65 0.00 0.00 174.74 174.31 2cde s ILE 77 N 1.86 3.31 0.21 0.89 1.01 0.24 0.11 121.20 128.81 2cde s ILE 77 Ca 0.20 -0.62 0.07 0.00 0.00 0.00 0.00 60.65 60.30 2cde s ILE 77 Cb -0.15 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 2cde s ILE 77 CO 0.09 0.58 0.07 -0.89 0.00 0.00 0.00 174.94 174.79 2cde s THR 78 N -0.55 3.98 -0.39 2.92 2.01 -0.53 -1.70 115.64 121.38 2cde s THR 78 Ca 0.08 -1.44 -0.09 0.00 0.31 0.00 0.00 61.69 60.54 2cde s THR 78 Cb -0.12 -3.07 0.01 0.00 0.01 0.00 0.00 72.50 69.34 2cde s THR 78 CO 0.02 -0.21 0.36 0.00 -0.69 0.00 0.00 174.62 174.09 2cde n ALA 79 N -0.55 -1.93 -1.63 7.40 0.00 -1.25 -4.76 120.51 117.79 2cde n ALA 79 Ca -0.08 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 52.92 2cde n ALA 79 Cb 0.56 -0.74 0.01 0.00 0.00 0.00 0.00 19.45 19.29 2cde n ALA 79 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cde n SER 80 N -0.68 1.55 -4.12 0.00 3.41 -0.65 -4.53 113.62 108.61 2cde n SER 80 Ca -0.14 1.05 -0.26 0.00 -0.26 0.00 0.00 58.87 59.27 2cde n SER 80 Cb 0.40 -1.38 -0.16 0.00 -0.26 0.00 0.00 64.21 62.80 2cde n SER 80 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2cde s GLN 81 N -2.05 1.84 0.52 4.33 0.74 -1.26 -1.69 119.66 122.09 2cde s GLN 81 Ca 0.63 -0.60 0.35 0.00 0.05 0.00 0.00 55.36 55.79 2cde s GLN 81 Cb -0.55 -1.57 1.51 0.00 1.10 0.00 0.00 33.01 33.50 2cde s GLN 81 CO 0.57 0.21 1.79 1.37 -0.55 0.00 0.00 175.29 178.68 2cde h LEU 82 N 6.37 0.06 -1.13 3.68 -0.00 -1.90 0.98 115.31 123.37 2cde h LEU 82 Ca -0.32 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.58 2cde h LEU 82 Cb 1.18 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 2cde h LEU 82 CO 0.48 0.00 0.00 -1.54 -0.00 0.00 0.00 178.44 177.38 2cde n SER 83 N -4.23 0.64 0.18 0.17 3.41 -1.26 -1.16 113.62 111.36 2cde n SER 83 Ca 0.27 0.73 0.12 0.00 -0.26 0.00 0.00 58.87 59.72 2cde n SER 83 Cb 1.24 -0.83 0.11 0.00 -0.26 0.00 0.00 64.21 64.47 2cde n SER 83 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2cde h ASP 84 N 0.00 0.00 -1.05 4.04 3.32 0.60 -3.45 116.42 119.88 2cde h ASP 84 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2cde h ASP 84 Cb 0.17 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2cde h ASP 84 CO 0.00 0.01 1.56 -1.54 -1.72 0.00 0.00 179.24 177.54 2cde n SER 85 N -2.96 1.85 -3.60 6.45 3.41 -0.31 -4.82 113.62 113.65 2cde n SER 85 Ca 0.03 0.08 -0.02 0.00 -0.26 0.00 0.00 58.87 58.69 2cde n SER 85 Cb 0.54 -1.30 -0.00 0.00 -0.26 0.00 0.00 64.21 63.19 2cde n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cde s ALA 86 N 9.17 -1.73 0.04 7.33 0.00 -0.70 -4.91 121.76 130.96 2cde s ALA 86 Ca 1.11 0.03 -0.18 0.00 0.00 0.00 0.00 51.96 52.93 2cde s ALA 86 Cb -0.72 0.65 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 2cde s ALA 86 CO 0.42 -1.06 0.53 -1.54 0.00 0.00 0.00 175.76 174.11 2cde s SER 87 N -3.13 6.98 -0.08 0.00 1.04 -1.13 -0.80 113.70 116.59 2cde s SER 87 Ca 0.16 1.16 0.05 0.00 0.48 0.00 0.00 55.95 57.80 2cde s SER 87 Cb -0.01 -2.33 -0.01 0.00 0.10 0.00 0.00 66.02 63.77 2cde s SER 87 CO 0.02 0.26 -0.23 -0.31 0.98 0.00 0.00 173.24 173.97 2cde s TYR 88 N -0.96 2.53 -0.07 5.02 4.12 -1.11 -1.88 117.35 124.99 2cde s TYR 88 Ca 0.28 -0.78 0.01 0.00 0.02 0.00 0.00 57.07 56.59 2cde s TYR 88 Cb -0.19 -1.66 -0.03 0.00 -1.52 0.00 0.00 41.96 38.57 2cde s TYR 88 CO 0.17 -0.25 -0.07 0.42 0.02 0.00 0.00 175.55 175.84 2cde s ILE 89 N 0.01 3.72 -0.27 2.71 1.01 -1.05 -2.51 121.20 124.81 2cde s ILE 89 Ca -0.08 -0.47 -0.07 0.00 0.00 0.00 0.00 60.65 60.03 2cde s ILE 89 Cb -0.15 -2.52 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 2cde s ILE 89 CO 0.05 0.60 0.07 0.00 0.00 0.00 0.00 174.94 175.66 2cde s VAL 91 N 1.56 1.76 0.44 0.00 1.01 0.69 -1.76 120.40 124.10 2cde s VAL 91 Ca 0.05 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.23 2cde s VAL 91 Cb -0.16 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 2cde s VAL 91 CO 0.03 0.49 0.25 -0.69 0.00 0.00 0.00 175.10 175.19 2cde s VAL 92 N 0.20 2.22 -0.19 2.92 1.01 -0.83 -0.24 120.40 125.48 2cde s VAL 92 Ca -0.11 -1.60 -0.17 0.00 0.00 0.00 0.00 61.98 60.10 2cde s VAL 92 Cb -0.15 -2.81 0.05 0.00 0.00 0.00 0.00 36.38 33.47 2cde s VAL 92 CO 0.05 0.00 0.51 -0.94 0.00 0.00 0.00 175.10 174.72 2cde s SER 93 N -4.02 -0.54 -0.78 3.32 1.04 -1.14 -0.63 113.70 110.95 2cde s SER 93 Ca 0.40 1.04 -0.25 0.00 0.48 0.00 0.00 55.95 57.61 2cde s SER 93 Cb 0.01 1.04 -0.02 0.00 0.10 0.00 0.00 66.02 67.15 2cde s SER 93 CO 0.23 -0.18 1.82 -1.81 0.98 0.00 0.00 173.24 174.27 2cde s ASP 94 N 0.35 5.38 0.00 7.02 1.11 -0.96 -3.53 116.67 126.04 2cde s ASP 94 Ca -0.01 -0.30 0.00 0.00 0.18 0.00 0.00 52.55 52.42 2cde s ASP 94 Cb -0.04 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.40 2cde s ASP 94 CO -0.00 -2.42 0.00 -2.11 1.18 0.00 0.00 175.17 171.81 2cde n ARG 95 N 9.04 0.00 0.00 8.23 1.85 -1.26 -3.84 116.66 130.68 2cde n ARG 95 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.14 2cde n ARG 95 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 2cde n ARG 95 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2cde n GLY 96 N 0.00 1.34 0.00 2.89 0.00 -1.26 -4.42 105.19 103.73 2cde n GLY 96 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2cde n GLY 96 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cde n SER 97 N 0.00 0.00 -0.01 1.61 3.41 -1.26 -0.81 113.62 116.56 2cde n SER 97 Ca 0.00 0.42 -0.02 0.00 -0.26 0.00 0.00 58.87 59.01 2cde n SER 97 Cb 0.00 -0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 63.52 2cde n SER 97 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2cde n THR 98 N -1.42 0.13 -2.67 6.66 -1.04 -1.26 -4.85 114.28 109.83 2cde n THR 98 Ca 0.00 -0.05 -0.25 0.00 -2.04 0.00 0.00 64.05 61.72 2cde n THR 98 Cb 0.07 -0.85 -0.01 0.00 -1.82 0.00 0.00 70.33 67.73 2cde n THR 98 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2cde n LEU 99 N -2.72 4.08 -3.97 -4.42 4.77 -0.87 -5.03 117.00 108.84 2cde n LEU 99 Ca -0.04 -5.18 -0.23 0.00 -0.03 0.00 0.00 56.01 50.52 2cde n LEU 99 Cb 0.54 -0.33 -0.17 0.00 -2.33 0.00 0.00 43.42 41.14 2cde n LEU 99 CO 0.02 2.20 -0.45 -0.83 -1.33 0.00 0.00 177.39 177.01 2cde s GLY 100 N -3.41 0.68 -0.06 -0.72 0.00 0.01 -4.63 107.32 99.19 2cde s GLY 100 Ca 0.46 -0.30 -0.03 0.00 0.00 0.00 0.00 44.72 44.85 2cde s GLY 100 CO -0.14 0.27 0.08 1.09 0.00 0.00 0.00 173.10 174.39 2cde s ARG 101 N 0.81 3.15 -0.17 2.90 1.70 -1.26 -4.78 118.95 121.30 2cde s ARG 101 Ca -0.12 -0.36 -0.09 0.00 -0.47 0.00 0.00 55.73 54.68 2cde s ARG 101 Cb -0.15 -2.93 -0.05 0.00 -0.57 0.00 0.00 34.95 31.25 2cde s ARG 101 CO 0.02 0.70 0.14 -0.48 -1.08 0.00 0.00 175.30 174.60 2cde s LEU 102 N -1.30 4.27 -0.25 -1.89 2.34 -1.25 -2.27 118.68 118.34 2cde s LEU 102 Ca 0.18 0.32 -0.07 0.00 0.06 0.00 0.00 54.13 54.63 2cde s LEU 102 Cb -0.12 -2.10 -0.02 0.00 -0.56 0.00 0.00 46.19 43.39 2cde s LEU 102 CO 0.08 0.25 0.05 -0.31 -1.06 0.00 0.00 176.35 175.36 2cde s TYR 103 N -0.08 3.06 0.44 3.48 1.51 0.20 -4.91 117.35 121.05 2cde s TYR 103 Ca 0.11 -0.55 -0.06 0.00 -1.01 0.00 0.00 57.07 55.55 2cde s TYR 103 Cb -0.11 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 2cde s TYR 103 CO 0.00 -0.41 0.76 -0.06 -1.11 0.00 0.00 175.55 174.73 2cde s PHE 104 N 1.58 3.53 0.19 2.71 0.40 -1.26 -1.96 117.98 123.17 2cde s PHE 104 Ca 0.06 0.84 0.04 0.00 -0.60 0.00 0.00 56.93 57.27 2cde s PHE 104 Cb -0.15 -2.31 -0.03 0.00 0.51 0.00 0.00 43.02 41.04 2cde s PHE 104 CO 0.02 -0.19 0.31 0.20 0.70 0.00 0.00 175.22 176.26 2cde s GLY 105 N -3.80 1.51 0.57 4.36 0.00 -0.72 -4.71 107.32 104.52 2cde s GLY 105 Ca 0.48 -1.12 0.38 0.00 0.00 0.00 0.00 44.72 44.46 2cde s GLY 105 CO 0.40 -1.13 2.17 3.21 0.00 0.00 0.00 173.10 177.75 2cde h ARG 106 N 1.75 0.00 0.00 2.90 3.08 -1.91 -3.43 114.38 116.77 2cde h ARG 106 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2cde h ARG 106 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 2cde h ARG 106 CO 0.65 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.96 2cde n GLY 107 N -0.97 -1.86 2.87 0.04 0.00 -1.26 -4.93 105.19 99.08 2cde n GLY 107 Ca -0.02 -1.69 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 2cde n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cde s THR 108 N 0.00 -0.48 -0.32 2.61 2.01 -1.04 -4.59 115.64 113.82 2cde s THR 108 Ca 0.00 -0.05 -0.28 0.00 0.31 0.00 0.00 61.69 61.67 2cde s THR 108 Cb 0.00 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.75 2cde s THR 108 CO 0.00 -0.13 1.96 -1.58 -0.69 0.00 0.00 174.62 174.18 2cde s GLN 109 N 2.45 3.17 -0.02 4.92 2.00 -0.73 -2.75 119.66 128.71 2cde s GLN 109 Ca 0.09 1.55 -0.17 0.00 -2.00 0.00 0.00 55.36 54.84 2cde s GLN 109 Cb -0.15 -4.28 -0.05 0.00 0.80 0.00 0.00 33.01 29.32 2cde s GLN 109 CO -0.14 -2.06 0.46 -1.17 -0.50 0.00 0.00 175.29 171.89 2cde s LEU 110 N 7.71 4.43 -0.03 3.68 2.96 0.02 -1.10 118.68 136.36 2cde s LEU 110 Ca 0.86 0.99 0.03 0.00 -0.22 0.00 0.00 54.13 55.79 2cde s LEU 110 Cb -0.25 -2.68 0.00 0.00 0.50 0.00 0.00 46.19 43.76 2cde s LEU 110 CO 0.33 0.22 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.57 2cde s THR 111 N -0.59 1.01 -0.19 3.68 2.01 -0.09 -1.72 115.64 119.74 2cde s THR 111 Ca 0.25 -0.48 0.00 0.00 0.31 0.00 0.00 61.69 61.78 2cde s THR 111 Cb -0.17 -0.88 0.04 0.00 0.01 0.00 0.00 72.50 71.50 2cde s THR 111 CO 0.14 0.30 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.60 2cde s VAL 112 N 0.15 1.45 0.35 3.82 1.01 -1.25 -0.05 120.40 125.87 2cde s VAL 112 Ca -0.03 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.11 2cde s VAL 112 Cb -0.10 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 2cde s VAL 112 CO 0.01 0.14 0.50 0.26 0.00 0.00 0.00 175.10 176.01 2cde s TRP 113 N 1.48 3.17 0.61 5.22 0.51 0.76 -4.70 118.94 125.99 2cde s TRP 113 Ca -0.01 -0.11 -0.05 0.00 -2.12 0.00 0.00 56.10 53.81 2cde s TRP 113 Cb -0.16 -2.02 0.02 0.00 -0.81 0.00 0.00 33.47 30.51 2cde s TRP 113 CO -0.08 -0.04 0.91 -1.25 -0.51 0.00 0.00 176.95 175.99 2cde s PRO 114 N -4.23 2.72 -0.27 4.98 0.04 -1.26 -2.68 135.00 134.31 2cde s PRO 114 Ca 0.45 -0.14 -0.29 0.00 0.04 0.00 0.00 61.00 61.05 2cde s PRO 114 Cb -0.10 -2.27 0.01 0.00 0.04 0.00 0.00 34.50 32.18 2cde s PRO 114 CO 0.32 -0.82 1.06 -0.51 0.04 0.00 0.00 177.00 177.09 2cde s ASP 115 N -4.36 7.03 -1.08 6.66 1.01 -1.26 -4.75 116.67 119.92 2cde s ASP 115 Ca 0.55 1.25 -0.16 0.00 0.71 0.00 0.00 52.55 54.90 2cde s ASP 115 Cb -0.11 -2.54 0.15 0.00 1.01 0.00 0.00 42.92 41.43 2cde s ASP 115 CO 0.44 -0.76 1.31 -0.63 0.21 0.00 0.00 175.17 175.75 2cde s ILE 116 N 3.39 4.83 -0.17 0.77 1.01 -1.26 -4.98 121.20 124.78 2cde s ILE 116 Ca 0.45 -2.08 -0.02 0.00 0.00 0.00 0.00 60.65 58.99 2cde s ILE 116 Cb -0.14 -4.87 -0.01 0.00 0.01 0.00 0.00 42.46 37.45 2cde s ILE 116 CO 0.10 -1.60 -0.09 -1.10 0.00 0.00 0.00 174.94 172.26 2cde s GLN 117 N 2.27 3.40 -0.52 2.79 -0.21 -1.26 -4.61 119.66 121.52 2cde s GLN 117 Ca 0.39 -0.64 -0.01 0.00 0.02 0.00 0.00 55.36 55.11 2cde s GLN 117 Cb -0.03 -2.82 -0.01 0.00 1.00 0.00 0.00 33.01 31.14 2cde s GLN 117 CO -0.04 0.03 0.44 1.63 -2.12 0.00 0.00 175.29 175.23 2cde n LYS 118 N 4.10 -2.18 -0.66 2.91 5.02 -1.26 -5.03 118.16 121.06 2cde n LYS 118 Ca -0.18 0.39 -0.30 0.00 -2.02 0.00 0.00 58.31 56.20 2cde n LYS 118 Cb 0.52 -3.81 0.27 0.00 -0.02 0.00 0.00 35.03 31.98 2cde n LYS 118 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2cde s PRO 119 N -4.20 -2.06 0.00 1.97 0.04 -1.26 -5.05 135.00 124.43 2cde s PRO 119 Ca 0.09 0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.28 2cde s PRO 119 Cb -0.01 -1.48 0.00 0.00 0.04 0.00 0.00 34.50 33.05 2cde s PRO 119 CO 0.34 -4.31 0.00 -3.47 0.04 0.00 0.00 177.00 169.60 2cde n ASP 120 N -5.23 0.00 -4.63 6.66 -0.08 -0.54 -5.06 116.55 107.67 2cde n ASP 120 Ca 0.11 0.00 -0.40 0.00 -1.51 0.00 0.00 54.79 53.00 2cde n ASP 120 Cb 0.59 0.00 0.03 0.00 2.34 0.00 0.00 41.12 44.08 2cde n ASP 120 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2cde n PRO 121 N 0.00 1.27 -3.60 -0.67 -0.04 0.91 -4.51 135.00 128.35 2cde n PRO 121 Ca 0.00 0.47 -0.06 0.00 -0.04 0.00 0.00 63.50 63.86 2cde n PRO 121 Cb 0.00 -2.16 -0.04 0.00 -0.04 0.00 0.00 33.50 31.26 2cde n PRO 121 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cde s ALA 122 N -1.37 -2.02 -0.14 0.55 0.00 -0.84 -4.97 121.76 112.98 2cde s ALA 122 Ca 0.68 1.69 0.01 0.00 0.00 0.00 0.00 51.96 54.34 2cde s ALA 122 Cb -0.49 -0.91 -0.00 0.00 0.00 0.00 0.00 23.12 21.72 2cde s ALA 122 CO 0.53 -0.33 -0.17 0.08 0.00 0.00 0.00 175.76 175.87 2cde s VAL 123 N -1.31 2.60 -0.01 0.00 1.01 -1.25 -0.08 120.40 121.35 2cde s VAL 123 Ca 0.04 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.30 2cde s VAL 123 Cb -0.01 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2cde s VAL 123 CO -0.03 0.53 -0.25 -0.31 0.00 0.00 0.00 175.10 175.03 2cde s TYR 124 N 0.67 2.36 -0.11 5.22 2.02 0.18 -4.90 117.35 122.79 2cde s TYR 124 Ca -0.08 -0.41 -0.14 0.00 -0.37 0.00 0.00 57.07 56.07 2cde s TYR 124 Cb -0.16 -1.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.86 2cde s TYR 124 CO 0.02 0.01 0.34 -1.14 -1.57 0.00 0.00 175.55 173.21 2cde s GLN 125 N -0.73 4.12 0.04 -0.62 0.74 -1.26 0.00 119.66 121.95 2cde s GLN 125 Ca 0.10 0.21 0.06 0.00 0.05 0.00 0.00 55.36 55.79 2cde s GLN 125 Cb -0.10 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.62 2cde s GLN 125 CO -0.00 0.38 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.46 2cde s LEU 126 N -0.00 2.81 0.13 3.68 1.43 0.31 -5.00 118.68 122.04 2cde s LEU 126 Ca 0.20 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2cde s LEU 126 Cb -0.14 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 2cde s LEU 126 CO 0.07 0.25 0.21 -0.13 0.23 0.00 0.00 176.35 176.98 2cde s ARG 127 N -1.55 3.23 0.23 1.70 0.52 -1.26 -3.07 118.95 118.75 2cde s ARG 127 Ca 0.16 -0.65 -0.30 0.00 -0.52 0.00 0.00 55.73 54.42 2cde s ARG 127 Cb -0.11 -2.87 -0.09 0.00 0.52 0.00 0.00 34.95 32.40 2cde s ARG 127 CO 0.07 0.53 1.28 0.34 0.02 0.00 0.00 175.30 177.55 2cde s ASP 128 N -2.96 6.92 0.23 0.23 -1.08 -1.26 -4.91 116.67 113.84 2cde s ASP 128 Ca 0.33 2.43 -0.07 0.00 -0.52 0.00 0.00 52.55 54.72 2cde s ASP 128 Cb -0.11 -2.62 0.28 0.00 -1.46 0.00 0.00 42.92 39.00 2cde s ASP 128 CO 0.26 -0.48 1.84 0.77 0.52 0.00 0.00 175.17 178.08 2cde h SER 129 N 4.85 0.74 -3.15 -0.34 4.64 -1.97 -3.39 113.55 114.93 2cde h SER 129 Ca -0.46 0.02 -0.61 0.00 -0.47 0.00 0.00 61.79 60.27 2cde h SER 129 Cb 1.22 -0.14 -0.11 0.00 -0.31 0.00 0.00 62.40 63.06 2cde h SER 129 CO 0.74 0.48 -0.46 -0.54 -0.87 0.00 0.00 176.83 176.18 2cde s LYS 130 N -6.08 4.05 -0.40 4.77 1.02 -1.26 -5.01 119.74 116.83 2cde s LYS 130 Ca -0.13 -0.16 -0.40 0.00 0.02 0.00 0.00 55.97 55.30 2cde s LYS 130 Cb 0.17 -3.37 -0.16 0.00 -0.52 0.00 0.00 37.83 33.95 2cde s LYS 130 CO 0.78 0.39 2.02 -1.13 -0.92 0.00 0.00 175.35 176.48 2cde n SER 131 N 3.21 1.63 -3.48 2.83 3.41 -1.26 -4.90 113.62 115.05 2cde n SER 131 Ca -0.16 0.73 -0.12 0.00 -0.26 0.00 0.00 58.87 59.05 2cde n SER 131 Cb 0.53 -1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 63.36 2cde n SER 131 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2cde s SER 132 N 5.61 0.45 -0.07 4.04 1.04 -1.26 -5.05 113.70 118.46 2cde s SER 132 Ca 1.10 -1.26 0.15 0.00 0.48 0.00 0.00 55.95 56.42 2cde s SER 132 Cb -1.19 0.65 0.49 0.00 0.10 0.00 0.00 66.02 66.07 2cde s SER 132 CO 0.62 -1.28 1.41 0.47 0.98 0.00 0.00 173.24 175.43 2cde n ASP 133 N -1.04 3.68 -4.76 7.02 8.00 -1.26 -4.88 116.55 123.31 2cde n ASP 133 Ca -0.01 -2.34 -0.26 0.00 0.71 0.00 0.00 54.79 52.89 2cde n ASP 133 Cb 0.62 -0.41 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 2cde n ASP 133 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2cde s LYS 134 N -1.63 2.74 0.37 -1.24 1.02 -1.26 -4.85 119.74 114.90 2cde s LYS 134 Ca 0.36 -0.96 -0.10 0.00 0.02 0.00 0.00 55.97 55.30 2cde s LYS 134 Cb 0.23 -2.54 0.03 0.00 -0.52 0.00 0.00 37.83 35.03 2cde s LYS 134 CO 0.18 0.47 0.65 -1.54 -0.92 0.00 0.00 175.35 174.18 2cde s SER 135 N -3.11 0.44 0.01 2.83 1.04 -1.26 -4.19 113.70 109.46 2cde s SER 135 Ca 0.30 -1.31 -0.01 0.00 0.48 0.00 0.00 55.95 55.41 2cde s SER 135 Cb -0.10 0.77 -0.01 0.00 0.10 0.00 0.00 66.02 66.78 2cde s SER 135 CO 0.22 -1.52 -0.00 0.68 0.98 0.00 0.00 173.24 173.60 2cde s VAL 136 N -2.63 0.09 -0.09 5.02 -7.23 -1.17 -4.46 120.40 109.93 2cde s VAL 136 Ca 0.22 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 59.63 2cde s VAL 136 Cb -0.03 -0.25 -0.03 0.00 0.56 0.00 0.00 36.38 36.63 2cde s VAL 136 CO 0.16 -0.41 -0.04 0.00 -0.31 0.00 0.00 175.10 174.50 2cde s LEU 138 N -0.59 1.79 -0.19 0.00 2.96 0.10 -1.66 118.68 121.09 2cde s LEU 138 Ca 0.09 -0.43 -0.08 0.00 -0.22 0.00 0.00 54.13 53.49 2cde s LEU 138 Cb -0.12 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 2cde s LEU 138 CO 0.02 0.05 0.09 0.12 -1.32 0.00 0.00 176.35 175.31 2cde s PHE 139 N 0.79 3.31 0.29 5.38 5.36 -0.22 0.49 117.98 133.39 2cde s PHE 139 Ca -0.11 0.17 0.01 0.00 -0.96 0.00 0.00 56.93 56.05 2cde s PHE 139 Cb -0.16 -2.10 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 2cde s PHE 139 CO 0.01 0.22 0.30 0.99 -1.46 0.00 0.00 175.22 175.29 2cde s THR 140 N 0.32 0.00 -1.35 0.12 2.01 0.88 -1.07 115.64 116.56 2cde s THR 140 Ca 0.05 -1.86 -0.10 0.00 0.31 0.00 0.00 61.69 60.09 2cde s THR 140 Cb -0.12 -2.51 0.01 0.00 0.01 0.00 0.00 72.50 69.88 2cde s THR 140 CO -0.01 0.00 0.46 0.47 -0.69 0.00 0.00 174.62 174.86 2cde n ASP 141 N -1.11 -1.73 -4.46 3.53 8.00 -1.03 -1.98 116.55 117.77 2cde n ASP 141 Ca 0.04 -1.11 -0.29 0.00 0.71 0.00 0.00 54.79 54.14 2cde n ASP 141 Cb 0.63 -2.64 -0.12 0.00 -0.02 0.00 0.00 41.12 38.98 2cde n ASP 141 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2cde s PHE 142 N -3.87 2.46 0.51 1.24 -0.12 -1.26 -0.06 117.98 116.88 2cde s PHE 142 Ca 0.18 -0.30 -0.23 0.00 -0.05 0.00 0.00 56.93 56.53 2cde s PHE 142 Cb -0.08 -1.29 -0.06 0.00 -0.63 0.00 0.00 43.02 40.96 2cde s PHE 142 CO 0.92 0.40 1.37 0.16 -0.05 0.00 0.00 175.22 178.01 2cde s ASP 143 N -2.24 5.50 0.38 1.98 1.47 -1.26 -4.63 116.67 117.88 2cde s ASP 143 Ca 0.18 2.79 0.13 0.00 1.18 0.00 0.00 52.55 56.82 2cde s ASP 143 Cb -0.10 -2.64 0.93 0.00 -0.34 0.00 0.00 42.92 40.77 2cde s ASP 143 CO 0.09 -1.41 1.85 0.28 0.68 0.00 0.00 175.17 176.66 2cde h SER 144 N 1.76 0.55 -0.07 2.11 0.02 -1.97 -0.07 113.55 115.88 2cde h SER 144 Ca -0.51 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.51 2cde h SER 144 Cb 1.29 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.77 2cde h SER 144 CO 0.59 0.24 0.35 1.56 -1.14 0.00 0.00 176.83 178.43 2cde h GLN 145 N 0.56 0.00 -6.93 3.45 4.20 -1.95 -3.41 115.11 111.03 2cde h GLN 145 Ca 0.47 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.66 2cde h GLN 145 Cb 0.94 0.00 0.08 0.00 0.30 0.00 0.00 27.48 28.80 2cde h GLN 145 CO -0.21 0.00 0.60 0.99 -0.67 0.00 0.00 178.83 179.54 2cde s THR 146 N -4.20 2.70 -0.09 -0.54 2.01 -0.04 -5.02 115.64 110.46 2cde s THR 146 Ca -0.04 0.64 0.01 0.00 0.31 0.00 0.00 61.69 62.61 2cde s THR 146 Cb 0.10 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 2cde s THR 146 CO 0.33 0.10 -0.12 0.20 -0.69 0.00 0.00 174.62 174.44 2cde s ASN 147 N -0.74 4.21 -0.54 3.53 0.01 -1.26 -5.03 114.94 115.12 2cde s ASN 147 Ca 0.55 -0.20 -0.18 0.00 -0.71 0.00 0.00 52.86 52.33 2cde s ASN 147 Cb -0.37 -1.23 0.09 0.00 0.41 0.00 0.00 41.25 40.14 2cde s ASN 147 CO 0.48 0.28 0.61 -0.69 -1.51 0.00 0.00 177.10 176.28 2cde s VAL 148 N -0.32 4.94 0.61 1.60 1.01 -1.26 -5.05 120.40 121.92 2cde s VAL 148 Ca 0.03 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.95 2cde s VAL 148 Cb -0.13 -4.36 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 2cde s VAL 148 CO 0.02 -0.91 1.24 -0.94 0.00 0.00 0.00 175.10 174.52 2cde s SER 149 N 3.15 5.01 -0.14 3.32 1.04 -1.26 -4.92 113.70 119.89 2cde s SER 149 Ca 0.11 2.49 -0.11 0.00 0.48 0.00 0.00 55.95 58.92 2cde s SER 149 Cb -0.23 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.24 2cde s SER 149 CO 0.08 -1.72 0.21 -1.10 0.98 0.00 0.00 173.24 171.69 2cde s GLN 150 N -3.32 3.94 0.06 4.02 -0.21 -1.26 -4.98 119.66 117.90 2cde s GLN 150 Ca 0.79 -0.03 -0.11 0.00 0.02 0.00 0.00 55.36 56.03 2cde s GLN 150 Cb -0.33 -3.32 -0.02 0.00 1.00 0.00 0.00 33.01 30.33 2cde s GLN 150 CO 0.36 0.48 0.56 -1.13 -2.12 0.00 0.00 175.29 173.45 2cde n SER 151 N 2.84 -0.39 0.00 5.90 3.41 -1.26 -4.70 113.62 119.42 2cde n SER 151 Ca -0.16 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2cde n SER 151 Cb 0.53 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 2cde n SER 151 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2cde n LYS 152 N -4.46 -0.86 -3.74 4.33 5.02 -1.26 -4.88 118.16 112.31 2cde n LYS 152 Ca 0.01 0.22 -0.36 0.00 -2.02 0.00 0.00 58.31 56.15 2cde n LYS 152 Cb 0.10 -4.38 -0.10 0.00 -0.02 0.00 0.00 35.03 30.62 2cde n LYS 152 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2cde s ASP 153 N -2.09 5.25 0.02 4.39 1.01 -1.26 -4.99 116.67 119.00 2cde s ASP 153 Ca 0.00 -2.47 0.01 0.00 0.71 0.00 0.00 52.55 50.80 2cde s ASP 153 Cb 0.00 -1.85 0.07 0.00 1.01 0.00 0.00 42.92 42.16 2cde s ASP 153 CO 0.00 -0.45 0.09 -0.24 0.21 0.00 0.00 175.17 174.78 2cde n SER 154 N 4.01 0.01 -0.38 0.27 2.88 -1.26 0.23 113.62 119.38 2cde n SER 154 Ca 0.03 0.10 0.13 0.00 -1.33 0.00 0.00 58.87 57.80 2cde n SER 154 Cb 0.39 -0.05 0.40 0.00 -0.75 0.00 0.00 64.21 64.21 2cde n SER 154 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2cde n ASP 155 N -3.28 1.35 -4.56 -3.46 8.00 -1.26 -4.89 116.55 108.44 2cde n ASP 155 Ca 0.02 -1.21 -0.33 0.00 0.71 0.00 0.00 54.79 53.98 2cde n ASP 155 Cb 0.07 0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.15 2cde n ASP 155 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2cde s VAL 156 N -2.28 3.51 -0.13 2.53 1.01 0.63 -4.24 120.40 121.43 2cde s VAL 156 Ca 0.30 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2cde s VAL 156 Cb 0.20 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.13 2cde s VAL 156 CO 0.44 0.54 -0.18 -0.31 0.00 0.00 0.00 175.10 175.59 2cde s TYR 157 N -0.84 2.71 -0.05 5.22 2.02 -0.33 -4.62 117.35 121.45 2cde s TYR 157 Ca 0.13 -1.05 -0.00 0.00 -0.37 0.00 0.00 57.07 55.78 2cde s TYR 157 Cb -0.11 -1.82 0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2cde s TYR 157 CO 0.03 -0.45 -0.01 0.42 -1.57 0.00 0.00 175.55 173.97 2cde s ILE 158 N 0.63 0.35 0.31 2.71 1.01 -1.26 -1.11 121.20 123.83 2cde s ILE 158 Ca -0.10 0.07 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 2cde s ILE 158 Cb -0.16 -0.47 -0.07 0.00 0.01 0.00 0.00 42.46 41.77 2cde s ILE 158 CO 0.03 0.22 0.65 0.42 0.00 0.00 0.00 174.94 176.26 2cde s THR 159 N 1.51 4.85 0.83 2.92 -4.23 -0.15 -4.74 115.64 116.62 2cde s THR 159 Ca -0.02 0.56 -0.11 0.00 -1.18 0.00 0.00 61.69 60.94 2cde s THR 159 Cb -0.13 -3.66 0.09 0.00 1.34 0.00 0.00 72.50 70.14 2cde s THR 159 CO -0.03 -0.26 1.09 -1.81 -0.54 0.00 0.00 174.62 173.08 2cde s ASP 160 N -2.68 4.02 0.43 3.99 1.01 -1.26 -4.14 116.67 118.04 2cde s ASP 160 Ca 0.49 1.64 -0.26 0.00 0.71 0.00 0.00 52.55 55.14 2cde s ASP 160 Cb -0.11 -2.34 -0.08 0.00 1.01 0.00 0.00 42.92 41.40 2cde s ASP 160 CO 0.24 -2.32 1.37 -1.59 0.21 0.00 0.00 175.17 173.08 2cde s LYS 161 N -4.93 3.82 -0.02 8.23 -2.85 -1.26 -4.66 119.74 118.06 2cde s LYS 161 Ca 0.62 2.29 0.00 0.00 -1.00 0.00 0.00 55.97 57.88 2cde s LYS 161 Cb -0.17 -2.70 0.02 0.00 -2.06 0.00 0.00 37.83 32.92 2cde s LYS 161 CO 0.56 -0.67 0.00 0.99 0.10 0.00 0.00 175.35 176.34 2cde s THR 162 N -1.23 0.13 -0.02 3.79 2.01 -0.87 -4.91 115.64 114.54 2cde s THR 162 Ca 0.59 0.09 -0.05 0.00 0.31 0.00 0.00 61.69 62.63 2cde s THR 162 Cb -0.41 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2cde s THR 162 CO 0.53 0.12 0.21 0.54 -0.69 0.00 0.00 174.62 175.33 2cde s VAL 163 N 0.91 5.39 0.06 3.82 0.11 -1.26 -2.00 120.40 127.43 2cde s VAL 163 Ca -0.09 0.03 0.05 0.00 -2.93 0.00 0.00 61.98 59.04 2cde s VAL 163 Cb -0.12 -3.53 -0.03 0.00 -1.53 0.00 0.00 36.38 31.17 2cde s VAL 163 CO -0.02 0.38 -0.14 -1.48 -3.33 0.00 0.00 175.10 170.51 2cde s LEU 164 N -1.74 2.24 -0.14 2.54 0.05 -1.06 -5.00 118.68 115.57 2cde s LEU 164 Ca 0.26 -0.55 0.02 0.00 0.05 0.00 0.00 54.13 53.90 2cde s LEU 164 Cb -0.13 -0.55 0.01 0.00 -2.05 0.00 0.00 46.19 43.47 2cde s LEU 164 CO 0.16 -0.03 -0.19 -0.62 -0.55 0.00 0.00 176.35 175.11 2cde s ASP 165 N -1.50 2.91 -1.12 1.48 2.15 -1.26 -2.18 116.67 117.15 2cde s ASP 165 Ca -0.01 -0.56 -0.11 0.00 0.43 0.00 0.00 52.55 52.31 2cde s ASP 165 Cb -0.09 -1.34 0.25 0.00 -0.30 0.00 0.00 42.92 41.44 2cde s ASP 165 CO 0.02 0.04 1.17 -0.04 -0.17 0.00 0.00 175.17 176.19 2cde s MET 166 N 0.97 4.14 0.22 4.34 -1.94 0.19 -4.90 119.30 122.32 2cde s MET 166 Ca -0.05 -3.00 -0.14 0.00 -1.71 0.00 0.00 55.69 50.79 2cde s MET 166 Cb -0.15 -4.68 0.26 0.00 2.01 0.00 0.00 34.83 32.27 2cde s MET 166 CO -0.04 -1.38 1.59 0.00 -0.01 0.00 0.00 175.02 175.18 2cde h ARG 167 N 6.88 -0.04 -0.93 2.03 3.08 -1.95 0.28 114.38 123.73 2cde h ARG 167 Ca 0.21 0.00 0.28 0.00 0.07 0.00 0.00 59.98 60.54 2cde h ARG 167 Cb 0.89 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 30.79 2cde h ARG 167 CO 1.06 -0.03 0.25 0.66 -1.07 0.00 0.00 179.97 180.84 2cde h SER 168 N -0.05 -0.03 -0.17 7.04 4.64 -1.96 0.37 113.55 123.40 2cde h SER 168 Ca 0.33 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 2cde h SER 168 Cb 0.56 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2cde h SER 168 CO -0.78 -0.24 0.00 0.23 -0.87 0.00 0.00 176.83 175.17 2cde n MET 169 N -5.28 2.23 -3.80 4.77 2.81 -0.01 -4.96 117.12 112.87 2cde n MET 169 Ca 0.25 -1.99 -0.27 0.00 -1.81 0.00 0.00 57.70 53.87 2cde n MET 169 Cb 0.81 -1.45 0.04 0.00 -0.71 0.00 0.00 33.22 31.91 2cde n MET 169 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2cde n ASP 170 N 1.31 -4.68 -4.33 7.83 -0.08 0.13 -4.97 116.55 111.76 2cde n ASP 170 Ca 0.15 -0.72 -0.30 0.00 -1.51 0.00 0.00 54.79 52.41 2cde n ASP 170 Cb 0.57 -4.21 -0.15 0.00 2.34 0.00 0.00 41.12 39.67 2cde n ASP 170 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 2cde s PHE 171 N -3.35 2.28 -0.07 -0.67 5.36 -0.89 -4.98 117.98 115.66 2cde s PHE 171 Ca 0.55 -0.42 -0.00 0.00 -0.96 0.00 0.00 56.93 56.10 2cde s PHE 171 Cb -0.27 -1.39 0.03 0.00 -0.34 0.00 0.00 43.02 41.05 2cde s PHE 171 CO 0.80 0.09 -0.02 0.15 -1.46 0.00 0.00 175.22 174.78 2cde s LYS 172 N -1.09 0.79 -0.03 10.12 1.02 -1.26 0.57 119.74 129.86 2cde s LYS 172 Ca 0.11 -0.01 0.02 0.00 0.02 0.00 0.00 55.97 56.11 2cde s LYS 172 Cb -0.10 -1.00 0.01 0.00 -0.52 0.00 0.00 37.83 36.22 2cde s LYS 172 CO 0.01 -0.23 -0.07 -1.54 -0.92 0.00 0.00 175.35 172.61 2cde s SER 173 N 1.59 0.99 0.73 2.83 1.04 -0.93 -4.98 113.70 114.98 2cde s SER 173 Ca -0.00 -0.15 -0.09 0.00 0.48 0.00 0.00 55.95 56.19 2cde s SER 173 Cb -0.13 -0.29 0.06 0.00 0.10 0.00 0.00 66.02 65.76 2cde s SER 173 CO -0.04 0.03 1.07 0.20 0.98 0.00 0.00 173.24 175.48 2cde s ASN 174 N 0.31 4.78 -0.30 7.02 0.01 -1.26 -2.57 114.94 122.93 2cde s ASN 174 Ca -0.04 0.60 -0.21 0.00 -0.71 0.00 0.00 52.86 52.50 2cde s ASN 174 Cb -0.09 -1.23 0.21 0.00 0.41 0.00 0.00 41.25 40.55 2cde s ASN 174 CO 0.00 -1.66 1.41 -0.94 -1.51 0.00 0.00 177.10 174.40 2cde s SER 175 N -4.52 -0.01 0.08 -1.22 1.04 -0.85 -2.47 113.70 105.76 2cde s SER 175 Ca 0.60 0.01 0.09 0.00 0.48 0.00 0.00 55.95 57.14 2cde s SER 175 Cb -0.11 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 2cde s SER 175 CO 0.46 -0.00 -0.25 0.00 0.98 0.00 0.00 173.24 174.43 2cde s ALA 176 N 0.43 2.17 0.37 5.32 0.00 -0.23 -2.06 121.76 127.76 2cde s ALA 176 Ca 0.01 -1.31 0.08 0.00 0.00 0.00 0.00 51.96 50.75 2cde s ALA 176 Cb -0.04 -0.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.63 2cde s ALA 176 CO -0.14 0.49 0.01 0.08 0.00 0.00 0.00 175.76 176.21 2cde s VAL 177 N -0.95 2.35 0.02 0.00 1.01 -1.26 -1.05 120.40 120.52 2cde s VAL 177 Ca 0.11 -1.99 -0.28 0.00 0.00 0.00 0.00 61.98 59.83 2cde s VAL 177 Cb -0.10 -2.84 0.08 0.00 0.00 0.00 0.00 36.38 33.52 2cde s VAL 177 CO 0.04 -0.12 0.70 0.00 0.00 0.00 0.00 175.10 175.71 2cde s ALA 178 N -2.59 -1.73 0.06 5.51 0.00 -0.67 -0.98 121.76 121.36 2cde s ALA 178 Ca 0.35 1.03 -0.27 0.00 0.00 0.00 0.00 51.96 53.07 2cde s ALA 178 Cb 0.03 0.28 0.09 0.00 0.00 0.00 0.00 23.12 23.52 2cde s ALA 178 CO 0.19 -0.53 0.83 1.67 0.00 0.00 0.00 175.76 177.92 2cde s TRP 179 N -2.23 -0.35 0.00 0.00 -2.14 -0.27 -1.46 118.94 112.49 2cde s TRP 179 Ca -0.05 0.17 0.00 0.00 2.66 0.00 0.00 56.10 58.89 2cde s TRP 179 Cb -0.00 0.56 0.00 0.00 -3.10 0.00 0.00 33.47 30.93 2cde s TRP 179 CO -0.00 -0.66 0.00 0.45 -2.66 0.00 0.00 176.95 174.08 2cde n SER 180 N -0.31 0.00 -3.01 -2.66 2.88 -1.26 -1.18 113.62 108.08 2cde n SER 180 Ca -0.10 -0.82 -0.38 0.00 -1.33 0.00 0.00 58.87 56.24 2cde n SER 180 Cb 0.62 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.11 2cde n SER 180 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2cde n ASN 181 N -1.99 6.97 -0.25 -3.46 4.13 -1.26 -4.80 115.26 114.60 2cde n ASN 181 Ca 0.00 -3.78 0.00 0.00 1.68 0.00 0.00 54.58 52.48 2cde n ASN 181 Cb 0.00 -0.98 0.00 0.00 -1.54 0.00 0.00 39.78 37.26 2cde n ASN 181 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 2cde n LYS 182 N -0.42 0.00 0.00 3.52 4.81 -1.26 -4.99 118.16 119.83 2cde n LYS 182 Ca 0.49 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 2cde n LYS 182 Cb 0.30 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.35 2cde n LYS 182 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2cde n SER 183 N -2.02 0.00 -3.31 3.14 7.64 -1.26 -4.33 113.62 113.48 2cde n SER 183 Ca 0.00 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.61 2cde n SER 183 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2cde n SER 183 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2cde n ASP 184 N 6.20 3.70 -4.04 6.43 8.00 -1.26 -4.84 116.55 130.74 2cde n ASP 184 Ca 0.00 -2.41 -0.23 0.00 0.71 0.00 0.00 54.79 52.86 2cde n ASP 184 Cb 0.00 -1.04 -0.16 0.00 -0.02 0.00 0.00 41.12 39.90 2cde n ASP 184 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2cde s PHE 185 N 4.11 1.29 -0.26 1.24 5.36 -1.26 -5.09 117.98 123.37 2cde s PHE 185 Ca 0.42 -0.39 -0.22 0.00 -0.96 0.00 0.00 56.93 55.79 2cde s PHE 185 Cb 0.11 -0.92 0.07 0.00 -0.34 0.00 0.00 43.02 41.94 2cde s PHE 185 CO 0.02 -0.17 0.68 0.00 -1.46 0.00 0.00 175.22 174.29 2cde s ALA 186 N 0.33 -1.71 -0.04 11.12 0.00 -1.26 -5.02 121.76 125.18 2cde s ALA 186 Ca -0.07 2.01 0.16 0.00 0.00 0.00 0.00 51.96 54.06 2cde s ALA 186 Cb -0.12 -1.17 0.86 0.00 0.00 0.00 0.00 23.12 22.69 2cde s ALA 186 CO 0.02 -0.33 1.41 0.00 0.00 0.00 0.00 175.76 176.86 2cde h ALA 188 N 1.44 -0.22 -0.26 0.00 0.00 -1.99 -3.33 119.26 114.91 2cde h ALA 188 Ca 0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2cde h ALA 188 Cb 0.42 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2cde h ALA 188 CO 0.00 -0.26 -0.27 -0.91 0.00 0.00 0.00 179.25 177.81 2cde h ASN 189 N -0.93 0.51 -4.25 0.00 2.35 -1.86 -3.44 115.58 107.96 2cde h ASN 189 Ca -0.02 -0.18 -0.52 0.00 -0.55 0.00 0.00 56.30 55.03 2cde h ASN 189 Cb 0.48 -0.14 0.18 0.00 0.05 0.00 0.00 38.32 38.90 2cde h ASN 189 CO 0.04 0.77 0.24 0.00 -1.65 0.00 0.00 177.43 176.82 2cde s ALA 190 N -4.46 1.58 -1.53 -0.83 0.00 -1.03 -2.95 121.76 112.53 2cde s ALA 190 Ca -0.07 0.50 -0.14 0.00 0.00 0.00 0.00 51.96 52.26 2cde s ALA 190 Cb 0.14 -3.41 0.09 0.00 0.00 0.00 0.00 23.12 19.94 2cde s ALA 190 CO 0.80 -2.59 0.89 1.19 0.00 0.00 0.00 175.76 176.05 2cde n PHE 191 N -4.11 -2.16 -3.38 0.00 3.01 -1.26 -4.90 117.46 104.65 2cde n PHE 191 Ca 0.11 0.83 -0.45 0.00 1.01 0.00 0.00 57.45 58.94 2cde n PHE 191 Cb 0.52 -3.74 -0.04 0.00 -0.01 0.00 0.00 39.48 36.22 2cde n PHE 191 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 2cde s ASN 192 N -3.20 6.38 0.00 4.37 -0.87 -1.15 -5.06 114.94 115.41 2cde s ASN 192 Ca 0.64 -2.42 0.00 0.00 -1.57 0.00 0.00 52.86 49.51 2cde s ASN 192 Cb -0.32 -2.16 0.00 0.00 -0.02 0.00 0.00 41.25 38.75 2cde s ASN 192 CO 0.78 -0.63 0.00 0.59 -2.57 0.00 0.00 177.10 175.27