#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 0.02 -0.00 3.52 -0.21 -1.25 -4.98 119.66 116.76 2cde s GLN 3 Ca 0.00 0.31 0.05 0.00 0.02 0.00 0.00 55.36 55.74 2cde s GLN 3 Cb 0.00 -0.53 -0.03 0.00 1.00 0.00 0.00 33.01 33.46 2cde s GLN 3 CO 0.00 -0.30 -0.15 0.14 -2.12 0.00 0.00 175.29 172.87 2cde s VAL 4 N 1.94 3.03 -0.24 1.09 -7.23 -1.26 -0.79 120.40 116.95 2cde s VAL 4 Ca 0.02 -0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 59.26 2cde s VAL 4 Cb -0.12 -2.25 0.07 0.00 0.56 0.00 0.00 36.38 34.64 2cde s VAL 4 CO -0.03 0.45 0.01 -1.61 -0.31 0.00 0.00 175.10 173.61 2cde s GLU 5 N -1.15 1.12 0.00 4.82 2.02 0.15 -4.78 118.70 120.88 2cde s GLU 5 Ca 0.14 -0.84 -0.17 0.00 0.02 0.00 0.00 54.97 54.12 2cde s GLU 5 Cb -0.11 -2.34 -0.06 0.00 0.10 0.00 0.00 34.13 31.72 2cde s GLU 5 CO 0.04 -0.70 0.47 -0.65 0.02 0.00 0.00 175.26 174.44 2cde s GLN 6 N 1.58 4.08 0.02 1.61 -0.21 -1.26 -1.87 119.66 123.60 2cde s GLN 6 Ca -0.01 0.52 0.01 0.00 0.02 0.00 0.00 55.36 55.91 2cde s GLN 6 Cb -0.18 -3.26 -0.01 0.00 1.00 0.00 0.00 33.01 30.56 2cde s GLN 6 CO -0.10 0.59 -0.04 -1.54 -2.12 0.00 0.00 175.29 172.08 2cde s SER 7 N -0.82 0.44 0.00 5.90 1.04 -0.66 -4.63 113.70 114.97 2cde s SER 7 Ca 0.26 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.34 2cde s SER 7 Cb -0.17 0.03 0.00 0.00 0.10 0.00 0.00 66.02 65.98 2cde s SER 7 CO 0.15 -0.15 0.00 -0.81 0.98 0.00 0.00 173.24 173.41 2cde n PRO 8 N 2.09 2.38 -0.08 4.02 -0.04 -1.26 -1.20 135.00 140.91 2cde n PRO 8 Ca -0.19 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.15 2cde n PRO 8 Cb 0.56 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.95 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 0.00 0.40 -3.75 0.54 1.13 -1.26 -4.66 117.38 109.78 2cde n GLN 9 Ca 0.00 0.10 -0.13 0.00 -1.94 0.00 0.00 57.00 55.02 2cde n GLN 9 Cb 0.00 -1.31 -0.09 0.00 0.11 0.00 0.00 30.24 28.94 2cde n GLN 9 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2cde s SER 10 N -5.60 -0.30 0.03 1.08 1.04 -1.26 -2.10 113.70 106.58 2cde s SER 10 Ca -0.22 0.44 -0.06 0.00 0.48 0.00 0.00 55.95 56.59 2cde s SER 10 Cb 0.06 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 2cde s SER 10 CO 0.37 -0.29 0.11 -0.22 0.98 0.00 0.00 173.24 174.19 2cde s LEU 11 N -0.55 1.72 -0.02 2.42 2.96 0.29 -4.90 118.68 120.61 2cde s LEU 11 Ca -0.07 -0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 53.42 2cde s LEU 11 Cb -0.04 0.62 0.01 0.00 0.50 0.00 0.00 46.19 47.29 2cde s LEU 11 CO 0.03 -0.45 0.04 -0.63 -1.32 0.00 0.00 176.35 174.01 2cde s ILE 12 N -2.14 -0.02 0.09 6.68 1.01 -1.26 -0.20 121.20 125.37 2cde s ILE 12 Ca -0.09 0.06 -0.25 0.00 0.00 0.00 0.00 60.65 60.37 2cde s ILE 12 Cb -0.04 -0.07 0.08 0.00 0.01 0.00 0.00 42.46 42.44 2cde s ILE 12 CO -0.02 0.03 0.68 -0.51 0.00 0.00 0.00 174.94 175.11 2cde s ILE 13 N 0.33 0.00 0.66 2.92 2.07 -0.05 -4.94 121.20 122.19 2cde s ILE 13 Ca -0.03 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.12 2cde s ILE 13 Cb -0.04 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.56 2cde s ILE 13 CO -0.01 0.00 1.02 -0.76 -1.91 0.00 0.00 174.94 173.28 2cde s LEU 14 N -2.43 3.03 0.49 8.50 1.43 -1.26 -1.08 118.68 127.36 2cde s LEU 14 Ca 0.00 1.00 -0.23 0.00 -1.03 0.00 0.00 54.13 53.87 2cde s LEU 14 Cb -0.01 -3.82 -0.08 0.00 0.03 0.00 0.00 46.19 42.32 2cde s LEU 14 CO -0.09 -1.22 1.21 -1.84 0.23 0.00 0.00 176.35 174.65 2cde n GLU 15 N -2.85 1.62 0.00 1.70 0.28 -1.07 -3.39 120.64 116.94 2cde n GLU 15 Ca 0.06 0.59 0.00 0.00 -0.16 0.00 0.00 57.16 57.65 2cde n GLU 15 Cb 0.57 -2.36 0.00 0.00 1.43 0.00 0.00 31.44 31.08 2cde n GLU 15 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2cde n GLY 16 N 0.92 2.00 3.63 -1.84 0.00 0.58 -4.79 105.19 105.68 2cde n GLY 16 Ca 0.09 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 2cde n GLY 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cde n LYS 17 N 0.00 0.26 -3.19 1.61 5.02 -1.22 -2.58 118.16 118.06 2cde n LYS 17 Ca 0.00 0.15 -0.24 0.00 -2.02 0.00 0.00 58.31 56.20 2cde n LYS 17 Cb 0.00 -2.27 -0.01 0.00 -0.02 0.00 0.00 35.03 32.73 2cde n LYS 17 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2cde s ASN 18 N -1.90 6.19 -0.05 4.39 0.01 -1.26 -1.28 114.94 121.04 2cde s ASN 18 Ca 0.71 0.48 -0.31 0.00 -0.71 0.00 0.00 52.86 53.04 2cde s ASN 18 Cb -0.31 -1.96 0.07 0.00 0.41 0.00 0.00 41.25 39.47 2cde s ASN 18 CO 0.53 -0.42 0.69 0.00 -1.51 0.00 0.00 177.10 176.38 2cde s THR 20 N -1.28 -0.04 0.23 0.00 2.01 -1.25 0.24 115.64 115.55 2cde s THR 20 Ca -0.10 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.12 2cde s THR 20 Cb -0.00 -0.07 -0.04 0.00 0.01 0.00 0.00 72.50 72.40 2cde s THR 20 CO 0.09 0.06 0.19 -0.76 -0.69 0.00 0.00 174.62 173.51 2cde s LEU 21 N 0.76 3.83 0.18 4.42 1.43 0.14 -4.84 118.68 124.60 2cde s LEU 21 Ca -0.06 -0.21 0.11 0.00 -1.03 0.00 0.00 54.13 52.94 2cde s LEU 21 Cb -0.09 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 2cde s LEU 21 CO -0.02 -0.01 -0.24 -1.10 0.23 0.00 0.00 176.35 175.21 2cde s GLN 22 N -3.66 1.47 -0.03 1.70 -0.21 -0.34 -0.32 119.66 118.27 2cde s GLN 22 Ca 0.32 -1.47 -0.02 0.00 0.02 0.00 0.00 55.36 54.21 2cde s GLN 22 Cb -0.08 -1.80 0.01 0.00 1.00 0.00 0.00 33.01 32.14 2cde s GLN 22 CO 0.25 0.40 0.07 0.00 -2.12 0.00 0.00 175.29 173.89 2cde s ASN 24 N 0.21 0.56 0.12 0.00 -0.87 -0.78 -0.12 114.94 114.06 2cde s ASN 24 Ca -0.01 -1.14 -0.15 0.00 -1.57 0.00 0.00 52.86 49.98 2cde s ASN 24 Cb -0.02 0.23 0.05 0.00 -0.02 0.00 0.00 41.25 41.49 2cde s ASN 24 CO -0.01 -0.65 0.73 0.00 -2.57 0.00 0.00 177.10 174.60 2cde n TYR 25 N -0.07 -1.08 -3.32 2.20 0.18 -1.23 0.30 117.16 114.14 2cde n TYR 25 Ca -0.08 -0.87 -0.26 0.00 1.88 0.00 0.00 57.90 58.57 2cde n TYR 25 Cb 0.63 0.42 -0.09 0.00 -0.38 0.00 0.00 39.34 39.92 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 -0.51 -0.97 -5.17 -3.48 -1.04 0.03 -4.96 114.28 98.17 2cde n THR 26 Ca -0.01 -3.67 -0.29 0.00 -2.04 0.00 0.00 64.05 58.04 2cde n THR 26 Cb 0.41 -1.77 -0.16 0.00 -1.82 0.00 0.00 70.33 66.98 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 -0.43 1.85 0.04 12.58 -7.23 -1.26 -2.84 120.40 123.11 2cde s VAL 27 Ca 0.34 -1.00 -0.19 0.00 -1.81 0.00 0.00 61.98 59.32 2cde s VAL 27 Cb 0.09 -1.54 -0.09 0.00 0.56 0.00 0.00 36.38 35.40 2cde s VAL 27 CO -0.17 0.52 1.29 0.77 -0.31 0.00 0.00 175.10 177.21 2cde h SER 28 N 5.55 -0.71 -2.42 4.85 4.64 -1.99 -3.44 113.55 120.03 2cde h SER 28 Ca -0.41 0.05 -0.62 0.00 -0.47 0.00 0.00 61.79 60.35 2cde h SER 28 Cb 1.13 0.23 -0.15 0.00 -0.31 0.00 0.00 62.40 63.30 2cde h SER 28 CO 0.47 -0.36 -0.76 -2.16 -0.87 0.00 0.00 176.83 173.15 2cde s PRO 29 N -4.48 1.71 0.23 4.77 0.04 -1.26 -5.13 135.00 130.87 2cde s PRO 29 Ca -0.09 -1.68 0.04 0.00 0.04 0.00 0.00 61.00 59.31 2cde s PRO 29 Cb 0.02 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.68 2cde s PRO 29 CO 0.31 0.35 -0.03 -0.06 0.04 0.00 0.00 177.00 177.61 2cde s PHE 30 N -2.31 1.60 0.00 0.56 0.40 -1.26 -4.09 117.98 112.88 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 -0.91 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2cde s PHE 30 CO 0.14 0.04 0.00 -1.13 0.70 0.00 0.00 175.22 174.97 2cde n SER 31 N -0.42 0.00 -3.95 1.36 3.41 -1.23 -4.50 113.62 108.29 2cde n SER 31 Ca -0.06 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.26 2cde n SER 31 Cb 0.63 0.23 -0.16 0.00 -0.26 0.00 0.00 64.21 64.65 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 -1.48 3.13 -0.12 4.04 -0.87 -1.25 -3.88 114.94 114.51 2cde s ASN 32 Ca 0.00 -0.78 -0.04 0.00 -1.57 0.00 0.00 52.86 50.48 2cde s ASN 32 Cb 0.00 -1.09 -0.03 0.00 -0.02 0.00 0.00 41.25 40.10 2cde s ASN 32 CO 0.00 -0.16 0.02 -0.22 -2.57 0.00 0.00 177.10 174.17 2cde s LEU 33 N 1.50 3.67 0.05 0.60 2.96 -0.02 -2.55 118.68 124.89 2cde s LEU 33 Ca -0.00 0.13 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 2cde s LEU 33 Cb -0.16 -1.87 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 2cde s LEU 33 CO -0.08 0.32 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.10 2cde s ARG 34 N -0.50 0.54 -0.03 1.98 0.52 0.28 -0.42 118.95 121.33 2cde s ARG 34 Ca 0.09 -1.01 0.03 0.00 -0.52 0.00 0.00 55.73 54.32 2cde s ARG 34 Cb -0.12 0.08 -0.00 0.00 0.52 0.00 0.00 34.95 35.43 2cde s ARG 34 CO 0.02 -0.07 -0.12 -1.58 0.02 0.00 0.00 175.30 173.57 2cde s TRP 35 N -2.93 1.23 -0.04 -0.53 0.52 -1.15 0.15 118.94 116.20 2cde s TRP 35 Ca -0.01 -0.32 0.07 0.00 0.02 0.00 0.00 56.10 55.86 2cde s TRP 35 Cb 0.01 -0.85 -0.02 0.00 -1.15 0.00 0.00 33.47 31.46 2cde s TRP 35 CO -0.06 -0.11 -0.25 0.71 0.02 0.00 0.00 176.95 177.26 2cde s TYR 36 N 0.10 2.39 -0.37 -1.98 1.51 0.30 -2.39 117.35 116.90 2cde s TYR 36 Ca -0.03 -0.55 -0.11 0.00 -1.01 0.00 0.00 57.07 55.37 2cde s TYR 36 Cb -0.09 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.23 2cde s TYR 36 CO 0.01 -0.11 0.21 0.21 -1.11 0.00 0.00 175.55 174.76 2cde s LYS 37 N -0.42 2.91 -0.17 -0.62 2.20 0.24 0.14 119.74 124.01 2cde s LYS 37 Ca 0.04 -1.03 -0.02 0.00 -0.36 0.00 0.00 55.97 54.60 2cde s LYS 37 Cb -0.12 -3.73 -0.01 0.00 -1.51 0.00 0.00 37.83 32.46 2cde s LYS 37 CO 0.01 -0.67 -0.08 -1.14 -0.36 0.00 0.00 175.35 173.11 2cde s GLN 38 N 1.57 3.44 0.09 4.03 0.74 0.17 -0.58 119.66 129.12 2cde s GLN 38 Ca 0.03 -0.63 -0.06 0.00 0.05 0.00 0.00 55.36 54.75 2cde s GLN 38 Cb -0.19 -2.83 -0.05 0.00 1.10 0.00 0.00 33.01 31.04 2cde s GLN 38 CO 0.07 0.06 0.34 -0.51 -0.55 0.00 0.00 175.29 174.70 2cde s ASP 39 N 0.79 6.51 -0.35 6.67 1.11 -1.26 -2.10 116.67 128.04 2cde s ASP 39 Ca -0.03 0.60 -0.44 0.00 0.18 0.00 0.00 52.55 52.86 2cde s ASP 39 Cb -0.15 -2.10 -0.19 0.00 1.07 0.00 0.00 42.92 41.56 2cde s ASP 39 CO 0.01 0.14 1.54 0.41 1.18 0.00 0.00 175.17 178.46 2cde n THR 40 N 0.53 0.07 0.00 -1.27 -1.04 -1.26 -0.33 114.28 110.98 2cde n THR 40 Ca -0.06 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2cde n THR 40 Cb 0.52 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 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 3.62 1.38 3.79 3.41 0.00 -1.26 -4.98 105.19 111.14 2cde n GLY 41 Ca 0.28 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 4.28 0.30 1.61 0.52 0.55 -5.00 118.95 121.21 2cde s ARG 42 Ca 0.00 1.39 -0.30 0.00 -0.52 0.00 0.00 55.73 56.31 2cde s ARG 42 Cb 0.00 -2.54 -0.11 0.00 0.52 0.00 0.00 34.95 32.82 2cde s ARG 42 CO 0.00 -0.02 1.51 0.20 0.02 0.00 0.00 175.30 177.02 2cde s GLY 43 N -1.69 2.38 0.31 -3.53 0.00 -1.26 -3.98 107.32 99.54 2cde s GLY 43 Ca 0.57 1.48 -0.30 0.00 0.00 0.00 0.00 44.72 46.47 2cde s GLY 43 CO 0.24 2.38 1.56 -1.55 0.00 0.00 0.00 173.10 175.73 2cde n PRO 44 N 1.82 2.65 -3.58 2.90 -0.04 -1.26 -4.65 135.00 132.84 2cde n PRO 44 Ca 0.06 0.94 -0.34 0.00 -0.04 0.00 0.00 63.50 64.12 2cde n PRO 44 Cb 0.39 -2.70 -0.05 0.00 -0.04 0.00 0.00 33.50 31.09 2cde n PRO 44 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2cde s VAL 45 N -0.22 5.10 -0.29 0.52 1.01 0.25 -4.88 120.40 121.89 2cde s VAL 45 Ca 0.62 0.37 -0.18 0.00 0.00 0.00 0.00 61.98 62.79 2cde s VAL 45 Cb -0.50 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2cde s VAL 45 CO 0.51 0.21 0.53 -0.94 0.00 0.00 0.00 175.10 175.42 2cde s SER 46 N -1.94 6.41 -0.23 3.32 1.04 -1.26 -0.59 113.70 120.45 2cde s SER 46 Ca 0.36 0.38 -0.08 0.00 0.48 0.00 0.00 55.95 57.08 2cde s SER 46 Cb -0.13 -2.29 -0.18 0.00 0.10 0.00 0.00 66.02 63.53 2cde s SER 46 CO 0.20 -0.36 -0.09 0.18 0.98 0.00 0.00 173.24 174.14 2cde n LEU 47 N 5.65 2.42 -3.78 2.42 4.77 -1.01 -4.98 117.00 122.49 2cde n LEU 47 Ca -0.04 0.16 -0.12 0.00 -0.03 0.00 0.00 56.01 55.99 2cde n LEU 47 Cb 0.49 -0.93 -0.08 0.00 -2.33 0.00 0.00 43.42 40.57 2cde n LEU 47 CO 0.42 0.71 -0.01 -0.89 -1.33 0.00 0.00 177.39 176.29 2cde s THR 48 N -2.50 0.08 -0.12 -5.08 2.01 -1.25 -4.90 115.64 103.89 2cde s THR 48 Ca -0.33 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 60.94 2cde s THR 48 Cb 0.10 -0.85 0.05 0.00 0.01 0.00 0.00 72.50 71.80 2cde s THR 48 CO 0.60 -0.38 0.06 -0.63 -0.69 0.00 0.00 174.62 173.58 2cde s ILE 49 N -2.29 0.02 0.20 1.82 1.01 -1.26 -2.92 121.20 117.78 2cde s ILE 49 Ca -0.07 0.04 0.05 0.00 0.00 0.00 0.00 60.65 60.67 2cde s ILE 49 Cb -0.02 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 41.95 2cde s ILE 49 CO -0.02 -0.05 0.22 -0.04 0.00 0.00 0.00 174.94 175.05 2cde s MET 50 N 2.10 3.08 0.00 2.79 -1.94 0.44 -4.87 119.30 120.91 2cde s MET 50 Ca 0.03 -0.87 0.00 0.00 -1.71 0.00 0.00 55.69 53.14 2cde s MET 50 Cb -0.14 -2.71 0.00 0.00 2.01 0.00 0.00 34.83 33.99 2cde s MET 50 CO -0.06 0.45 0.00 2.41 -0.01 0.00 0.00 175.02 177.81 2cde n THR 51 N -0.84 0.00 0.00 2.05 -1.04 -1.25 -0.84 114.28 112.36 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 -2.60 -1.42 3.01 -1.26 -3.58 117.46 111.61 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 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 2cde n PHE 52 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2cde n SER 53 N -0.91 4.98 -1.29 4.37 3.41 -1.26 -4.96 113.62 117.95 2cde n SER 53 Ca 0.00 -2.98 0.00 0.00 -0.26 0.00 0.00 58.87 55.63 2cde n SER 53 Cb 0.00 -1.61 0.00 0.00 -0.26 0.00 0.00 64.21 62.35 2cde n SER 53 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2cde n GLU 54 N 6.02 2.84 0.00 4.33 0.28 -1.23 -4.77 120.64 128.11 2cde n GLU 54 Ca 0.42 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.42 2cde n GLU 54 Cb 0.42 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.29 2cde n GLU 54 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2cde n ASN 55 N 0.00 0.00 -4.72 -1.84 4.13 -1.24 -4.72 115.26 106.87 2cde n ASN 55 Ca 0.00 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 55.99 2cde n ASN 55 Cb 0.00 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.17 2cde n ASN 55 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2cde s THR 56 N 0.00 4.06 -0.28 3.41 2.01 -1.26 -2.58 115.64 120.99 2cde s THR 56 Ca 0.00 -1.23 0.20 0.00 0.31 0.00 0.00 61.69 60.97 2cde s THR 56 Cb 0.00 -3.04 0.48 0.00 0.01 0.00 0.00 72.50 69.95 2cde s THR 56 CO 0.00 -0.08 1.23 0.29 -0.69 0.00 0.00 174.62 175.37 2cde n LYS 57 N -0.11 1.62 -1.47 4.92 5.02 -1.24 -5.00 118.16 121.89 2cde n LYS 57 Ca -0.09 -2.89 -0.43 0.00 -2.02 0.00 0.00 58.31 52.88 2cde n LYS 57 Cb 0.54 -1.05 -0.00 0.00 -0.02 0.00 0.00 35.03 34.50 2cde n LYS 57 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2cde n SER 58 N -0.85 -0.47 -3.66 4.39 3.41 -1.26 -4.56 113.62 110.63 2cde n SER 58 Ca 0.00 1.01 -0.16 0.00 -0.26 0.00 0.00 58.87 59.46 2cde n SER 58 Cb 0.82 -1.12 -0.15 0.00 -0.26 0.00 0.00 64.21 63.50 2cde n SER 58 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2cde s ASN 59 N -0.86 0.73 1.50 4.04 -0.87 -0.20 -4.99 114.94 114.28 2cde s ASN 59 Ca 0.62 0.34 0.00 0.00 -1.57 0.00 0.00 52.86 52.26 2cde s ASN 59 Cb -0.68 0.35 0.00 0.00 -0.02 0.00 0.00 41.25 40.90 2cde s ASN 59 CO 0.58 -0.25 0.00 0.61 -2.57 0.00 0.00 177.10 175.47 2cde n GLY 60 N 5.33 3.29 0.07 0.66 0.00 -1.26 -1.27 105.19 112.00 2cde n GLY 60 Ca -0.05 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.87 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 13.97 0.32 -3.02 1.61 1.74 -1.26 -4.84 116.66 125.19 2cde n ARG 61 Ca 0.00 -0.14 -0.39 0.00 -0.77 0.00 0.00 57.85 56.55 2cde n ARG 61 Cb 0.00 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 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 -2.77 3.88 -0.17 -1.55 4.12 -0.40 -0.26 117.35 120.20 2cde s TYR 62 Ca 0.19 1.58 -0.03 0.00 0.02 0.00 0.00 57.07 58.83 2cde s TYR 62 Cb 0.19 -2.73 0.06 0.00 -1.52 0.00 0.00 41.96 37.96 2cde s TYR 62 CO 0.57 0.52 0.04 0.99 0.02 0.00 0.00 175.55 177.68 2cde s THR 63 N -1.17 0.40 0.53 -0.71 2.01 0.30 -1.03 115.64 115.97 2cde s THR 63 Ca 0.35 -0.39 -0.07 0.00 0.31 0.00 0.00 61.69 61.90 2cde s THR 63 Cb -0.22 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 2cde s THR 63 CO 0.25 -0.15 0.86 0.00 -0.69 0.00 0.00 174.62 174.89 2cde s ALA 64 N 1.92 3.31 -0.21 7.40 0.00 -1.26 0.23 121.76 133.16 2cde s ALA 64 Ca 0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 2cde s ALA 64 Cb -0.16 -2.71 0.10 0.00 0.00 0.00 0.00 23.12 20.36 2cde s ALA 64 CO -0.08 -0.51 0.37 0.99 0.00 0.00 0.00 175.76 176.54 2cde s THR 65 N -2.89 -0.59 -0.17 0.00 2.01 0.21 -3.70 115.64 110.52 2cde s THR 65 Ca 0.50 0.08 -0.08 0.00 0.31 0.00 0.00 61.69 62.50 2cde s THR 65 Cb -0.10 -0.70 -0.04 0.00 0.01 0.00 0.00 72.50 71.66 2cde s THR 65 CO 0.47 -0.01 0.11 -0.22 -0.69 0.00 0.00 174.62 174.28 2cde s LEU 66 N 2.55 4.11 0.53 4.42 2.96 -1.07 0.39 118.68 132.57 2cde s LEU 66 Ca 0.05 0.25 -0.22 0.00 -0.22 0.00 0.00 54.13 53.98 2cde s LEU 66 Cb -0.14 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2cde s LEU 66 CO -0.13 0.25 1.38 -0.62 -1.32 0.00 0.00 176.35 175.90 2cde s ASP 67 N -0.07 5.37 0.00 3.68 -1.08 0.10 -3.71 116.67 120.96 2cde s ASP 67 Ca 0.09 2.81 0.00 0.00 -0.52 0.00 0.00 52.55 54.93 2cde s ASP 67 Cb -0.12 -2.64 0.00 0.00 -1.46 0.00 0.00 42.92 38.70 2cde s ASP 67 CO 0.00 -1.51 0.92 0.00 0.52 0.00 0.00 175.17 175.11 2cde n ALA 68 N -0.87 -0.21 0.50 3.66 0.00 -1.26 0.02 120.51 122.34 2cde n ALA 68 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.58 2cde n ALA 68 Cb 0.44 0.23 0.26 0.00 0.00 0.00 0.00 19.45 20.38 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 -2.22 0.00 -3.04 0.00 5.75 -1.26 -4.83 116.55 110.95 2cde n ASP 69 Ca 0.00 0.07 -0.11 0.00 -0.01 0.00 0.00 54.79 54.74 2cde n ASP 69 Cb 0.00 -0.24 0.05 0.00 -1.03 0.00 0.00 41.12 39.90 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 -1.24 -8.53 0.36 2.12 -1.04 0.10 -4.94 114.28 101.12 2cde n THR 70 Ca 0.05 -1.03 0.04 0.00 -2.04 0.00 0.00 64.05 61.07 2cde n THR 70 Cb 0.07 -6.25 -0.06 0.00 -1.82 0.00 0.00 70.33 62.27 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 -2.80 3.26 -3.81 -2.82 2.85 -1.26 -4.94 118.16 108.63 2cde n LYS 71 Ca -0.05 -0.02 -0.05 0.00 -1.05 0.00 0.00 58.31 57.14 2cde n LYS 71 Cb 0.59 -0.99 -0.00 0.00 -0.65 0.00 0.00 35.03 33.97 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 -2.02 1.56 0.15 -1.58 -2.07 -1.26 -3.55 119.66 110.89 2cde s GLN 72 Ca 0.02 -0.91 -0.19 0.00 -1.82 0.00 0.00 55.36 52.46 2cde s GLN 72 Cb 0.07 0.50 0.05 0.00 -1.09 0.00 0.00 33.01 32.53 2cde s GLN 72 CO 0.39 -0.72 0.49 0.45 -1.32 0.00 0.00 175.29 174.57 2cde s SER 73 N -3.02 -0.35 0.13 12.60 0.15 0.83 0.01 113.70 124.05 2cde s SER 73 Ca 0.14 -0.24 0.03 0.00 0.70 0.00 0.00 55.95 56.57 2cde s SER 73 Cb -0.04 0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 64.76 2cde s SER 73 CO 0.06 -0.92 -0.06 -0.94 1.20 0.00 0.00 173.24 172.57 2cde s SER 74 N -2.80 1.38 -0.24 5.45 1.04 0.16 0.55 113.70 119.25 2cde s SER 74 Ca 0.03 -1.04 -0.03 0.00 0.48 0.00 0.00 55.95 55.39 2cde s SER 74 Cb 0.00 0.06 0.08 0.00 0.10 0.00 0.00 66.02 66.26 2cde s SER 74 CO -0.11 -0.44 0.07 -0.22 0.98 0.00 0.00 173.24 173.52 2cde s LEU 75 N -3.11 1.27 0.30 2.42 2.96 0.56 0.68 118.68 123.76 2cde s LEU 75 Ca 0.16 -1.09 -0.16 0.00 -0.22 0.00 0.00 54.13 52.81 2cde s LEU 75 Cb 0.05 -0.59 -0.09 0.00 0.50 0.00 0.00 46.19 46.05 2cde s LEU 75 CO -0.01 -0.36 0.73 -2.28 -1.32 0.00 0.00 176.35 173.11 2cde s HIS 76 N 1.86 3.44 -0.07 5.38 5.65 0.63 -0.68 115.29 131.50 2cde s HIS 76 Ca 0.04 1.25 0.00 0.00 0.25 0.00 0.00 55.06 56.60 2cde s HIS 76 Cb -0.17 -2.55 0.02 0.00 -1.18 0.00 0.00 32.58 28.70 2cde s HIS 76 CO -0.17 0.15 -0.05 0.42 -0.65 0.00 0.00 174.74 174.44 2cde s ILE 77 N -1.87 0.71 -0.13 0.89 1.01 0.67 0.11 121.20 122.58 2cde s ILE 77 Ca 0.51 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.96 2cde s ILE 77 Cb -0.12 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 2cde s ILE 77 CO 0.18 0.29 0.06 -0.89 0.00 0.00 0.00 174.94 174.58 2cde s THR 78 N 1.33 4.77 -1.06 2.92 2.01 0.64 -1.23 115.64 125.02 2cde s THR 78 Ca -0.04 -0.06 -0.07 0.00 0.31 0.00 0.00 61.69 61.83 2cde s THR 78 Cb -0.14 -3.08 -0.06 0.00 0.01 0.00 0.00 72.50 69.23 2cde s THR 78 CO -0.03 0.56 0.91 0.00 -0.69 0.00 0.00 174.62 175.37 2cde n ALA 79 N 2.58 -2.49 -1.42 7.40 0.00 -1.07 -4.75 120.51 120.76 2cde n ALA 79 Ca -0.18 0.10 -0.49 0.00 0.00 0.00 0.00 53.44 52.86 2cde n ALA 79 Cb 0.53 -5.63 -0.04 0.00 0.00 0.00 0.00 19.45 14.32 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 -3.17 -0.93 -3.84 0.00 3.41 -0.40 -4.19 113.62 104.49 2cde n SER 80 Ca -0.07 1.14 -0.12 0.00 -0.26 0.00 0.00 58.87 59.55 2cde n SER 80 Cb 0.62 -0.97 -0.13 0.00 -0.26 0.00 0.00 64.21 63.47 2cde n SER 80 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2cde s GLN 81 N -0.88 0.14 0.00 4.33 -0.21 -1.26 0.21 119.66 121.99 2cde s GLN 81 Ca 0.67 0.09 0.00 0.00 0.02 0.00 0.00 55.36 56.14 2cde s GLN 81 Cb -0.96 0.07 0.00 0.00 1.00 0.00 0.00 33.01 33.11 2cde s GLN 81 CO 0.56 -0.02 0.40 1.47 -2.12 0.00 0.00 175.29 175.58 2cde n LEU 82 N 2.90 0.00 0.02 2.90 -0.00 -1.26 0.23 117.00 121.79 2cde n LEU 82 Ca -0.13 0.07 -0.20 0.00 -0.00 0.00 0.00 56.01 55.75 2cde n LEU 82 Cb 0.59 -0.07 -0.14 0.00 -0.00 0.00 0.00 43.42 43.79 2cde n LEU 82 CO 0.23 -0.07 -0.66 0.77 -0.00 0.00 0.00 177.39 177.65 2cde h SER 83 N 0.00 0.42 -0.02 1.45 4.64 -1.95 -3.30 113.55 114.79 2cde h SER 83 Ca 0.00 -0.80 0.01 0.00 -0.47 0.00 0.00 61.79 60.52 2cde h SER 83 Cb 0.14 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2cde h SER 83 CO 0.00 1.71 0.04 0.44 -0.87 0.00 0.00 176.83 178.15 2cde h ASP 84 N 0.07 0.00 -1.42 4.97 3.32 0.25 -3.40 116.42 120.21 2cde h ASP 84 Ca -0.37 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.20 2cde h ASP 84 Cb 2.05 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.59 2cde h ASP 84 CO 0.12 0.00 1.64 -1.54 -1.72 0.00 0.00 179.24 177.74 2cde n SER 85 N -3.46 2.12 -0.80 6.45 3.41 -1.19 -4.73 113.62 115.42 2cde n SER 85 Ca -0.02 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.22 2cde n SER 85 Cb 0.12 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.58 2cde n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cde n ALA 86 N 14.89 0.00 -2.75 7.33 0.00 -1.02 -4.96 120.51 134.01 2cde n ALA 86 Ca 0.40 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.49 2cde n ALA 86 Cb 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.83 2cde n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2cde s SER 87 N -0.40 5.41 -0.16 0.00 0.15 -0.89 -1.47 113.70 116.34 2cde s SER 87 Ca 0.00 0.16 -0.02 0.00 0.70 0.00 0.00 55.95 56.79 2cde s SER 87 Cb 0.00 -1.64 -0.02 0.00 -1.71 0.00 0.00 66.02 62.65 2cde s SER 87 CO 0.00 0.34 -0.09 -0.31 1.20 0.00 0.00 173.24 174.38 2cde s TYR 88 N -0.65 2.89 -0.05 3.44 2.02 -0.93 -0.65 117.35 123.42 2cde s TYR 88 Ca 0.11 -0.66 0.06 0.00 -0.37 0.00 0.00 57.07 56.21 2cde s TYR 88 Cb -0.12 -1.92 -0.01 0.00 -0.40 0.00 0.00 41.96 39.50 2cde s TYR 88 CO 0.02 -0.26 -0.23 0.42 -1.57 0.00 0.00 175.55 173.93 2cde s ILE 89 N 0.61 2.23 -0.25 2.71 1.01 0.12 -1.70 121.20 125.93 2cde s ILE 89 Ca -0.06 -1.01 -0.10 0.00 0.00 0.00 0.00 60.65 59.48 2cde s ILE 89 Cb -0.15 -1.81 -0.05 0.00 0.01 0.00 0.00 42.46 40.46 2cde s ILE 89 CO 0.03 0.57 0.16 0.00 0.00 0.00 0.00 174.94 175.70 2cde s VAL 91 N 1.27 1.10 0.45 0.00 1.01 0.40 -1.78 120.40 122.85 2cde s VAL 91 Ca 0.07 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.63 2cde s VAL 91 Cb -0.14 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 2cde s VAL 91 CO 0.06 0.34 0.24 -0.69 0.00 0.00 0.00 175.10 175.05 2cde s VAL 92 N 0.45 2.11 -0.20 2.92 1.01 -0.42 0.10 120.40 126.37 2cde s VAL 92 Ca -0.10 -1.63 -0.18 0.00 0.00 0.00 0.00 61.98 60.07 2cde s VAL 92 Cb -0.13 -2.73 0.05 0.00 0.00 0.00 0.00 36.38 33.56 2cde s VAL 92 CO 0.03 0.00 0.53 -0.94 0.00 0.00 0.00 175.10 174.72 2cde s SER 93 N -4.02 -0.56 -0.77 3.32 1.04 -1.06 -0.41 113.70 111.25 2cde s SER 93 Ca 0.37 1.07 -0.25 0.00 0.48 0.00 0.00 55.95 57.62 2cde s SER 93 Cb 0.01 1.08 -0.02 0.00 0.10 0.00 0.00 66.02 67.19 2cde s SER 93 CO 0.21 -0.18 1.80 -1.81 0.98 0.00 0.00 173.24 174.24 2cde s ASP 94 N 0.31 5.41 0.00 7.02 1.11 -1.12 -3.54 116.67 125.87 2cde s ASP 94 Ca -0.00 -0.28 0.00 0.00 0.18 0.00 0.00 52.55 52.44 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 -2.39 0.00 -2.11 1.18 0.00 0.00 175.17 171.85 2cde n ARG 95 N 9.05 0.00 0.00 8.23 1.85 -1.26 -3.84 116.66 130.69 2cde n ARG 95 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.12 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 1.29 0.00 2.89 0.00 -1.26 -4.42 105.19 103.69 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 -0.76 113.62 116.61 2cde n SER 97 Ca 0.00 0.41 -0.02 0.00 -0.26 0.00 0.00 58.87 59.01 2cde n SER 97 Cb 0.00 -0.41 -0.01 0.00 -0.26 0.00 0.00 64.21 63.53 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 -1.41 0.12 -2.66 6.66 -1.04 -1.26 -4.85 114.28 109.83 2cde n THR 98 Ca -0.00 -0.04 -0.23 0.00 -2.04 0.00 0.00 64.05 61.73 2cde n THR 98 Cb 0.09 -0.68 -0.01 0.00 -1.82 0.00 0.00 70.33 67.91 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 -2.62 3.86 -3.95 -4.42 4.77 -0.85 -5.01 117.00 108.78 2cde n LEU 99 Ca -0.04 -5.07 -0.29 0.00 -0.03 0.00 0.00 56.01 50.59 2cde n LEU 99 Cb 0.54 -0.26 -0.17 0.00 -2.33 0.00 0.00 43.42 41.20 2cde n LEU 99 CO 0.02 2.16 -0.46 -0.83 -1.33 0.00 0.00 177.39 176.95 2cde s GLY 100 N -3.38 0.99 0.21 -0.72 0.00 0.06 -4.64 107.32 99.84 2cde s GLY 100 Ca 0.44 -0.77 -0.20 0.00 0.00 0.00 0.00 44.72 44.19 2cde s GLY 100 CO -0.13 0.71 0.72 -1.60 0.00 0.00 0.00 173.10 172.79 2cde s ARG 101 N 1.59 4.27 0.27 2.90 3.52 -1.26 -4.78 118.95 125.47 2cde s ARG 101 Ca 0.04 0.88 -0.13 0.00 -0.13 0.00 0.00 55.73 56.38 2cde s ARG 101 Cb -0.13 -2.94 -0.08 0.00 -1.56 0.00 0.00 34.95 30.24 2cde s ARG 101 CO -0.09 0.43 0.66 -0.51 -0.81 0.00 0.00 175.30 174.97 2cde s LEU 102 N -1.85 4.14 -0.17 -0.88 2.01 -1.26 -2.79 118.68 117.88 2cde s LEU 102 Ca 0.41 1.15 -0.00 0.00 0.01 0.00 0.00 54.13 55.70 2cde s LEU 102 Cb -0.17 -3.84 0.04 0.00 0.01 0.00 0.00 46.19 42.23 2cde s LEU 102 CO 0.21 -0.12 -0.06 -0.31 1.01 0.00 0.00 176.35 177.09 2cde s TYR 103 N -1.85 1.79 0.12 0.29 1.51 0.45 -4.97 117.35 114.70 2cde s TYR 103 Ca 0.50 -1.16 -0.04 0.00 -1.01 0.00 0.00 57.07 55.36 2cde s TYR 103 Cb -0.11 -1.35 -0.05 0.00 -0.11 0.00 0.00 41.96 40.33 2cde s TYR 103 CO 0.19 -0.64 0.34 -0.06 -1.11 0.00 0.00 175.55 174.28 2cde s PHE 104 N 1.60 3.48 0.46 2.71 0.40 -1.26 -1.30 117.98 124.07 2cde s PHE 104 Ca 0.00 0.50 0.07 0.00 -0.60 0.00 0.00 56.93 56.90 2cde s PHE 104 Cb -0.16 -1.96 0.02 0.00 0.51 0.00 0.00 43.02 41.44 2cde s PHE 104 CO -0.08 0.47 0.63 0.20 0.70 0.00 0.00 175.22 177.14 2cde s GLY 105 N -2.43 1.91 0.43 4.36 0.00 -0.74 -4.76 107.32 106.09 2cde s GLY 105 Ca 0.40 -1.63 0.29 0.00 0.00 0.00 0.00 44.72 43.78 2cde s GLY 105 CO 0.25 -1.41 1.86 3.21 0.00 0.00 0.00 173.10 177.01 2cde h ARG 106 N 0.49 0.00 -0.68 2.90 3.08 -1.90 -3.45 114.38 114.82 2cde h ARG 106 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2cde h ARG 106 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2cde h ARG 106 CO 0.46 0.00 -0.16 0.41 -1.07 0.00 0.00 179.97 179.61 2cde n GLY 107 N 0.13 -3.36 3.77 0.04 0.00 -1.26 -4.94 105.19 99.58 2cde n GLY 107 Ca 0.01 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.01 5.14 -0.37 2.61 2.01 -0.69 -4.91 115.64 117.42 2cde s THR 108 Ca 0.00 0.83 -0.24 0.00 0.31 0.00 0.00 61.69 62.59 2cde s THR 108 Cb 0.00 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.79 2cde s THR 108 CO 0.00 0.45 0.84 -1.58 -0.69 0.00 0.00 174.62 173.64 2cde s GLN 109 N -0.13 3.78 -0.13 4.92 2.00 -0.89 -2.19 119.66 127.02 2cde s GLN 109 Ca 0.23 0.40 -0.05 0.00 -2.00 0.00 0.00 55.36 53.95 2cde s GLN 109 Cb -0.15 -3.81 -0.04 0.00 0.80 0.00 0.00 33.01 29.81 2cde s GLN 109 CO 0.10 -0.90 0.05 -1.17 -0.50 0.00 0.00 175.29 172.87 2cde s LEU 110 N 3.26 3.82 0.03 3.68 2.96 -0.54 0.11 118.68 132.00 2cde s LEU 110 Ca 0.34 0.18 0.06 0.00 -0.22 0.00 0.00 54.13 54.49 2cde s LEU 110 Cb -0.13 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.62 2cde s LEU 110 CO 0.18 0.31 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.45 2cde s THR 111 N -0.45 1.39 -0.59 3.68 2.01 0.72 -2.43 115.64 119.96 2cde s THR 111 Ca 0.09 -1.05 0.04 0.00 0.31 0.00 0.00 61.69 61.09 2cde s THR 111 Cb -0.12 -1.22 0.16 0.00 0.01 0.00 0.00 72.50 71.34 2cde s THR 111 CO 0.02 0.15 0.42 -0.69 -0.69 0.00 0.00 174.62 173.82 2cde s VAL 112 N -0.76 2.03 0.90 3.82 1.01 -1.25 -0.87 120.40 125.29 2cde s VAL 112 Ca 0.05 -3.63 -0.12 0.00 0.00 0.00 0.00 61.98 58.28 2cde s VAL 112 Cb -0.08 -2.36 0.10 0.00 0.00 0.00 0.00 36.38 34.04 2cde s VAL 112 CO 0.01 -1.05 0.91 0.79 0.00 0.00 0.00 175.10 175.76 2cde n TRP 113 N 2.41 0.18 -3.79 5.22 5.03 -0.24 -4.55 117.44 121.69 2cde n TRP 113 Ca 0.21 0.35 -0.36 0.00 3.03 0.00 0.00 57.50 60.73 2cde n TRP 113 Cb 0.38 -1.95 -0.07 0.00 -1.03 0.00 0.00 31.31 28.64 2cde n TRP 113 CO 0.00 0.00 0.00 -1.25 -0.03 0.00 0.00 177.69 176.41 2cde s PRO 114 N -4.17 3.91 -0.59 -0.99 0.05 -1.26 -2.60 135.00 129.34 2cde s PRO 114 Ca 0.65 -0.19 -0.28 0.00 0.05 0.00 0.00 61.00 61.23 2cde s PRO 114 Cb -0.24 -3.33 0.02 0.00 0.05 0.00 0.00 34.50 31.00 2cde s PRO 114 CO 0.60 0.48 1.40 -0.51 0.05 0.00 0.00 177.00 179.01 2cde s ASP 115 N -0.16 6.12 0.56 6.66 1.01 -1.26 -4.42 116.67 125.17 2cde s ASP 115 Ca 0.11 0.18 -0.20 0.00 0.71 0.00 0.00 52.55 53.35 2cde s ASP 115 Cb -0.11 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 2cde s ASP 115 CO 0.00 -1.74 1.21 -0.63 0.21 0.00 0.00 175.17 174.23 2cde s ILE 116 N 6.08 2.69 -0.18 0.77 1.01 -1.26 -4.97 121.20 125.33 2cde s ILE 116 Ca 0.50 0.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.45 2cde s ILE 116 Cb -0.10 -3.20 -0.06 0.00 0.01 0.00 0.00 42.46 39.10 2cde s ILE 116 CO 0.24 -0.06 -0.30 0.00 0.00 0.00 0.00 174.94 174.81 2cde n GLN 117 N -1.26 0.52 -3.67 2.79 3.00 -1.26 -4.82 117.38 112.67 2cde n GLN 117 Ca 0.12 0.29 -0.28 0.00 -0.01 0.00 0.00 57.00 57.12 2cde n GLN 117 Cb 0.49 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 29.12 2cde n GLN 117 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2cde n LYS 118 N -4.47 1.10 -1.14 -1.09 5.02 -1.26 -5.12 118.16 111.20 2cde n LYS 118 Ca -0.17 -3.90 -0.35 0.00 -2.02 0.00 0.00 58.31 51.88 2cde n LYS 118 Cb 0.50 -2.01 0.10 0.00 -0.02 0.00 0.00 35.03 33.60 2cde n LYS 118 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2cde n PRO 119 N 2.34 0.18 -2.72 1.97 -0.04 -1.26 -5.00 135.00 130.47 2cde n PRO 119 Ca 0.25 0.12 -0.06 0.00 -0.04 0.00 0.00 63.50 63.77 2cde n PRO 119 Cb 0.41 -2.09 0.05 0.00 -0.04 0.00 0.00 33.50 31.83 2cde n PRO 119 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2cde n ASP 120 N -1.64 -2.43 -4.67 3.54 -0.08 -0.21 -5.04 116.55 106.02 2cde n ASP 120 Ca 0.11 -2.53 -0.35 0.00 -1.51 0.00 0.00 54.79 50.51 2cde n ASP 120 Cb 0.51 1.39 0.09 0.00 2.34 0.00 0.00 41.12 45.45 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 2.01 0.59 0.00 -0.67 -0.04 0.22 -4.41 135.00 132.70 2cde n PRO 121 Ca 0.09 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 2cde n PRO 121 Cb 0.64 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 2cde n PRO 121 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cde n ALA 122 N -2.57 0.00 -3.63 0.55 0.00 -0.96 -4.98 120.51 108.92 2cde n ALA 122 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.29 2cde n ALA 122 Cb 0.49 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.78 2cde n ALA 122 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2cde s VAL 123 N -2.00 1.57 0.13 0.00 1.01 -1.26 -0.67 120.40 119.18 2cde s VAL 123 Ca 0.00 -0.69 0.10 0.00 0.00 0.00 0.00 61.98 61.39 2cde s VAL 123 Cb 0.00 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2cde s VAL 123 CO 0.00 0.45 -0.21 -0.31 0.00 0.00 0.00 175.10 175.03 2cde s TYR 124 N 0.93 2.44 -0.15 5.22 2.02 0.52 -4.93 117.35 123.41 2cde s TYR 124 Ca -0.07 -0.31 -0.06 0.00 -0.37 0.00 0.00 57.07 56.25 2cde s TYR 124 Cb -0.15 -1.30 -0.04 0.00 -0.40 0.00 0.00 41.96 40.07 2cde s TYR 124 CO -0.01 0.38 0.07 -1.14 -1.57 0.00 0.00 175.55 173.28 2cde s GLN 125 N -2.16 3.65 -0.01 -0.62 0.74 -1.26 -0.35 119.66 119.65 2cde s GLN 125 Ca 0.17 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.32 2cde s GLN 125 Cb -0.10 -3.13 -0.03 0.00 1.10 0.00 0.00 33.01 30.85 2cde s GLN 125 CO 0.09 0.49 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.66 2cde s LEU 126 N -0.23 2.78 0.19 3.68 1.43 -0.22 -5.00 118.68 121.31 2cde s LEU 126 Ca 0.08 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.96 2cde s LEU 126 Cb -0.12 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2cde s LEU 126 CO 0.01 0.30 0.29 -0.13 0.23 0.00 0.00 176.35 177.06 2cde s ARG 127 N -1.10 3.38 0.21 1.70 0.52 -1.26 -3.24 118.95 119.15 2cde s ARG 127 Ca 0.14 -0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 2cde s ARG 127 Cb -0.11 -2.90 -0.08 0.00 0.52 0.00 0.00 34.95 32.38 2cde s ARG 127 CO 0.04 0.48 1.18 0.34 0.02 0.00 0.00 175.30 177.36 2cde s ASP 128 N -3.50 7.12 0.25 0.23 -1.08 -1.26 -4.92 116.67 113.51 2cde s ASP 128 Ca 0.34 2.25 -0.04 0.00 -0.52 0.00 0.00 52.55 54.58 2cde s ASP 128 Cb -0.10 -2.61 0.36 0.00 -1.46 0.00 0.00 42.92 39.10 2cde s ASP 128 CO 0.28 -0.33 1.87 0.77 0.52 0.00 0.00 175.17 178.28 2cde h SER 129 N 4.88 0.92 -3.19 -0.34 4.64 -1.97 -3.39 113.55 115.10 2cde h SER 129 Ca -0.45 0.01 -0.61 0.00 -0.47 0.00 0.00 61.79 60.27 2cde h SER 129 Cb 1.21 -0.18 -0.12 0.00 -0.31 0.00 0.00 62.40 63.00 2cde h SER 129 CO 0.73 0.59 -0.50 -0.54 -0.87 0.00 0.00 176.83 176.23 2cde s LYS 130 N -6.06 4.03 -0.42 4.77 1.02 -1.26 -5.01 119.74 116.82 2cde s LYS 130 Ca -0.13 -0.23 -0.41 0.00 0.02 0.00 0.00 55.97 55.22 2cde s LYS 130 Cb 0.19 -3.34 -0.16 0.00 -0.52 0.00 0.00 37.83 33.99 2cde s LYS 130 CO 0.80 0.37 2.00 -1.13 -0.92 0.00 0.00 175.35 176.47 2cde n SER 131 N 3.29 1.52 -3.71 2.83 3.41 -1.26 -4.91 113.62 114.79 2cde n SER 131 Ca -0.17 0.76 -0.10 0.00 -0.26 0.00 0.00 58.87 59.10 2cde n SER 131 Cb 0.52 -1.04 -0.04 0.00 -0.26 0.00 0.00 64.21 63.39 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 5.45 0.15 -0.04 4.04 1.04 -1.26 -5.05 113.70 118.03 2cde s SER 132 Ca 1.11 -1.08 0.16 0.00 0.48 0.00 0.00 55.95 56.62 2cde s SER 132 Cb -1.24 0.63 0.51 0.00 0.10 0.00 0.00 66.02 66.02 2cde s SER 132 CO 0.64 -1.24 1.43 0.47 0.98 0.00 0.00 173.24 175.52 2cde n ASP 133 N -0.73 3.68 -4.79 7.02 8.00 -1.26 -4.86 116.55 123.62 2cde n ASP 133 Ca -0.02 -2.18 -0.30 0.00 0.71 0.00 0.00 54.79 53.00 2cde n ASP 133 Cb 0.62 -0.40 -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 -1.33 2.92 0.26 -1.24 1.02 -1.26 -4.87 119.74 115.24 2cde s LYS 134 Ca 0.38 -0.69 -0.13 0.00 0.02 0.00 0.00 55.97 55.56 2cde s LYS 134 Cb 0.22 -2.74 -0.00 0.00 -0.52 0.00 0.00 37.83 34.79 2cde s LYS 134 CO 0.22 0.56 0.50 -1.54 -0.92 0.00 0.00 175.35 174.18 2cde s SER 135 N -2.46 -0.03 0.05 2.83 1.04 -1.26 -4.20 113.70 109.68 2cde s SER 135 Ca 0.30 -0.96 0.04 0.00 0.48 0.00 0.00 55.95 55.81 2cde s SER 135 Cb -0.12 0.61 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 2cde s SER 135 CO 0.22 -1.18 -0.12 0.68 0.98 0.00 0.00 173.24 173.82 2cde s VAL 136 N -3.88 0.91 -0.06 5.02 -7.23 -1.20 -4.39 120.40 109.56 2cde s VAL 136 Ca 0.22 -1.11 0.01 0.00 -1.81 0.00 0.00 61.98 59.29 2cde s VAL 136 Cb -0.01 -0.88 -0.03 0.00 0.56 0.00 0.00 36.38 36.02 2cde s VAL 136 CO 0.10 -0.20 -0.06 0.00 -0.31 0.00 0.00 175.10 174.62 2cde s LEU 138 N -0.87 1.84 -0.19 0.00 2.96 0.53 -1.83 118.68 121.11 2cde s LEU 138 Ca 0.13 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.51 2cde s LEU 138 Cb -0.11 -1.14 -0.05 0.00 0.50 0.00 0.00 46.19 45.40 2cde s LEU 138 CO 0.02 0.07 0.10 0.12 -1.32 0.00 0.00 176.35 175.34 2cde s PHE 139 N 0.69 3.36 0.32 5.38 5.36 0.22 -0.35 117.98 132.95 2cde s PHE 139 Ca -0.13 0.24 0.04 0.00 -0.96 0.00 0.00 56.93 56.13 2cde s PHE 139 Cb -0.16 -2.11 -0.02 0.00 -0.34 0.00 0.00 43.02 40.39 2cde s PHE 139 CO 0.03 0.27 0.31 0.99 -1.46 0.00 0.00 175.22 175.36 2cde s THR 140 N 0.25 0.00 -1.25 0.12 2.01 0.15 -0.65 115.64 116.27 2cde s THR 140 Ca 0.07 -1.91 -0.27 0.00 0.31 0.00 0.00 61.69 59.89 2cde s THR 140 Cb -0.12 -2.53 0.03 0.00 0.01 0.00 0.00 72.50 69.90 2cde s THR 140 CO -0.01 0.00 0.62 0.47 -0.69 0.00 0.00 174.62 175.01 2cde n ASP 141 N -1.37 -3.64 -4.44 3.53 8.00 -1.13 -2.26 116.55 115.24 2cde n ASP 141 Ca 0.05 -1.23 -0.27 0.00 0.71 0.00 0.00 54.79 54.06 2cde n ASP 141 Cb 0.63 -2.08 -0.11 0.00 -0.02 0.00 0.00 41.12 39.54 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 -3.63 2.33 0.43 1.24 -0.12 -1.26 0.72 117.98 117.68 2cde s PHE 142 Ca 0.41 -0.34 -0.25 0.00 -0.05 0.00 0.00 56.93 56.70 2cde s PHE 142 Cb -0.21 -1.13 -0.08 0.00 -0.63 0.00 0.00 43.02 40.97 2cde s PHE 142 CO 0.95 0.53 1.27 0.16 -0.05 0.00 0.00 175.22 178.08 2cde s ASP 143 N -2.79 6.22 0.51 1.98 1.47 -1.26 -4.66 116.67 118.14 2cde s ASP 143 Ca 0.22 2.58 0.25 0.00 1.18 0.00 0.00 52.55 56.78 2cde s ASP 143 Cb -0.08 -2.63 1.35 0.00 -0.34 0.00 0.00 42.92 41.22 2cde s ASP 143 CO 0.11 -0.91 1.94 0.28 0.68 0.00 0.00 175.17 177.27 2cde h SER 144 N 2.47 0.09 -0.07 2.11 0.02 -2.00 0.79 113.55 116.96 2cde h SER 144 Ca -0.50 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 60.48 2cde h SER 144 Cb 1.25 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 2cde h SER 144 CO 0.62 0.04 0.23 1.56 -1.14 0.00 0.00 176.83 178.14 2cde h GLN 145 N 0.10 0.00 -6.94 3.45 4.20 -1.93 -3.42 115.11 110.58 2cde h GLN 145 Ca 0.35 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.54 2cde h GLN 145 Cb 1.24 0.00 0.07 0.00 0.30 0.00 0.00 27.48 29.10 2cde h GLN 145 CO -0.04 0.00 0.59 0.99 -0.67 0.00 0.00 178.83 179.70 2cde s THR 146 N -4.27 2.75 -0.10 -0.54 2.01 0.27 -5.02 115.64 110.74 2cde s THR 146 Ca -0.04 0.67 -0.00 0.00 0.31 0.00 0.00 61.69 62.63 2cde s THR 146 Cb 0.12 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 2cde s THR 146 CO 0.39 0.10 -0.08 0.20 -0.69 0.00 0.00 174.62 174.54 2cde s ASN 147 N -0.81 4.52 -0.57 3.53 0.01 -1.26 -5.02 114.94 115.33 2cde s ASN 147 Ca 0.56 -0.11 -0.18 0.00 -0.71 0.00 0.00 52.86 52.42 2cde s ASN 147 Cb -0.36 -1.35 0.10 0.00 0.41 0.00 0.00 41.25 40.05 2cde s ASN 147 CO 0.47 0.29 0.65 -0.69 -1.51 0.00 0.00 177.10 176.30 2cde s VAL 148 N -0.35 4.90 0.53 1.60 1.01 -1.26 -5.05 120.40 121.79 2cde s VAL 148 Ca 0.05 -1.02 -0.22 0.00 0.00 0.00 0.00 61.98 60.79 2cde s VAL 148 Cb -0.12 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.77 2cde s VAL 148 CO 0.02 -1.03 1.34 -0.94 0.00 0.00 0.00 175.10 174.49 2cde s SER 149 N 3.48 5.43 -0.11 3.32 1.04 -1.26 -4.90 113.70 120.69 2cde s SER 149 Ca 0.10 2.72 -0.12 0.00 0.48 0.00 0.00 55.95 59.13 2cde s SER 149 Cb -0.25 -2.63 -0.05 0.00 0.10 0.00 0.00 66.02 63.19 2cde s SER 149 CO 0.06 -1.46 0.28 -1.10 0.98 0.00 0.00 173.24 172.00 2cde s GLN 150 N -2.84 3.96 0.02 4.02 -0.21 -1.26 -4.99 119.66 118.37 2cde s GLN 150 Ca 0.70 0.10 -0.05 0.00 0.02 0.00 0.00 55.36 56.13 2cde s GLN 150 Cb -0.39 -3.31 -0.01 0.00 1.00 0.00 0.00 33.01 30.29 2cde s GLN 150 CO 0.47 0.49 0.34 -1.13 -2.12 0.00 0.00 175.29 173.34 2cde n SER 151 N 2.72 -0.16 0.00 5.90 3.41 -1.26 -4.73 113.62 119.50 2cde n SER 151 Ca -0.15 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 2cde n SER 151 Cb 0.53 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 -3.43 -0.76 -3.79 4.33 5.02 -1.26 -4.89 118.16 113.38 2cde n LYS 152 Ca 0.00 0.19 -0.35 0.00 -2.02 0.00 0.00 58.31 56.13 2cde n LYS 152 Cb 0.04 -4.14 -0.11 0.00 -0.02 0.00 0.00 35.03 30.80 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 -2.14 5.09 0.27 4.39 1.01 -1.26 -4.99 116.67 119.03 2cde s ASP 153 Ca 0.00 -2.59 0.23 0.00 0.71 0.00 0.00 52.55 50.89 2cde s ASP 153 Cb 0.00 -1.80 0.86 0.00 1.01 0.00 0.00 42.92 42.99 2cde s ASP 153 CO 0.00 -0.40 0.82 -1.54 0.21 0.00 0.00 175.17 174.26 2cde n SER 154 N 3.81 0.05 0.04 0.27 3.41 -1.26 0.13 113.62 120.06 2cde n SER 154 Ca 0.04 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 2cde n SER 154 Cb 0.38 -0.31 0.27 0.00 -0.26 0.00 0.00 64.21 64.29 2cde n SER 154 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2cde n ASP 155 N -3.32 0.56 -4.76 4.04 8.00 -1.26 -4.87 116.55 114.93 2cde n ASP 155 Ca 0.23 0.07 -0.32 0.00 0.71 0.00 0.00 54.79 55.48 2cde n ASP 155 Cb 0.97 0.05 -0.07 0.00 -0.02 0.00 0.00 41.12 42.04 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 -3.09 4.54 -0.13 2.53 1.01 0.35 -4.20 120.40 121.42 2cde s VAL 156 Ca 0.09 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2cde s VAL 156 Cb 0.15 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.43 2cde s VAL 156 CO 0.68 0.26 -0.19 -0.31 0.00 0.00 0.00 175.10 175.54 2cde s TYR 157 N -1.26 2.33 -0.06 5.22 2.02 -0.15 -4.68 117.35 120.78 2cde s TYR 157 Ca 0.25 -1.15 0.01 0.00 -0.37 0.00 0.00 57.07 55.81 2cde s TYR 157 Cb -0.12 -1.63 0.02 0.00 -0.40 0.00 0.00 41.96 39.83 2cde s TYR 157 CO 0.17 -0.56 -0.07 0.42 -1.57 0.00 0.00 175.55 173.94 2cde s ILE 158 N 0.93 0.80 0.25 2.71 1.01 -1.26 -1.00 121.20 124.65 2cde s ILE 158 Ca -0.06 -0.26 -0.11 0.00 0.00 0.00 0.00 60.65 60.22 2cde s ILE 158 Cb -0.15 -0.79 -0.08 0.00 0.01 0.00 0.00 42.46 41.45 2cde s ILE 158 CO -0.02 0.29 0.60 0.42 0.00 0.00 0.00 174.94 176.23 2cde s THR 159 N 0.95 4.86 0.98 2.92 -4.23 0.65 -4.76 115.64 117.01 2cde s THR 159 Ca -0.10 0.60 -0.12 0.00 -1.18 0.00 0.00 61.69 60.89 2cde s THR 159 Cb -0.15 -3.62 0.18 0.00 1.34 0.00 0.00 72.50 70.26 2cde s THR 159 CO 0.00 -0.10 1.08 -1.81 -0.54 0.00 0.00 174.62 173.26 2cde s ASP 160 N -2.33 2.67 0.39 3.99 1.01 -1.26 -4.11 116.67 117.03 2cde s ASP 160 Ca 0.49 1.48 -0.26 0.00 0.71 0.00 0.00 52.55 54.96 2cde s ASP 160 Cb -0.11 -2.15 -0.09 0.00 1.01 0.00 0.00 42.92 41.58 2cde s ASP 160 CO 0.20 -3.14 1.27 -1.59 0.21 0.00 0.00 175.17 172.12 2cde s LYS 161 N -4.82 4.08 -0.01 8.23 -2.85 -1.26 -4.66 119.74 118.45 2cde s LYS 161 Ca 0.65 2.10 0.01 0.00 -1.00 0.00 0.00 55.97 57.73 2cde s LYS 161 Cb -0.20 -2.82 0.01 0.00 -2.06 0.00 0.00 37.83 32.77 2cde s LYS 161 CO 0.59 -0.38 -0.01 0.99 0.10 0.00 0.00 175.35 176.64 2cde s THR 162 N -1.26 0.16 -0.09 3.79 2.01 -0.99 -4.92 115.64 114.34 2cde s THR 162 Ca 0.55 -0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.51 2cde s THR 162 Cb -0.37 -0.20 -0.03 0.00 0.01 0.00 0.00 72.50 71.91 2cde s THR 162 CO 0.47 0.09 0.03 0.54 -0.69 0.00 0.00 174.62 175.06 2cde s VAL 163 N 0.40 4.54 0.09 3.82 0.11 -1.26 -1.64 120.40 126.46 2cde s VAL 163 Ca -0.04 -0.16 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 2cde s VAL 163 Cb -0.06 -2.93 -0.03 0.00 -1.53 0.00 0.00 36.38 31.83 2cde s VAL 163 CO -0.01 0.60 -0.18 -1.48 -3.33 0.00 0.00 175.10 170.70 2cde s LEU 164 N -0.87 2.29 -0.12 2.54 0.05 -0.86 -4.98 118.68 116.73 2cde s LEU 164 Ca 0.13 -0.66 0.02 0.00 0.05 0.00 0.00 54.13 53.68 2cde s LEU 164 Cb -0.11 -0.75 0.01 0.00 -2.05 0.00 0.00 46.19 43.29 2cde s LEU 164 CO 0.03 0.01 -0.19 -0.62 -0.55 0.00 0.00 176.35 175.03 2cde s ASP 165 N -1.83 2.78 -1.07 1.48 2.15 -1.26 -1.44 116.67 117.47 2cde s ASP 165 Ca 0.03 -0.51 -0.11 0.00 0.43 0.00 0.00 52.55 52.39 2cde s ASP 165 Cb -0.10 -1.27 0.25 0.00 -0.30 0.00 0.00 42.92 41.51 2cde s ASP 165 CO 0.03 0.05 1.10 -0.04 -0.17 0.00 0.00 175.17 176.14 2cde s MET 166 N 0.88 4.08 0.20 4.34 -1.94 0.36 -4.91 119.30 122.31 2cde s MET 166 Ca -0.07 -2.99 -0.21 0.00 -1.71 0.00 0.00 55.69 50.71 2cde s MET 166 Cb -0.15 -4.61 0.15 0.00 2.01 0.00 0.00 34.83 32.23 2cde s MET 166 CO -0.01 -1.32 1.56 0.00 -0.01 0.00 0.00 175.02 175.24 2cde h ARG 167 N 6.96 -0.08 -0.99 2.03 3.08 -1.95 0.25 114.38 123.68 2cde h ARG 167 Ca 0.18 0.01 0.30 0.00 0.07 0.00 0.00 59.98 60.54 2cde h ARG 167 Cb 0.90 0.02 -0.18 0.00 0.08 0.00 0.00 29.97 30.79 2cde h ARG 167 CO 1.00 -0.06 0.15 0.66 -1.07 0.00 0.00 179.97 180.66 2cde h SER 168 N -0.09 -0.28 -0.22 7.04 4.64 -1.95 0.67 113.55 123.36 2cde h SER 168 Ca 0.27 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2cde h SER 168 Cb 0.57 0.43 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2cde h SER 168 CO -0.84 -0.37 0.00 0.23 -0.87 0.00 0.00 176.83 174.98 2cde n MET 169 N -5.43 2.22 -3.76 4.77 2.81 0.11 -4.96 117.12 112.87 2cde n MET 169 Ca 0.27 -2.02 -0.26 0.00 -1.81 0.00 0.00 57.70 53.88 2cde n MET 169 Cb 0.88 -1.44 0.04 0.00 -0.71 0.00 0.00 33.22 31.99 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 1.29 -4.06 -4.25 7.83 -0.08 0.24 -4.98 116.55 112.53 2cde n ASP 170 Ca 0.15 -0.73 -0.28 0.00 -1.51 0.00 0.00 54.79 52.42 2cde n ASP 170 Cb 0.55 -4.25 -0.15 0.00 2.34 0.00 0.00 41.12 39.61 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 -3.40 2.00 -0.06 -0.67 5.36 -0.90 -4.98 117.98 115.33 2cde s PHE 171 Ca 0.44 -0.38 0.01 0.00 -0.96 0.00 0.00 56.93 56.04 2cde s PHE 171 Cb -0.21 -1.27 0.02 0.00 -0.34 0.00 0.00 43.02 41.21 2cde s PHE 171 CO 0.80 -0.01 -0.07 0.15 -1.46 0.00 0.00 175.22 174.63 2cde s LYS 172 N -0.63 1.17 -0.01 10.12 1.02 -1.26 0.13 119.74 130.28 2cde s LYS 172 Ca 0.09 -0.20 0.01 0.00 0.02 0.00 0.00 55.97 55.89 2cde s LYS 172 Cb -0.09 -1.13 -0.00 0.00 -0.52 0.00 0.00 37.83 36.09 2cde s LYS 172 CO -0.00 -0.10 -0.04 -1.54 -0.92 0.00 0.00 175.35 172.74 2cde s SER 173 N 1.07 0.53 0.70 2.83 1.04 -0.52 -4.95 113.70 114.39 2cde s SER 173 Ca -0.08 -0.08 -0.04 0.00 0.48 0.00 0.00 55.95 56.23 2cde s SER 173 Cb -0.14 -0.09 0.08 0.00 0.10 0.00 0.00 66.02 65.97 2cde s SER 173 CO -0.01 0.04 0.98 0.20 0.98 0.00 0.00 173.24 175.44 2cde s ASN 174 N 0.02 4.65 0.00 7.02 0.01 -1.26 -2.03 114.94 123.35 2cde s ASN 174 Ca 0.00 0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.29 2cde s ASN 174 Cb -0.03 -0.72 0.00 0.00 0.41 0.00 0.00 41.25 40.91 2cde s ASN 174 CO -0.00 -1.66 0.00 -1.54 -1.51 0.00 0.00 177.10 172.38 2cde n SER 175 N -2.85 0.00 -4.36 -1.22 3.41 -0.65 -2.84 113.62 105.11 2cde n SER 175 Ca 0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.42 2cde n SER 175 Cb 0.60 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.42 2cde n SER 175 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cde s ALA 176 N -0.81 2.27 0.32 7.33 0.00 0.17 -2.35 121.76 128.69 2cde s ALA 176 Ca 0.00 -1.36 0.10 0.00 0.00 0.00 0.00 51.96 50.69 2cde s ALA 176 Cb 0.00 -0.41 -0.06 0.00 0.00 0.00 0.00 23.12 22.65 2cde s ALA 176 CO 0.00 0.52 -0.11 0.08 0.00 0.00 0.00 175.76 176.25 2cde s VAL 177 N -0.95 2.19 0.15 0.00 1.01 -1.26 -0.61 120.40 120.93 2cde s VAL 177 Ca 0.12 -2.23 -0.23 0.00 0.00 0.00 0.00 61.98 59.64 2cde s VAL 177 Cb -0.10 -2.55 0.07 0.00 0.00 0.00 0.00 36.38 33.80 2cde s VAL 177 CO 0.04 -0.25 0.60 0.00 0.00 0.00 0.00 175.10 175.49 2cde s ALA 178 N -2.65 -1.61 -0.04 5.51 0.00 -0.76 -0.26 121.76 121.95 2cde s ALA 178 Ca 0.31 0.53 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 2cde s ALA 178 Cb 0.01 0.84 0.11 0.00 0.00 0.00 0.00 23.12 24.08 2cde s ALA 178 CO 0.15 -0.75 0.93 1.67 0.00 0.00 0.00 175.76 177.77 2cde s TRP 179 N -3.61 -0.32 0.00 0.00 -2.14 -0.17 -1.62 118.94 111.08 2cde s TRP 179 Ca 0.00 0.24 0.00 0.00 2.66 0.00 0.00 56.10 59.00 2cde s TRP 179 Cb -0.01 0.53 0.00 0.00 -3.10 0.00 0.00 33.47 30.89 2cde s TRP 179 CO -0.12 -0.49 0.00 0.45 -2.66 0.00 0.00 176.95 174.14 2cde n SER 180 N -0.13 0.00 -2.87 -2.66 2.88 -1.26 -0.98 113.62 108.61 2cde n SER 180 Ca -0.08 -0.41 -0.34 0.00 -1.33 0.00 0.00 58.87 56.71 2cde n SER 180 Cb 0.61 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.08 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 -1.18 6.13 -0.11 -3.46 4.13 -1.26 -4.81 115.26 114.70 2cde n ASN 181 Ca 0.00 -3.76 0.00 0.00 1.68 0.00 0.00 54.58 52.50 2cde n ASN 181 Cb 0.00 -0.80 0.00 0.00 -1.54 0.00 0.00 39.78 37.44 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 -0.41 0.00 0.00 3.52 4.81 -1.26 -4.97 118.16 119.85 2cde n LYS 182 Ca 0.45 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 2cde n LYS 182 Cb 0.41 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.46 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 -1.91 0.00 -3.76 3.14 7.64 -1.26 -4.23 113.62 113.24 2cde n SER 183 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 2cde n SER 183 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 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 8.02 3.55 -3.72 6.43 8.00 -1.26 -4.87 116.55 132.70 2cde n ASP 184 Ca 0.00 -2.80 -0.18 0.00 0.71 0.00 0.00 54.79 52.52 2cde n ASP 184 Cb 0.00 -1.52 -0.17 0.00 -0.02 0.00 0.00 41.12 39.41 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 3.87 0.07 -0.17 1.24 5.36 -1.26 -5.10 117.98 121.99 2cde s PHE 185 Ca 0.51 0.19 -0.14 0.00 -0.96 0.00 0.00 56.93 56.53 2cde s PHE 185 Cb 0.13 -0.39 0.05 0.00 -0.34 0.00 0.00 43.02 42.48 2cde s PHE 185 CO -0.02 -0.15 0.45 0.00 -1.46 0.00 0.00 175.22 174.04 2cde s ALA 186 N 1.68 -1.13 -0.14 11.12 0.00 -1.26 -5.02 121.76 127.01 2cde s ALA 186 Ca -0.01 1.40 0.09 0.00 0.00 0.00 0.00 51.96 53.44 2cde s ALA 186 Cb -0.12 -0.83 0.51 0.00 0.00 0.00 0.00 23.12 22.68 2cde s ALA 186 CO -0.03 -0.24 1.16 0.00 0.00 0.00 0.00 175.76 176.65 2cde h ALA 188 N 1.18 -0.08 -0.11 0.00 0.00 -1.99 -3.33 119.26 114.94 2cde h ALA 188 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.48 2cde h ALA 188 Cb 0.56 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2cde h ALA 188 CO 0.00 -0.15 -0.49 -0.91 0.00 0.00 0.00 179.25 177.70 2cde h ASN 189 N -0.87 0.30 -3.39 0.00 2.35 -1.79 -3.44 115.58 108.74 2cde h ASN 189 Ca -0.01 -0.14 -0.44 0.00 -0.55 0.00 0.00 56.30 55.15 2cde h ASN 189 Cb 0.63 -0.08 0.21 0.00 0.05 0.00 0.00 38.32 39.12 2cde h ASN 189 CO 0.01 0.74 0.04 0.00 -1.65 0.00 0.00 177.43 176.58 2cde s ALA 190 N -4.00 -0.23 -1.64 -0.83 0.00 -1.06 -3.00 121.76 111.01 2cde s ALA 190 Ca -0.05 -0.10 -0.19 0.00 0.00 0.00 0.00 51.96 51.62 2cde s ALA 190 Cb 0.13 -3.25 0.17 0.00 0.00 0.00 0.00 23.12 20.17 2cde s ALA 190 CO 0.79 -3.69 0.66 1.19 0.00 0.00 0.00 175.76 174.71 2cde n PHE 191 N -4.81 -1.57 -3.37 0.00 3.01 -1.26 -4.86 117.46 104.60 2cde n PHE 191 Ca 0.04 0.69 -0.45 0.00 1.01 0.00 0.00 57.45 58.73 2cde n PHE 191 Cb 0.54 -2.49 -0.05 0.00 -0.01 0.00 0.00 39.48 37.48 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 -3.14 6.29 0.00 4.37 -0.87 -1.16 -5.06 114.94 115.37 2cde s ASN 192 Ca 0.71 -2.18 0.00 0.00 -1.57 0.00 0.00 52.86 49.82 2cde s ASN 192 Cb -0.40 -2.17 0.00 0.00 -0.02 0.00 0.00 41.25 38.66 2cde s ASN 192 CO 0.87 -0.71 0.00 0.59 -2.57 0.00 0.00 177.10 175.27