#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fee s ARG 3 N 0.00 2.55 -0.17 7.34 3.52 0.14 -4.96 118.95 127.36 2fee s ARG 3 Ca 0.00 -0.89 -0.04 0.00 -0.13 0.00 0.00 55.73 54.68 2fee s ARG 3 Cb 0.00 -2.19 -0.02 0.00 -1.56 0.00 0.00 34.95 31.18 2fee s ARG 3 CO 0.00 0.40 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.35 2fee s LEU 4 N -0.21 3.16 -0.37 -0.88 1.43 -1.26 -0.49 118.68 120.05 2fee s LEU 4 Ca -0.02 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.90 2fee s LEU 4 Cb -0.13 -1.77 0.12 0.00 0.03 0.00 0.00 46.19 44.43 2fee s LEU 4 CO 0.03 0.12 0.15 -0.22 0.23 0.00 0.00 176.35 176.67 2fee s LEU 5 N 0.64 2.81 0.02 1.79 1.98 -0.47 -4.07 118.68 121.38 2fee s LEU 5 Ca -0.02 -2.14 -0.28 0.00 -2.89 0.00 0.00 54.13 48.79 2fee s LEU 5 Cb -0.14 -1.05 -0.04 0.00 0.66 0.00 0.00 46.19 45.61 2fee s LEU 5 CO 0.02 -0.35 0.90 -1.83 -1.89 0.00 0.00 176.35 173.21 2fee s GLU 6 N 0.96 4.57 0.00 1.98 1.03 -1.26 -0.09 118.70 125.89 2fee s GLU 6 Ca 0.13 1.30 0.00 0.00 0.03 0.00 0.00 54.97 56.43 2fee s GLU 6 Cb -0.21 -3.43 0.00 0.00 -0.80 0.00 0.00 34.13 29.70 2fee s GLU 6 CO -0.12 0.08 0.00 -1.13 -1.33 0.00 0.00 175.26 172.76 2fee n SER 7 N 3.47 1.07 0.00 0.83 3.41 0.39 -4.55 113.62 118.24 2fee n SER 7 Ca 0.03 -0.94 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 2fee n SER 7 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2fee n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fee n GLY 8 N 2.67 0.93 3.72 5.00 0.00 -1.26 -0.88 105.19 115.37 2fee n GLY 8 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2fee n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fee s GLY 9 N -1.68 1.59 0.00 -0.02 0.00 -1.26 -4.61 107.32 101.34 2fee s GLY 9 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.12 2fee s GLY 9 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 173.10 173.76 2fee n GLY 10 N -1.70 0.07 3.69 0.20 0.00 0.78 -4.95 105.19 103.29 2fee n GLY 10 Ca 0.08 -1.05 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 2fee n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fee s LEU 11 N 0.00 4.18 0.03 0.99 2.96 -1.26 0.74 118.68 126.32 2fee s LEU 11 Ca 0.00 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 2fee s LEU 11 Cb 0.00 -2.28 -0.02 0.00 0.50 0.00 0.00 46.19 44.39 2fee s LEU 11 CO 0.00 0.06 -0.13 0.68 -1.32 0.00 0.00 176.35 175.64 2fee s VAL 12 N 0.82 1.04 0.51 1.68 -7.23 -0.43 -4.96 120.40 111.83 2fee s VAL 12 Ca 0.13 -0.88 -0.21 0.00 -1.81 0.00 0.00 61.98 59.21 2fee s VAL 12 Cb -0.13 -0.93 -0.06 0.00 0.56 0.00 0.00 36.38 35.82 2fee s VAL 12 CO 0.04 0.05 1.16 -1.10 -0.31 0.00 0.00 175.10 174.94 2fee s GLN 13 N -0.95 3.50 0.93 4.82 -0.21 -1.25 -0.95 119.66 125.54 2fee s GLN 13 Ca 0.02 1.72 -0.12 0.00 0.02 0.00 0.00 55.36 56.99 2fee s GLN 13 Cb -0.07 -2.18 0.05 0.00 1.00 0.00 0.00 33.01 31.81 2fee s GLN 13 CO 0.01 -0.75 0.57 -2.30 -2.12 0.00 0.00 175.29 170.70 2fee n PRO 14 N -0.95 -0.27 -0.60 2.91 -0.02 -1.26 -2.12 135.00 132.68 2fee n PRO 14 Ca 0.10 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2fee n PRO 14 Cb 0.49 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2fee n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fee n GLY 15 N 1.26 0.21 0.00 -1.23 0.00 0.10 -4.88 105.19 100.65 2fee n GLY 15 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2fee n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fee n GLY 16 N -2.00 0.81 3.56 -0.02 0.00 -0.90 -4.35 105.19 102.29 2fee n GLY 16 Ca 0.00 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.36 2fee n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fee s SER 17 N -1.00 -0.30 0.20 1.61 1.04 -1.26 -1.92 113.70 112.07 2fee s SER 17 Ca 0.00 0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.50 2fee s SER 17 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 2fee s SER 17 CO 0.00 -0.38 0.41 -1.48 0.98 0.00 0.00 173.24 172.77 2fee s LEU 18 N -1.68 0.51 -0.37 2.42 2.34 -1.12 -5.04 118.68 115.74 2fee s LEU 18 Ca 0.03 -0.79 0.01 0.00 0.06 0.00 0.00 54.13 53.44 2fee s LEU 18 Cb -0.01 1.63 0.11 0.00 -0.56 0.00 0.00 46.19 47.37 2fee s LEU 18 CO -0.03 -1.02 0.15 -0.75 -1.06 0.00 0.00 176.35 173.64 2fee s LYS 19 N -3.96 1.07 0.42 1.48 2.20 -1.26 -2.87 119.74 116.82 2fee s LYS 19 Ca 0.17 -1.58 -0.24 0.00 -0.36 0.00 0.00 55.97 53.96 2fee s LYS 19 Cb 0.01 -2.33 -0.08 0.00 -1.51 0.00 0.00 37.83 33.92 2fee s LYS 19 CO 0.02 -1.05 1.11 -0.51 -0.36 0.00 0.00 175.35 174.57 2fee s LEU 20 N 0.99 4.12 -0.04 5.43 1.43 -0.48 -4.71 118.68 125.42 2fee s LEU 20 Ca 0.13 2.19 -0.00 0.00 -1.03 0.00 0.00 54.13 55.42 2fee s LEU 20 Cb -0.20 -4.16 0.03 0.00 0.03 0.00 0.00 46.19 41.88 2fee s LEU 20 CO -0.12 -0.66 0.01 -0.44 0.23 0.00 0.00 176.35 175.37 2fee s SER 21 N -1.40 0.63 -0.22 2.29 0.01 -0.06 -1.32 113.70 113.64 2fee s SER 21 Ca 0.59 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.76 2fee s SER 21 Cb -0.26 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.71 2fee s SER 21 CO 0.32 -0.13 0.07 0.00 0.41 0.00 0.00 173.24 173.91 2fee s ALA 23 N 1.02 2.48 -0.11 0.00 0.00 0.87 -0.93 121.76 125.08 2fee s ALA 23 Ca 0.04 -1.13 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 2fee s ALA 23 Cb -0.14 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2fee s ALA 23 CO 0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 175.76 175.53 2fee s ALA 24 N 1.10 3.05 0.03 0.00 0.00 -0.87 -1.36 121.76 123.70 2fee s ALA 24 Ca 0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2fee s ALA 24 Cb -0.14 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2fee s ALA 24 CO -0.05 0.43 0.01 -1.54 0.00 0.00 0.00 175.76 174.61 2fee s SER 25 N -0.35 0.27 0.00 0.00 1.04 0.36 -4.92 113.70 110.09 2fee s SER 25 Ca 0.06 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2fee s SER 25 Cb -0.12 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2fee s SER 25 CO 0.02 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.43 2fee n GLY 26 N 1.05 0.84 3.53 7.32 0.00 -1.26 0.28 105.19 116.94 2fee n GLY 26 Ca -0.20 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 2fee n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fee s PHE 27 N -2.05 -0.30 -0.48 1.61 -0.71 -1.26 -4.09 117.98 110.70 2fee s PHE 27 Ca 0.00 0.16 -0.27 0.00 -1.04 0.00 0.00 56.93 55.78 2fee s PHE 27 Cb 0.00 0.54 -0.02 0.00 -1.21 0.00 0.00 43.02 42.33 2fee s PHE 27 CO 0.00 -0.52 1.88 0.34 -1.34 0.00 0.00 175.22 175.58 2fee s ASP 28 N -2.48 5.46 0.30 1.98 3.68 -1.26 -4.88 116.67 119.47 2fee s ASP 28 Ca 0.06 0.81 0.02 0.00 2.13 0.00 0.00 52.55 55.57 2fee s ASP 28 Cb -0.01 -2.53 0.49 0.00 -1.45 0.00 0.00 42.92 39.42 2fee s ASP 28 CO -0.08 -2.14 1.82 0.22 0.13 0.00 0.00 175.17 175.13 2fee h TYR 29 N 14.48 0.66 -1.02 -5.34 3.20 -1.96 -3.41 116.97 123.58 2fee h TYR 29 Ca -0.29 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.50 2fee h TYR 29 Cb 1.17 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.26 2fee h TYR 29 CO 1.00 0.63 0.00 0.43 -1.64 0.00 0.00 178.16 178.58 2fee n SER 30 N -4.25 -1.03 0.00 -2.11 7.64 -1.26 -3.68 113.62 108.93 2fee n SER 30 Ca 0.02 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.69 2fee n SER 30 Cb 0.27 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 2fee n SER 30 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2fee n ARG 31 N -1.25 0.00 -4.05 1.43 5.12 -1.26 -4.85 116.66 111.80 2fee n ARG 31 Ca 0.00 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.57 2fee n ARG 31 Cb 0.00 -1.13 -0.09 0.00 -1.16 0.00 0.00 32.46 30.08 2fee n ARG 31 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2fee s TYR 32 N 0.00 3.27 0.20 -1.55 1.51 -1.24 -4.90 117.35 114.64 2fee s TYR 32 Ca 0.00 0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 55.89 2fee s TYR 32 Cb 0.00 -2.02 -0.08 0.00 -0.11 0.00 0.00 41.96 39.75 2fee s TYR 32 CO 0.00 0.26 1.10 -1.58 -1.11 0.00 0.00 175.55 174.22 2fee s TRP 33 N 0.05 3.60 -0.00 2.71 0.52 -1.26 -4.27 118.94 120.28 2fee s TRP 33 Ca 0.05 1.62 0.02 0.00 0.02 0.00 0.00 56.10 57.81 2fee s TRP 33 Cb -0.12 -3.27 -0.04 0.00 -1.15 0.00 0.00 33.47 28.89 2fee s TRP 33 CO 0.01 -0.59 -0.01 -1.64 0.02 0.00 0.00 176.95 174.74 2fee s MET 34 N -0.61 2.75 0.14 4.98 -1.94 -0.96 0.33 119.30 123.97 2fee s MET 34 Ca 0.48 -0.62 0.01 0.00 -1.71 0.00 0.00 55.69 53.85 2fee s MET 34 Cb -0.30 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 33.86 2fee s MET 34 CO 0.36 0.62 -0.02 0.45 -0.01 0.00 0.00 175.02 176.43 2fee s SER 35 N -1.49 1.05 -0.10 3.03 0.15 0.20 -1.44 113.70 115.11 2fee s SER 35 Ca 0.19 -1.11 0.01 0.00 0.70 0.00 0.00 55.95 55.73 2fee s SER 35 Cb -0.11 0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.35 2fee s SER 35 CO 0.09 -0.55 -0.10 0.26 1.20 0.00 0.00 173.24 174.14 2fee s TRP 36 N -3.70 1.56 -0.05 3.44 0.52 -0.89 -1.03 118.94 118.79 2fee s TRP 36 Ca 0.19 -0.71 0.01 0.00 0.02 0.00 0.00 56.10 55.61 2fee s TRP 36 Cb 0.06 -1.21 0.02 0.00 -1.15 0.00 0.00 33.47 31.19 2fee s TRP 36 CO 0.00 -0.44 -0.05 0.08 0.02 0.00 0.00 176.95 176.56 2fee s VAL 37 N 1.25 0.61 0.22 4.03 1.01 0.59 0.22 120.40 128.33 2fee s VAL 37 Ca -0.03 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 61.89 2fee s VAL 37 Cb -0.14 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2fee s VAL 37 CO -0.04 0.24 -0.08 0.00 0.00 0.00 0.00 175.10 175.22 2fee s ARG 38 N 0.93 2.07 -0.24 2.72 1.70 0.33 -0.19 118.95 126.27 2fee s ARG 38 Ca -0.11 -1.38 -0.01 0.00 -0.47 0.00 0.00 55.73 53.76 2fee s ARG 38 Cb -0.14 -2.10 0.07 0.00 -0.57 0.00 0.00 34.95 32.20 2fee s ARG 38 CO 0.00 0.40 0.01 -1.14 -1.08 0.00 0.00 175.30 173.50 2fee s GLN 39 N -3.16 1.10 0.12 3.89 0.74 0.93 -1.03 119.66 122.25 2fee s GLN 39 Ca 0.27 -0.88 -0.31 0.00 0.05 0.00 0.00 55.36 54.50 2fee s GLN 39 Cb -0.08 -2.34 -0.10 0.00 1.10 0.00 0.00 33.01 31.60 2fee s GLN 39 CO 0.16 -0.72 1.77 0.00 -0.55 0.00 0.00 175.29 175.96 2fee s ALA 40 N 1.57 3.77 0.22 1.58 0.00 -1.25 -1.63 121.76 126.01 2fee s ALA 40 Ca 0.00 1.42 -0.31 0.00 0.00 0.00 0.00 51.96 53.06 2fee s ALA 40 Cb -0.18 -3.74 -0.14 0.00 0.00 0.00 0.00 23.12 19.06 2fee s ALA 40 CO -0.11 -1.15 1.24 -2.30 0.00 0.00 0.00 175.76 173.44 2fee n PRO 41 N 5.39 1.55 -3.85 0.00 -0.02 -1.26 -1.98 135.00 134.83 2fee n PRO 41 Ca 0.17 0.55 -0.28 0.00 -2.02 0.00 0.00 63.50 61.92 2fee n PRO 41 Cb 0.38 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2fee n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fee n GLY 42 N 1.91 -1.25 0.22 -1.23 0.00 -1.26 -4.96 105.19 98.62 2fee n GLY 42 Ca 0.13 0.57 -0.00 0.00 0.00 0.00 0.00 46.02 46.71 2fee n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fee n LYS 43 N -2.98 0.03 -2.05 1.61 5.02 -0.84 -5.16 118.16 113.79 2fee n LYS 43 Ca -0.30 -0.07 -0.41 0.00 -2.02 0.00 0.00 58.31 55.51 2fee n LYS 43 Cb 0.68 0.10 -0.02 0.00 -0.02 0.00 0.00 35.03 35.77 2fee n LYS 43 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2fee s GLY 44 N -2.10 2.85 0.18 0.72 0.00 -1.26 -4.71 107.32 103.00 2fee s GLY 44 Ca 0.01 1.32 -0.30 0.00 0.00 0.00 0.00 44.72 45.75 2fee s GLY 44 CO 0.00 2.04 1.32 1.08 0.00 0.00 0.00 173.10 177.54 2fee s LEU 45 N -1.55 4.41 0.03 0.66 1.43 -1.26 -3.89 118.68 118.50 2fee s LEU 45 Ca 0.52 2.37 0.03 0.00 -1.03 0.00 0.00 54.13 56.02 2fee s LEU 45 Cb -0.41 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.18 2fee s LEU 45 CO 0.53 -0.54 -0.10 -0.54 0.23 0.00 0.00 176.35 175.92 2fee s LYS 46 N 0.13 0.70 -0.17 1.70 -0.14 -0.19 -5.01 119.74 116.75 2fee s LYS 46 Ca 0.58 -0.65 -0.13 0.00 -1.36 0.00 0.00 55.97 54.41 2fee s LYS 46 Cb -0.36 -0.63 -0.05 0.00 -1.68 0.00 0.00 37.83 35.11 2fee s LYS 46 CO 0.37 0.15 0.25 -0.46 -0.76 0.00 0.00 175.35 174.90 2fee s TRP 47 N -0.89 3.44 -0.15 3.18 -0.00 -1.26 -0.51 118.94 122.75 2fee s TRP 47 Ca -0.02 0.52 -0.14 0.00 -0.00 0.00 0.00 56.10 56.45 2fee s TRP 47 Cb -0.07 -2.30 -0.11 0.00 -0.00 0.00 0.00 33.47 30.98 2fee s TRP 47 CO 0.01 0.24 0.18 0.82 -0.00 0.00 0.00 176.95 178.19 2fee h ILE 48 N 4.70 0.63 -1.91 5.86 1.08 -0.60 -3.40 117.51 123.87 2fee h ILE 48 Ca -0.41 -1.59 0.29 0.00 -0.39 0.00 0.00 64.86 62.76 2fee h ILE 48 Cb 1.16 1.31 -0.06 0.00 -3.07 0.00 0.00 36.82 36.16 2fee h ILE 48 CO 0.76 0.21 0.75 0.61 -0.69 0.00 0.00 178.15 179.79 2fee n GLY 49 N 1.61 0.25 3.08 5.37 0.00 -1.14 -0.06 105.19 114.31 2fee n GLY 49 Ca -0.12 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 2fee n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2fee s GLU 50 N -2.01 0.53 -0.04 1.61 -1.05 0.28 -2.09 118.70 115.94 2fee s GLU 50 Ca 0.25 -0.81 -0.00 0.00 -0.15 0.00 0.00 54.97 54.26 2fee s GLU 50 Cb -0.00 0.20 0.03 0.00 -0.44 0.00 0.00 34.13 33.91 2fee s GLU 50 CO -0.01 -0.12 0.00 -1.50 0.95 0.00 0.00 175.26 174.58 2fee s ILE 51 N -2.60 0.20 0.85 1.83 2.07 -0.52 0.15 121.20 123.19 2fee s ILE 51 Ca -0.05 0.11 -0.12 0.00 -1.41 0.00 0.00 60.65 59.18 2fee s ILE 51 Cb -0.01 -0.32 0.10 0.00 0.13 0.00 0.00 42.46 42.36 2fee s ILE 51 CO -0.05 0.17 1.15 0.54 -1.91 0.00 0.00 174.94 174.84 2fee s ASN 52 N 1.27 4.04 0.21 4.50 2.20 0.12 -2.27 114.94 125.00 2fee s ASN 52 Ca -0.06 0.94 -0.05 0.00 -0.94 0.00 0.00 52.86 52.75 2fee s ASN 52 Cb -0.13 -1.52 0.16 0.00 -2.00 0.00 0.00 41.25 37.76 2fee s ASN 52 CO -0.02 -2.21 1.62 -0.65 -2.94 0.00 0.00 177.10 172.89 2fee h PRO 53 N -1.26 0.81 -0.67 3.55 0.11 -1.91 -0.99 132.00 131.64 2fee h PRO 53 Ca -0.48 -0.33 0.00 0.00 0.11 0.00 0.00 66.00 65.30 2fee h PRO 53 Cb 1.32 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2fee h PRO 53 CO 0.63 0.95 0.00 1.33 -0.21 0.00 0.00 178.00 180.70 2fee n VAL 54 N -4.11 0.41 -0.64 3.15 0.24 -1.26 -4.87 118.33 111.24 2fee n VAL 54 Ca 0.00 -0.23 -0.02 0.00 -2.04 0.00 0.00 64.34 62.04 2fee n VAL 54 Cb 0.44 -0.28 -0.01 0.00 -1.47 0.00 0.00 33.84 32.52 2fee n VAL 54 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2fee n SER 55 N 0.05 -2.65 -0.35 -1.34 7.64 -0.38 -4.73 113.62 111.85 2fee n SER 55 Ca 0.05 0.06 0.15 0.00 1.01 0.00 0.00 58.87 60.13 2fee n SER 55 Cb 0.33 -2.00 0.64 0.00 -1.01 0.00 0.00 64.21 62.16 2fee n SER 55 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2fee n SER 56 N 0.90 1.10 -3.74 6.43 3.41 -1.26 -4.71 113.62 115.75 2fee n SER 56 Ca -0.02 -1.36 -0.15 0.00 -0.26 0.00 0.00 58.87 57.07 2fee n SER 56 Cb 0.25 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.04 2fee n SER 56 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2fee s THR 57 N -2.00 -0.08 -0.13 6.66 2.01 -1.26 -5.05 115.64 115.78 2fee s THR 57 Ca 0.41 0.24 -0.04 0.00 0.31 0.00 0.00 61.69 62.61 2fee s THR 57 Cb 0.21 -0.18 0.05 0.00 0.01 0.00 0.00 72.50 72.59 2fee s THR 57 CO 0.35 0.10 0.11 -0.63 -0.69 0.00 0.00 174.62 173.86 2fee s ILE 58 N 1.37 -0.15 -0.06 1.82 1.01 -1.26 -0.71 121.20 123.23 2fee s ILE 58 Ca -0.06 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.72 2fee s ILE 58 Cb -0.12 -0.43 -0.01 0.00 0.01 0.00 0.00 42.46 41.90 2fee s ILE 58 CO -0.05 -0.08 -0.23 0.20 0.00 0.00 0.00 174.94 174.78 2fee s ASN 59 N 2.20 3.25 0.53 3.58 0.01 0.12 -4.95 114.94 119.69 2fee s ASN 59 Ca 0.04 -0.46 0.06 0.00 -0.71 0.00 0.00 52.86 51.79 2fee s ASN 59 Cb -0.14 -0.86 0.04 0.00 0.41 0.00 0.00 41.25 40.69 2fee s ASN 59 CO -0.07 0.26 0.45 -0.31 -1.51 0.00 0.00 177.10 175.92 2fee s TYR 60 N -0.23 1.72 0.67 2.20 1.51 -1.26 0.10 117.35 122.06 2fee s TYR 60 Ca -0.01 -0.79 -0.09 0.00 -1.01 0.00 0.00 57.07 55.18 2fee s TYR 60 Cb -0.13 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.76 2fee s TYR 60 CO 0.03 -0.52 1.01 -0.08 -1.11 0.00 0.00 175.55 174.88 2fee s THR 61 N -2.73 3.26 -0.69 -0.71 -1.32 0.92 -4.84 115.64 109.54 2fee s THR 61 Ca 0.39 0.14 -0.16 0.00 -1.21 0.00 0.00 61.69 60.85 2fee s THR 61 Cb -0.03 -3.36 -0.16 0.00 -1.51 0.00 0.00 72.50 67.44 2fee s THR 61 CO 0.24 -0.42 1.82 -2.65 -2.21 0.00 0.00 174.62 171.40 2fee n PRO 62 N -2.85 0.13 -3.83 7.08 -0.02 -1.26 -4.80 135.00 129.44 2fee n PRO 62 Ca 0.06 -0.84 -0.12 0.00 -2.02 0.00 0.00 63.50 60.58 2fee n PRO 62 Cb 0.58 -2.64 -0.12 0.00 -0.02 0.00 0.00 33.50 31.30 2fee n PRO 62 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2fee s SER 63 N 5.25 -0.11 0.69 2.55 0.15 -1.26 -5.15 113.70 115.83 2fee s SER 63 Ca 0.64 0.17 -0.16 0.00 0.70 0.00 0.00 55.95 57.30 2fee s SER 63 Cb -0.14 0.29 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 2fee s SER 63 CO 0.16 -0.14 0.82 0.18 1.20 0.00 0.00 173.24 175.47 2fee n LEU 64 N 2.59 2.69 0.00 3.45 4.77 -1.26 -4.88 117.00 124.36 2fee n LEU 64 Ca -0.15 0.67 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 2fee n LEU 64 Cb 0.58 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 2fee n LEU 64 CO 0.21 -2.35 0.01 0.29 -1.33 0.00 0.00 177.39 174.22 2fee n LYS 65 N -1.31 0.00 -0.94 3.23 5.02 -1.26 -2.17 118.16 120.73 2fee n LYS 65 Ca 0.12 0.03 0.04 0.00 -2.02 0.00 0.00 58.31 56.48 2fee n LYS 65 Cb 0.49 -0.09 0.38 0.00 -0.02 0.00 0.00 35.03 35.80 2fee n LYS 65 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2fee n ASP 66 N -0.27 5.56 0.00 4.39 9.92 -1.26 -4.57 116.55 130.32 2fee n ASP 66 Ca 0.00 -3.00 -0.10 0.00 -0.53 0.00 0.00 54.79 51.16 2fee n ASP 66 Cb 0.00 -0.70 -0.03 0.00 -0.64 0.00 0.00 41.12 39.74 2fee n ASP 66 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2fee h LYS 67 N 3.70 -0.31 -6.61 -1.24 1.63 -1.73 -3.38 116.57 108.63 2fee h LYS 67 Ca 0.06 0.02 -0.69 0.00 -0.85 0.00 0.00 60.65 59.20 2fee h LYS 67 Cb 2.08 0.07 -0.22 0.00 -0.60 0.00 0.00 32.23 33.55 2fee h LYS 67 CO 0.56 -0.21 -0.82 -0.06 -3.45 0.00 0.00 179.45 175.47 2fee s PHE 68 N -6.06 2.52 -0.31 1.91 0.40 -1.25 -1.58 117.98 113.60 2fee s PHE 68 Ca -0.15 -0.28 -0.03 0.00 -0.60 0.00 0.00 56.93 55.87 2fee s PHE 68 Cb 0.11 -1.44 0.11 0.00 0.51 0.00 0.00 43.02 42.31 2fee s PHE 68 CO 0.67 0.24 0.16 0.42 0.70 0.00 0.00 175.22 177.41 2fee s ILE 69 N -0.92 -0.00 0.18 0.64 1.01 -0.49 -4.95 121.20 116.66 2fee s ILE 69 Ca 0.14 -1.08 -0.18 0.00 0.00 0.00 0.00 60.65 59.54 2fee s ILE 69 Cb -0.10 -1.02 -0.08 0.00 0.01 0.00 0.00 42.46 41.27 2fee s ILE 69 CO 0.05 -0.82 0.65 -0.63 0.00 0.00 0.00 174.94 174.19 2fee s ILE 70 N 1.75 4.69 0.20 2.92 1.01 -1.26 -1.51 121.20 129.00 2fee s ILE 70 Ca 0.12 1.12 -0.23 0.00 0.00 0.00 0.00 60.65 61.66 2fee s ILE 70 Cb -0.18 -3.82 0.06 0.00 0.01 0.00 0.00 42.46 38.52 2fee s ILE 70 CO -0.24 0.26 0.93 -0.94 0.00 0.00 0.00 174.94 174.95 2fee s SER 71 N -1.61 -0.13 0.15 3.58 1.04 -1.21 -5.03 113.70 110.49 2fee s SER 71 Ca 0.39 -0.56 -0.17 0.00 0.48 0.00 0.00 55.95 56.10 2fee s SER 71 Cb -0.16 0.56 0.03 0.00 0.10 0.00 0.00 66.02 66.55 2fee s SER 71 CO 0.20 -1.05 0.45 0.00 0.98 0.00 0.00 173.24 173.82 2fee s ARG 72 N -3.05 1.18 -0.31 4.02 1.70 -1.26 -0.70 118.95 120.52 2fee s ARG 72 Ca 0.14 -0.75 -0.02 0.00 -0.47 0.00 0.00 55.73 54.63 2fee s ARG 72 Cb -0.03 0.49 0.11 0.00 -0.57 0.00 0.00 34.95 34.95 2fee s ARG 72 CO 0.04 -0.48 0.14 0.34 -1.08 0.00 0.00 175.30 174.27 2fee s ASP 73 N -2.83 3.57 0.59 -2.89 3.68 0.43 -4.99 116.67 114.23 2fee s ASP 73 Ca 0.05 -1.60 0.29 0.00 2.13 0.00 0.00 52.55 53.42 2fee s ASP 73 Cb 0.01 -0.52 1.74 0.00 -1.45 0.00 0.00 42.92 42.70 2fee s ASP 73 CO -0.09 -0.40 2.20 0.78 0.13 0.00 0.00 175.17 177.79 2fee h ASN 74 N 8.01 0.00 -0.55 -0.34 2.35 -1.93 0.16 115.58 123.28 2fee h ASN 74 Ca -0.13 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 2fee h ASN 74 Cb 1.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 2fee h ASN 74 CO 0.42 0.00 0.04 0.00 -1.65 0.00 0.00 177.43 176.24 2fee h ALA 75 N 1.93 0.74 -0.13 -0.83 0.00 -1.95 -2.49 119.26 116.54 2fee h ALA 75 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2fee h ALA 75 Cb 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2fee h ALA 75 CO -0.00 0.53 0.00 1.63 0.00 0.00 0.00 179.25 181.41 2fee n LYS 76 N -4.30 1.98 -3.70 0.00 5.02 -0.53 -4.97 118.16 111.66 2fee n LYS 76 Ca 0.02 -1.44 -0.30 0.00 -2.02 0.00 0.00 58.31 54.57 2fee n LYS 76 Cb 0.30 -1.46 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 2fee n LYS 76 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2fee n ASP 77 N 0.70 -4.63 -3.76 4.39 9.92 -0.07 -4.85 116.55 118.26 2fee n ASP 77 Ca 0.17 -1.00 -0.13 0.00 -0.53 0.00 0.00 54.79 53.30 2fee n ASP 77 Cb 0.45 -3.43 -0.08 0.00 -0.64 0.00 0.00 41.12 37.41 2fee n ASP 77 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2fee s THR 78 N -3.52 0.06 -0.09 -3.53 2.01 -1.02 -2.05 115.64 107.50 2fee s THR 78 Ca 0.40 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.93 2fee s THR 78 Cb -0.14 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.70 2fee s THR 78 CO 0.86 -0.28 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.11 2fee s LEU 79 N -1.44 1.87 0.24 4.42 2.96 -0.11 -0.43 118.68 126.19 2fee s LEU 79 Ca -0.12 -0.44 0.08 0.00 -0.22 0.00 0.00 54.13 53.43 2fee s LEU 79 Cb -0.04 -1.13 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2fee s LEU 79 CO 0.03 0.10 0.08 -0.31 -1.32 0.00 0.00 176.35 174.93 2fee s TYR 80 N 0.52 2.91 -0.04 5.38 1.51 0.13 -0.20 117.35 127.55 2fee s TYR 80 Ca -0.16 -0.15 -0.01 0.00 -1.01 0.00 0.00 57.07 55.73 2fee s TYR 80 Cb -0.17 -1.33 0.03 0.00 -0.11 0.00 0.00 41.96 40.39 2fee s TYR 80 CO 0.06 0.56 0.08 -1.17 -1.11 0.00 0.00 175.55 173.97 2fee s LEU 81 N -3.55 0.82 -0.25 -1.29 2.96 -0.43 -3.29 118.68 113.65 2fee s LEU 81 Ca 0.31 0.15 -0.07 0.00 -0.22 0.00 0.00 54.13 54.30 2fee s LEU 81 Cb -0.08 0.09 -0.03 0.00 0.50 0.00 0.00 46.19 46.68 2fee s LEU 81 CO 0.22 -0.15 0.06 -1.10 -1.32 0.00 0.00 176.35 174.06 2fee s GLN 82 N 1.25 3.64 -0.20 1.98 -0.21 -0.57 -1.38 119.66 124.17 2fee s GLN 82 Ca -0.07 -0.49 -0.10 0.00 0.02 0.00 0.00 55.36 54.72 2fee s GLN 82 Cb -0.12 -3.30 -0.05 0.00 1.00 0.00 0.00 33.01 30.54 2fee s GLN 82 CO -0.04 -0.19 0.13 0.42 -2.12 0.00 0.00 175.29 173.49 2fee s ILE 83 N 1.60 5.35 0.26 1.08 1.01 -1.14 -1.39 121.20 127.97 2fee s ILE 83 Ca 0.06 0.17 0.10 0.00 0.00 0.00 0.00 60.65 60.98 2fee s ILE 83 Cb -0.15 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 2fee s ILE 83 CO 0.03 0.44 -0.03 -0.44 0.00 0.00 0.00 174.94 174.94 2fee s SER 84 N 0.40 4.44 -0.59 3.58 0.01 -0.62 -2.78 113.70 118.15 2fee s SER 84 Ca 0.08 -0.68 -0.01 0.00 1.31 0.00 0.00 55.95 56.64 2fee s SER 84 Cb -0.11 -0.79 0.00 0.00 0.21 0.00 0.00 66.02 65.33 2fee s SER 84 CO -0.01 0.01 0.42 0.29 0.41 0.00 0.00 173.24 174.35 2fee n LYS 85 N -0.83 -1.04 -2.05 12.44 4.76 -0.81 -4.74 118.16 125.89 2fee n LYS 85 Ca -0.06 0.48 -0.38 0.00 -2.87 0.00 0.00 58.31 55.48 2fee n LYS 85 Cb 0.59 -1.52 0.01 0.00 -1.84 0.00 0.00 35.03 32.27 2fee n LYS 85 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2fee s VAL 86 N -2.75 2.65 0.30 -0.18 1.01 -0.91 -4.69 120.40 115.84 2fee s VAL 86 Ca 0.02 0.49 0.04 0.00 0.00 0.00 0.00 61.98 62.53 2fee s VAL 86 Cb -0.01 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 2fee s VAL 86 CO 0.63 -0.00 0.27 0.00 0.00 0.00 0.00 175.10 175.99 2fee s ARG 87 N -2.78 1.64 0.50 2.72 1.70 -1.26 0.01 118.95 121.48 2fee s ARG 87 Ca 0.67 -1.89 0.16 0.00 -0.47 0.00 0.00 55.73 54.20 2fee s ARG 87 Cb -0.34 0.33 1.21 0.00 -0.57 0.00 0.00 34.95 35.58 2fee s ARG 87 CO 0.41 -0.60 2.10 0.66 -1.08 0.00 0.00 175.30 176.79 2fee h SER 88 N 2.25 0.00 -0.88 -2.89 4.64 -1.97 -0.67 113.55 114.03 2fee h SER 88 Ca -0.28 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 61.27 2fee h SER 88 Cb 1.24 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.18 2fee h SER 88 CO 0.40 0.06 0.12 -0.33 -0.87 0.00 0.00 176.83 176.22 2fee h GLU 89 N 0.00 0.12 0.00 4.77 3.07 -1.96 -1.55 114.58 119.03 2fee h GLU 89 Ca -0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2fee h GLU 89 Cb 0.11 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 2fee h GLU 89 CO 0.01 0.08 0.00 -0.25 -1.40 0.00 0.00 179.01 177.44 2fee n ASP 90 N -5.33 0.00 -4.63 1.42 8.00 -0.26 -4.72 116.55 111.04 2fee n ASP 90 Ca 0.20 -1.03 -0.43 0.00 0.71 0.00 0.00 54.79 54.24 2fee n ASP 90 Cb 0.66 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.74 2fee n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2fee s THR 91 N -2.00 3.72 -0.08 -3.53 2.01 -0.58 -4.80 115.64 110.37 2fee s THR 91 Ca 0.41 0.80 -0.32 0.00 0.31 0.00 0.00 61.69 62.89 2fee s THR 91 Cb 0.19 -3.76 0.12 0.00 0.01 0.00 0.00 72.50 69.06 2fee s THR 91 CO 0.31 -0.34 1.08 0.00 -0.69 0.00 0.00 174.62 174.98 2fee s ALA 92 N 5.30 -1.97 -0.21 7.40 0.00 -0.50 -4.23 121.76 127.55 2fee s ALA 92 Ca 0.71 1.20 -0.25 0.00 0.00 0.00 0.00 51.96 53.62 2fee s ALA 92 Cb -0.24 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 2fee s ALA 92 CO 0.29 -0.70 0.85 -1.17 0.00 0.00 0.00 175.76 175.03 2fee s LEU 93 N -2.41 4.12 -0.33 0.00 2.96 -0.65 -1.68 118.68 120.69 2fee s LEU 93 Ca 0.08 1.12 -0.08 0.00 -0.22 0.00 0.00 54.13 55.03 2fee s LEU 93 Cb -0.01 -3.23 0.02 0.00 0.50 0.00 0.00 46.19 43.47 2fee s LEU 93 CO -0.06 -0.48 0.12 -0.31 -1.32 0.00 0.00 176.35 174.30 2fee s TYR 94 N 2.60 3.21 -0.08 5.38 2.02 0.02 -0.05 117.35 130.44 2fee s TYR 94 Ca 0.37 -1.13 -0.01 0.00 -0.37 0.00 0.00 57.07 55.93 2fee s TYR 94 Cb -0.16 -2.30 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 2fee s TYR 94 CO 0.09 -0.64 -0.03 0.71 -1.57 0.00 0.00 175.55 174.11 2fee s TYR 95 N 1.48 3.06 0.09 2.71 2.02 0.73 -2.17 117.35 125.27 2fee s TYR 95 Ca 0.01 0.10 -0.12 0.00 -0.37 0.00 0.00 57.07 56.69 2fee s TYR 95 Cb -0.18 -1.77 -0.06 0.00 -0.40 0.00 0.00 41.96 39.55 2fee s TYR 95 CO 0.04 0.38 0.45 0.00 -1.57 0.00 0.00 175.55 174.84 2fee s ALA 97 N -1.38 0.01 0.06 0.00 0.00 -0.20 -0.81 121.76 119.44 2fee s ALA 97 Ca 0.33 -0.55 -0.16 0.00 0.00 0.00 0.00 51.96 51.57 2fee s ALA 97 Cb -0.15 0.19 -0.06 0.00 0.00 0.00 0.00 23.12 23.10 2fee s ALA 97 CO 0.18 -0.25 0.51 -0.98 0.00 0.00 0.00 175.76 175.22 2fee s ARG 98 N -2.11 4.05 -0.09 0.00 1.70 -0.94 0.60 118.95 122.15 2fee s ARG 98 Ca -0.09 0.56 -0.14 0.00 -0.47 0.00 0.00 55.73 55.59 2fee s ARG 98 Cb -0.05 -3.16 -0.05 0.00 -0.57 0.00 0.00 34.95 31.12 2fee s ARG 98 CO -0.03 0.62 0.35 -0.51 -1.08 0.00 0.00 175.30 174.65 2fee s LEU 99 N -1.29 4.35 0.00 -1.89 1.43 0.15 -0.42 118.68 121.00 2fee s LEU 99 Ca 0.29 0.71 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 2fee s LEU 99 Cb -0.18 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.58 2fee s LEU 99 CO 0.17 0.20 0.00 0.00 0.23 0.00 0.00 176.35 176.95 2fee n TYR 100 N 2.80 -0.06 -3.81 0.29 9.36 -1.08 -4.23 117.16 120.43 2fee n TYR 100 Ca -0.13 0.00 -0.04 0.00 3.32 0.00 0.00 57.90 61.05 2fee n TYR 100 Cb 0.52 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.24 2fee n TYR 100 CO 0.00 0.00 0.00 1.52 0.22 0.00 0.00 176.86 178.60 2fee s TYR 101 N -1.99 -0.02 0.00 2.98 -0.85 -1.26 0.39 117.35 116.59 2fee s TYR 101 Ca 0.00 -0.37 0.00 0.00 -0.52 0.00 0.00 57.07 56.18 2fee s TYR 101 Cb 0.00 0.69 0.00 0.00 0.38 0.00 0.00 41.96 43.03 2fee s TYR 101 CO 0.00 -0.98 0.00 0.41 -1.52 0.00 0.00 175.55 173.46 2fee n GLY 102 N -0.56 0.20 0.23 5.49 0.00 -1.26 -4.81 105.19 104.47 2fee n GLY 102 Ca -0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.12 2fee n GLY 102 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2fee h TYR 103 N 0.00 0.00 0.00 1.61 0.05 -2.03 -3.47 116.97 113.13 2fee h TYR 103 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2fee h TYR 103 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2fee h TYR 103 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 2fee n GLY 104 N 0.45 1.02 3.60 3.88 0.00 -1.26 -5.09 105.19 107.79 2fee n GLY 104 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2fee n GLY 104 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fee s TYR 105 N -1.82 3.24 0.57 1.61 1.51 -1.26 -5.03 117.35 116.17 2fee s TYR 105 Ca 0.00 0.54 -0.17 0.00 -1.01 0.00 0.00 57.07 56.43 2fee s TYR 105 Cb 0.00 -2.79 -0.05 0.00 -0.11 0.00 0.00 41.96 39.01 2fee s TYR 105 CO 0.00 -0.35 1.07 -1.58 -1.11 0.00 0.00 175.55 173.58 2fee s TRP 106 N 2.36 2.91 0.40 2.71 0.52 -1.26 -4.39 118.94 122.18 2fee s TRP 106 Ca 0.21 1.54 0.04 0.00 0.02 0.00 0.00 56.10 57.90 2fee s TRP 106 Cb -0.15 -3.08 -0.04 0.00 -1.15 0.00 0.00 33.47 29.05 2fee s TRP 106 CO 0.10 -1.17 0.06 1.52 0.02 0.00 0.00 176.95 177.49 2fee s TYR 107 N -2.24 1.97 -0.49 -1.98 -0.85 0.16 -4.95 117.35 108.97 2fee s TYR 107 Ca 0.66 -1.02 -0.17 0.00 -0.52 0.00 0.00 57.07 56.02 2fee s TYR 107 Cb -0.18 -1.37 0.07 0.00 0.38 0.00 0.00 41.96 40.87 2fee s TYR 107 CO 0.32 0.01 0.49 -0.06 -1.52 0.00 0.00 175.55 174.79 2fee s PHE 108 N -3.11 3.17 0.00 -3.49 0.40 -1.26 -2.65 117.98 111.03 2fee s PHE 108 Ca 0.27 -0.83 0.00 0.00 -0.60 0.00 0.00 56.93 55.77 2fee s PHE 108 Cb 0.06 -3.37 0.00 0.00 0.51 0.00 0.00 43.02 40.22 2fee s PHE 108 CO 0.13 -0.91 0.58 -3.47 0.70 0.00 0.00 175.22 172.25 2fee n ASP 109 N 5.57 0.00 -4.05 1.36 2.03 0.44 -4.82 116.55 117.06 2fee n ASP 109 Ca -0.11 0.67 -0.28 0.00 0.52 0.00 0.00 54.79 55.59 2fee n ASP 109 Cb 0.44 -0.31 -0.17 0.00 -0.72 0.00 0.00 41.12 40.36 2fee n ASP 109 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2fee s VAL 110 N -1.77 1.42 0.05 5.18 1.01 -1.24 -4.98 120.40 120.07 2fee s VAL 110 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2fee s VAL 110 Cb 0.00 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2fee s VAL 110 CO 0.00 0.42 0.17 0.26 0.00 0.00 0.00 175.10 175.96 2fee s TRP 111 N 0.89 3.44 1.00 5.22 0.52 -1.26 -2.23 118.94 126.53 2fee s TRP 111 Ca -0.09 0.23 -0.15 0.00 0.02 0.00 0.00 56.10 56.11 2fee s TRP 111 Cb -0.15 -1.74 0.19 0.00 -1.15 0.00 0.00 33.47 30.62 2fee s TRP 111 CO 0.00 0.58 1.15 0.20 0.02 0.00 0.00 176.95 178.91 2fee s GLY 112 N -2.38 1.61 0.13 0.98 0.00 0.01 -4.75 107.32 102.91 2fee s GLY 112 Ca 0.32 -0.71 -0.13 0.00 0.00 0.00 0.00 44.72 44.20 2fee s GLY 112 CO 0.25 -0.03 1.48 0.00 0.00 0.00 0.00 173.10 174.80 2fee h ALA 113 N -1.84 0.54 0.00 3.20 0.00 -1.90 -3.45 119.26 115.81 2fee h ALA 113 Ca -0.49 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.03 2fee h ALA 113 Cb 1.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2fee h ALA 113 CO 0.51 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.70 2fee n GLY 114 N 0.02 3.26 2.99 0.00 0.00 -1.26 -4.95 105.19 105.23 2fee n GLY 114 Ca -0.02 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.88 2fee n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fee s THR 115 N -2.87 0.47 -0.10 2.61 -4.23 -0.92 -4.80 115.64 105.80 2fee s THR 115 Ca 0.00 -0.43 -0.15 0.00 -1.18 0.00 0.00 61.69 59.93 2fee s THR 115 Cb 0.00 -0.43 -0.05 0.00 1.34 0.00 0.00 72.50 73.36 2fee s THR 115 CO 0.00 0.01 0.37 -0.89 -0.54 0.00 0.00 174.62 173.58 2fee s THR 116 N -0.41 5.20 -0.21 3.99 2.01 -1.26 -0.80 115.64 124.16 2fee s THR 116 Ca -0.00 0.73 -0.03 0.00 0.31 0.00 0.00 61.69 62.70 2fee s THR 116 Cb -0.04 -3.70 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 2fee s THR 116 CO -0.00 0.44 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.61 2fee s VAL 117 N 0.00 3.19 -0.18 3.82 1.01 -0.68 -0.16 120.40 127.41 2fee s VAL 117 Ca 0.21 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 2fee s VAL 117 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 2fee s VAL 117 CO 0.08 0.44 -0.05 -0.89 0.00 0.00 0.00 175.10 174.69 2fee s THR 118 N 1.43 3.61 -0.41 3.92 2.01 0.23 -1.41 115.64 125.01 2fee s THR 118 Ca 0.05 -0.44 -0.05 0.00 0.31 0.00 0.00 61.69 61.56 2fee s THR 118 Cb -0.14 -2.60 0.10 0.00 0.01 0.00 0.00 72.50 69.87 2fee s THR 118 CO -0.04 0.46 0.22 -0.69 -0.69 0.00 0.00 174.62 173.88 2fee s VAL 119 N 0.83 3.59 -0.24 3.82 1.01 -1.26 -1.31 120.40 126.84 2fee s VAL 119 Ca -0.01 -1.82 -0.20 0.00 0.00 0.00 0.00 61.98 59.95 2fee s VAL 119 Cb -0.15 -3.35 0.06 0.00 0.00 0.00 0.00 36.38 32.95 2fee s VAL 119 CO 0.02 -0.61 0.62 -0.55 0.00 0.00 0.00 175.10 174.58 2fee s SER 120 N 1.97 -0.70 0.25 3.32 0.15 -0.13 -4.56 113.70 114.00 2fee s SER 120 Ca 0.05 1.28 0.13 0.00 0.70 0.00 0.00 55.95 58.12 2fee s SER 120 Cb -0.23 1.26 0.12 0.00 -1.71 0.00 0.00 66.02 65.46 2fee s SER 120 CO -0.02 -0.22 1.46 0.77 1.20 0.00 0.00 173.24 176.43 2fee h SER 121 N 5.65 0.00 -0.81 5.45 4.64 -1.94 -3.35 113.55 123.20 2fee h SER 121 Ca -0.29 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.48 2fee h SER 121 Cb 1.18 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.36 2fee h SER 121 CO 0.13 0.62 -0.42 0.00 -0.87 0.00 0.00 176.83 176.28 2fee n ALA 122 N -2.28 -2.53 -2.59 5.18 0.00 -1.26 -4.96 120.51 112.07 2fee n ALA 122 Ca 0.01 0.36 -0.38 0.00 0.00 0.00 0.00 53.44 53.43 2fee n ALA 122 Cb 0.74 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.83 2fee n ALA 122 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2fee s LYS 123 N -0.80 4.02 0.33 0.00 3.01 -1.26 -5.04 119.74 120.00 2fee s LYS 123 Ca 0.52 0.35 -0.26 0.00 -1.01 0.00 0.00 55.97 55.58 2fee s LYS 123 Cb -0.76 -3.29 -0.14 0.00 -1.01 0.00 0.00 37.83 32.64 2fee s LYS 123 CO 0.45 0.54 0.75 2.41 0.51 0.00 0.00 175.35 180.01 2fee n THR 124 N 2.39 1.94 -3.61 2.17 -1.04 -1.26 -4.73 114.28 110.14 2fee n THR 124 Ca -0.13 -0.50 -0.02 0.00 -2.04 0.00 0.00 64.05 61.36 2fee n THR 124 Cb 0.52 -0.65 -0.05 0.00 -1.82 0.00 0.00 70.33 68.33 2fee n THR 124 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2fee s THR 125 N -1.20 -0.68 0.89 12.58 2.01 0.52 -4.95 115.64 124.81 2fee s THR 125 Ca 0.61 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.51 2fee s THR 125 Cb -0.70 -1.00 0.13 0.00 0.01 0.00 0.00 72.50 70.93 2fee s THR 125 CO 0.58 0.00 1.11 -2.16 -0.69 0.00 0.00 174.62 173.46 2fee s PRO 126 N 2.50 1.27 0.26 4.92 0.04 -1.26 -1.80 135.00 140.93 2fee s PRO 126 Ca -0.07 1.26 -0.02 0.00 0.04 0.00 0.00 61.00 62.21 2fee s PRO 126 Cb -0.09 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 2fee s PRO 126 CO -0.19 -2.36 0.48 -1.25 0.04 0.00 0.00 177.00 173.73 2fee s PRO 127 N -4.76 3.56 -0.17 0.56 0.04 -1.26 -4.09 135.00 128.88 2fee s PRO 127 Ca 0.65 -0.20 -0.06 0.00 0.04 0.00 0.00 61.00 61.43 2fee s PRO 127 Cb -0.20 -2.73 -0.03 0.00 0.04 0.00 0.00 34.50 31.57 2fee s PRO 127 CO 0.58 0.28 0.02 -1.12 0.04 0.00 0.00 177.00 176.80 2fee s SER 128 N -3.31 5.27 -0.34 6.66 0.01 0.54 -4.95 113.70 117.58 2fee s SER 128 Ca 0.41 -0.01 -0.10 0.00 1.31 0.00 0.00 55.95 57.56 2fee s SER 128 Cb -0.11 -1.88 0.01 0.00 0.21 0.00 0.00 66.02 64.25 2fee s SER 128 CO 0.30 0.18 0.17 -0.69 0.41 0.00 0.00 173.24 173.61 2fee s VAL 129 N 0.34 4.56 -0.16 3.43 1.01 -1.26 -1.82 120.40 126.50 2fee s VAL 129 Ca 0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2fee s VAL 129 Cb -0.13 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 2fee s VAL 129 CO 0.01 -0.06 -0.13 -0.31 0.00 0.00 0.00 175.10 174.62 2fee s TYR 130 N 1.58 2.82 0.74 5.22 2.02 -0.50 -4.95 117.35 124.29 2fee s TYR 130 Ca 0.03 -0.88 -0.11 0.00 -0.37 0.00 0.00 57.07 55.74 2fee s TYR 130 Cb -0.18 -1.90 0.04 0.00 -0.40 0.00 0.00 41.96 39.51 2fee s TYR 130 CO 0.06 -0.39 1.09 -1.25 -1.57 0.00 0.00 175.55 173.49 2fee s PRO 131 N 0.74 2.47 -0.45 -1.71 0.04 -1.26 -0.27 135.00 134.56 2fee s PRO 131 Ca -0.06 1.17 0.09 0.00 0.04 0.00 0.00 61.00 62.24 2fee s PRO 131 Cb -0.15 -1.92 0.32 0.00 0.04 0.00 0.00 34.50 32.78 2fee s PRO 131 CO 0.01 -1.48 0.74 1.28 0.04 0.00 0.00 177.00 177.60 2fee n LEU 132 N -3.26 1.82 -4.76 -3.56 4.77 0.36 -4.78 117.00 107.59 2fee n LEU 132 Ca 0.09 -5.14 -0.39 0.00 -0.03 0.00 0.00 56.01 50.54 2fee n LEU 132 Cb 0.53 0.28 0.02 0.00 -2.33 0.00 0.00 43.42 41.91 2fee n LEU 132 CO 0.53 2.24 1.00 0.00 -1.33 0.00 0.00 177.39 179.83 2fee s ALA 133 N -2.42 3.11 0.45 -1.18 0.00 -1.26 -3.75 121.76 116.70 2fee s ALA 133 Ca 0.41 1.33 -0.22 0.00 0.00 0.00 0.00 51.96 53.48 2fee s ALA 133 Cb 0.28 -3.54 -0.08 0.00 0.00 0.00 0.00 23.12 19.77 2fee s ALA 133 CO -0.09 -1.11 1.07 -2.14 0.00 0.00 0.00 175.76 173.49 2fee s PRO 134 N -2.55 3.90 0.72 0.00 0.02 -1.26 -4.85 135.00 130.99 2fee s PRO 134 Ca 0.63 1.51 -0.11 0.00 0.02 0.00 0.00 61.00 63.06 2fee s PRO 134 Cb -0.40 -2.31 0.02 0.00 0.02 0.00 0.00 34.50 31.83 2fee s PRO 134 CO 0.50 -0.38 1.07 0.20 -0.33 0.00 0.00 177.00 178.07 2fee s GLY 135 N -1.69 1.66 0.00 0.52 0.00 -1.26 -4.03 107.32 102.51 2fee s GLY 135 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2fee s GLY 135 CO 0.26 0.34 0.25 1.44 0.00 0.00 0.00 173.10 175.39 2fee n SER 136 N -3.21 0.74 0.00 1.64 7.64 -1.26 -1.89 113.62 117.28 2fee n SER 136 Ca 0.07 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.45 2fee n SER 136 Cb 0.54 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2fee n SER 136 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fee n ALA 137 N 0.87 1.20 -2.90 -0.43 0.00 -1.26 -5.08 120.51 112.91 2fee n ALA 137 Ca 0.00 -0.14 -0.33 0.00 0.00 0.00 0.00 53.44 52.97 2fee n ALA 137 Cb 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.45 2fee n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fee s ALA 138 N -0.26 2.86 -0.70 0.00 0.00 -0.79 -5.08 121.76 117.79 2fee s ALA 138 Ca 0.00 -0.86 -0.21 0.00 0.00 0.00 0.00 51.96 50.89 2fee s ALA 138 Cb 0.00 -1.36 0.09 0.00 0.00 0.00 0.00 23.12 21.85 2fee s ALA 138 CO 0.00 0.31 0.95 0.00 0.00 0.00 0.00 175.76 177.02 2fee s ALA 139 N 0.09 3.20 -0.46 0.00 0.00 -1.26 -4.94 121.76 118.40 2fee s ALA 139 Ca -0.03 -2.06 -0.42 0.00 0.00 0.00 0.00 51.96 49.45 2fee s ALA 139 Cb -0.14 -3.84 -0.17 0.00 0.00 0.00 0.00 23.12 18.96 2fee s ALA 139 CO 0.03 -2.75 2.11 0.00 0.00 0.00 0.00 175.76 175.16 2fee n ALA 140 N 7.30 0.31 -1.33 0.00 0.00 -1.26 -4.95 120.51 120.59 2fee n ALA 140 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2fee n ALA 140 Cb 0.46 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2fee n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fee n ALA 141 N 7.77 0.00 0.07 0.00 0.00 -1.26 -5.01 120.51 122.08 2fee n ALA 141 Ca 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.91 2fee n ALA 141 Cb 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 2fee n ALA 141 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2fee h SER 142 N 0.00 -0.15 -2.90 0.00 0.02 -1.97 -3.40 113.55 105.14 2fee h SER 142 Ca 0.00 0.01 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 2fee h SER 142 Cb 0.00 0.04 -0.07 0.00 0.14 0.00 0.00 62.40 62.51 2fee h SER 142 CO 0.00 -0.08 -0.35 -0.04 -1.14 0.00 0.00 176.83 175.22 2fee s MET 143 N -2.79 3.77 -0.22 3.45 1.00 -1.26 0.73 119.30 123.98 2fee s MET 143 Ca -0.03 0.11 -0.09 0.00 0.00 0.00 0.00 55.69 55.68 2fee s MET 143 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 34.83 31.54 2fee s MET 143 CO 0.08 0.65 0.11 0.54 0.00 0.00 0.00 175.02 176.40 2fee s VAL 144 N -0.77 5.04 -0.23 -6.03 0.11 0.57 -4.67 120.40 114.41 2fee s VAL 144 Ca 0.18 0.06 -0.17 0.00 -2.93 0.00 0.00 61.98 59.13 2fee s VAL 144 Cb -0.14 -3.32 -0.03 0.00 -1.53 0.00 0.00 36.38 31.36 2fee s VAL 144 CO 0.07 0.39 0.46 -0.89 -3.33 0.00 0.00 175.10 171.80 2fee s THR 145 N 0.88 5.13 0.00 5.04 2.01 -1.26 -0.80 115.64 126.64 2fee s THR 145 Ca 0.06 0.81 0.00 0.00 0.31 0.00 0.00 61.69 62.87 2fee s THR 145 Cb -0.13 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.59 2fee s THR 145 CO 0.03 0.17 0.00 0.18 -0.69 0.00 0.00 174.62 174.31 2fee n LEU 146 N 4.96 0.00 0.00 4.42 4.77 -1.25 -4.46 117.00 125.45 2fee n LEU 146 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2fee n LEU 146 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2fee n LEU 146 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2fee n GLY 147 N 5.00 3.36 3.11 -0.72 0.00 -1.25 -3.86 105.19 110.83 2fee n GLY 147 Ca 0.00 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.79 2fee n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fee s LEU 149 N -1.63 3.75 -0.66 0.00 2.96 0.62 -0.76 118.68 122.96 2fee s LEU 149 Ca -0.06 -0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 53.70 2fee s LEU 149 Cb -0.10 -2.02 0.17 0.00 0.50 0.00 0.00 46.19 44.75 2fee s LEU 149 CO 0.01 -0.01 0.52 -0.69 -1.32 0.00 0.00 176.35 174.87 2fee s VAL 150 N 1.49 4.37 -0.13 1.68 1.01 0.12 -1.41 120.40 127.53 2fee s VAL 150 Ca 0.06 -2.63 -0.05 0.00 0.00 0.00 0.00 61.98 59.37 2fee s VAL 150 Cb -0.15 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2fee s VAL 150 CO 0.06 -0.91 0.04 -0.75 0.00 0.00 0.00 175.10 173.55 2fee s LYS 151 N 0.23 3.47 0.00 2.72 2.20 -0.76 -1.67 119.74 125.93 2fee s LYS 151 Ca 0.15 -0.35 0.00 0.00 -0.36 0.00 0.00 55.97 55.42 2fee s LYS 151 Cb -0.18 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.12 2fee s LYS 151 CO -0.05 0.52 0.00 0.41 -0.36 0.00 0.00 175.35 175.88 2fee n GLY 152 N 2.73 0.92 3.95 5.54 0.00 -0.13 -0.34 105.19 117.85 2fee n GLY 152 Ca -0.18 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 2fee n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2fee s TYR 153 N -2.37 2.80 -0.28 1.61 -0.85 -0.81 -4.48 117.35 112.97 2fee s TYR 153 Ca 0.00 -0.41 -0.21 0.00 -0.52 0.00 0.00 57.07 55.92 2fee s TYR 153 Cb 0.00 -2.23 0.12 0.00 0.38 0.00 0.00 41.96 40.23 2fee s TYR 153 CO 0.00 -0.24 0.97 0.12 -1.52 0.00 0.00 175.55 174.89 2fee s PHE 154 N -2.38 -0.57 0.55 -3.49 5.36 -0.74 0.11 117.98 116.82 2fee s PHE 154 Ca 0.51 1.27 0.08 0.00 -0.96 0.00 0.00 56.93 57.83 2fee s PHE 154 Cb -0.07 0.37 0.07 0.00 -0.34 0.00 0.00 43.02 43.05 2fee s PHE 154 CO 0.30 -0.28 0.66 -1.25 -1.46 0.00 0.00 175.22 173.20 2fee s PRO 155 N 0.72 2.33 0.46 10.12 0.04 -1.26 -0.35 135.00 147.07 2fee s PRO 155 Ca -0.02 -1.71 -0.22 0.00 0.04 0.00 0.00 61.00 59.09 2fee s PRO 155 Cb -0.05 -2.50 -0.10 0.00 0.04 0.00 0.00 34.50 31.89 2fee s PRO 155 CO -0.10 -0.73 0.74 0.39 0.04 0.00 0.00 177.00 177.33 2fee n GLU 156 N -2.07 0.84 -4.17 4.56 -0.58 -1.26 -4.70 120.64 113.27 2fee n GLU 156 Ca 0.10 0.31 -0.23 0.00 -0.42 0.00 0.00 57.16 56.93 2fee n GLU 156 Cb 0.62 -1.78 -0.06 0.00 -0.57 0.00 0.00 31.44 29.65 2fee n GLU 156 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2fee s PRO 157 N -1.93 2.52 0.12 3.49 0.04 -1.26 -5.03 135.00 132.95 2fee s PRO 157 Ca 0.65 -1.33 0.05 0.00 0.04 0.00 0.00 61.00 60.42 2fee s PRO 157 Cb -0.54 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.66 2fee s PRO 157 CO 0.56 0.31 0.04 0.14 0.04 0.00 0.00 177.00 178.08 2fee s VAL 158 N -2.29 4.13 -0.19 -0.36 -7.23 -1.26 -4.47 120.40 108.73 2fee s VAL 158 Ca 0.34 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.44 2fee s VAL 158 Cb -0.06 -3.02 -0.01 0.00 0.56 0.00 0.00 36.38 33.85 2fee s VAL 158 CO 0.22 0.04 -0.08 0.42 -0.31 0.00 0.00 175.10 175.40 2fee s THR 159 N -1.47 3.22 -0.19 5.32 -4.23 0.53 -4.97 115.64 113.84 2fee s THR 159 Ca 0.28 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.22 2fee s THR 159 Cb -0.11 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.32 2fee s THR 159 CO 0.20 0.46 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.89 2fee s VAL 160 N 1.11 2.33 0.22 2.29 1.01 -1.26 -1.47 120.40 124.64 2fee s VAL 160 Ca 0.01 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.14 2fee s VAL 160 Cb -0.15 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 2fee s VAL 160 CO -0.01 0.48 -0.03 0.42 0.00 0.00 0.00 175.10 175.95 2fee s THR 161 N 1.32 1.18 -0.05 3.92 -4.23 -0.32 -4.96 115.64 112.50 2fee s THR 161 Ca 0.04 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 58.54 2fee s THR 161 Cb -0.14 -2.27 -0.01 0.00 1.34 0.00 0.00 72.50 71.43 2fee s THR 161 CO -0.11 -0.40 -0.20 0.26 -0.54 0.00 0.00 174.62 173.63 2fee s TRP 162 N -3.32 1.98 -1.05 3.99 0.52 -1.26 -0.54 118.94 119.26 2fee s TRP 162 Ca 0.26 -0.59 -0.16 0.00 0.02 0.00 0.00 56.10 55.63 2fee s TRP 162 Cb 0.05 -1.32 -0.01 0.00 -1.15 0.00 0.00 33.47 31.03 2fee s TRP 162 CO 0.08 -0.20 0.76 0.09 0.02 0.00 0.00 176.95 177.70 2fee n ASN 163 N 3.11 -5.62 -3.91 2.95 3.02 -1.05 -1.27 115.26 112.50 2fee n ASN 163 Ca -0.18 -0.89 -0.26 0.00 -0.03 0.00 0.00 54.58 53.22 2fee n ASN 163 Cb 0.53 -3.43 -0.08 0.00 -0.61 0.00 0.00 39.78 36.19 2fee n ASN 163 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2fee n SER 164 N -2.56 0.37 0.00 6.41 7.64 -1.26 -0.92 113.62 123.30 2fee n SER 164 Ca -0.11 -0.99 0.00 0.00 1.01 0.00 0.00 58.87 58.78 2fee n SER 164 Cb 0.59 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 2fee n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fee n GLY 165 N -2.01 0.59 0.22 0.23 0.00 -0.40 -4.84 105.19 98.99 2fee n GLY 165 Ca -0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.94 2fee n GLY 165 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2fee h SER 166 N 0.00 0.00 -1.64 1.61 4.64 -0.86 -3.24 113.55 114.05 2fee h SER 166 Ca 0.00 0.00 -0.76 0.00 -0.47 0.00 0.00 61.79 60.56 2fee h SER 166 Cb 0.02 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 61.92 2fee h SER 166 CO 0.00 0.14 1.72 -0.11 -0.87 0.00 0.00 176.83 177.71 2fee n LEU 167 N -3.19 7.69 0.07 5.97 7.94 -0.98 -4.75 117.00 129.76 2fee n LEU 167 Ca 0.02 -5.07 0.09 0.00 -1.11 0.00 0.00 56.01 49.94 2fee n LEU 167 Cb 0.49 -1.27 0.40 0.00 0.53 0.00 0.00 43.42 43.57 2fee n LEU 167 CO 0.33 2.04 0.79 0.00 -1.11 0.00 0.00 177.39 179.44 2fee n ALA 168 N 0.87 1.58 -2.40 1.96 0.00 -1.23 -4.78 120.51 116.52 2fee n ALA 168 Ca 0.55 0.04 -0.39 0.00 0.00 0.00 0.00 53.44 53.64 2fee n ALA 168 Cb 0.26 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.35 2fee n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fee s ALA 169 N -3.19 3.52 -1.22 0.00 0.00 -1.26 -4.39 121.76 115.21 2fee s ALA 169 Ca 0.05 0.04 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 2fee s ALA 169 Cb 0.09 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.51 2fee s ALA 169 CO 0.31 0.25 1.05 0.41 0.00 0.00 0.00 175.76 177.77 2fee n GLY 170 N 2.18 -0.39 3.69 0.00 0.00 -1.26 -4.77 105.19 104.64 2fee n GLY 170 Ca -0.08 0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2fee n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fee s VAL 171 N -3.28 4.26 -0.18 1.61 1.01 -1.26 -1.98 120.40 120.57 2fee s VAL 171 Ca 0.52 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 2fee s VAL 171 Cb -0.23 -2.88 0.05 0.00 0.00 0.00 0.00 36.38 33.32 2fee s VAL 171 CO 0.64 0.42 0.02 -1.00 0.00 0.00 0.00 175.10 175.18 2fee s HIS 172 N -1.06 1.14 -0.25 5.22 3.76 -0.94 -4.97 115.29 118.19 2fee s HIS 172 Ca 0.19 -0.85 -0.23 0.00 -0.15 0.00 0.00 55.06 54.01 2fee s HIS 172 Cb -0.12 -1.06 -0.01 0.00 1.11 0.00 0.00 32.58 32.50 2fee s HIS 172 CO 0.09 -0.58 0.78 0.99 -0.85 0.00 0.00 174.74 175.17 2fee s THR 173 N 1.82 4.87 0.78 1.30 2.01 -1.26 0.52 115.64 125.68 2fee s THR 173 Ca -0.00 1.45 -0.12 0.00 0.31 0.00 0.00 61.69 63.33 2fee s THR 173 Cb -0.16 -4.07 0.06 0.00 0.01 0.00 0.00 72.50 68.33 2fee s THR 173 CO -0.07 -0.05 1.12 -0.36 -0.69 0.00 0.00 174.62 174.56 2fee s PHE 174 N 2.77 3.02 0.70 4.92 0.08 -0.58 -5.01 117.98 123.88 2fee s PHE 174 Ca 0.33 0.98 -0.16 0.00 0.12 0.00 0.00 56.93 58.20 2fee s PHE 174 Cb -0.15 -3.23 0.02 0.00 -0.57 0.00 0.00 43.02 39.10 2fee s PHE 174 CO 0.08 -1.61 1.21 -2.14 -0.10 0.00 0.00 175.22 172.66 2fee s PRO 175 N -5.35 2.30 0.48 0.24 0.02 -1.26 -4.67 135.00 126.75 2fee s PRO 175 Ca 0.60 1.78 -0.20 0.00 0.02 0.00 0.00 61.00 63.20 2fee s PRO 175 Cb -0.12 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.46 2fee s PRO 175 CO 0.52 -1.72 1.00 0.00 -0.33 0.00 0.00 177.00 176.47 2fee s ALA 176 N -1.91 2.95 -0.06 -1.55 0.00 -1.26 -4.67 121.76 115.27 2fee s ALA 176 Ca 0.75 0.45 0.06 0.00 0.00 0.00 0.00 51.96 53.22 2fee s ALA 176 Cb -0.30 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 2fee s ALA 176 CO 0.43 -0.16 -0.25 0.14 0.00 0.00 0.00 175.76 175.92 2fee s VAL 177 N -2.18 2.09 0.18 0.00 -7.23 -0.48 -4.93 120.40 107.85 2fee s VAL 177 Ca 0.64 -1.06 -0.30 0.00 -1.81 0.00 0.00 61.98 59.45 2fee s VAL 177 Cb -0.12 -1.75 -0.08 0.00 0.56 0.00 0.00 36.38 34.99 2fee s VAL 177 CO 0.20 0.57 0.98 -0.22 -0.31 0.00 0.00 175.10 176.32 2fee s LEU 178 N -0.19 4.57 -0.07 1.32 2.96 -1.26 -1.36 118.68 124.64 2fee s LEU 178 Ca -0.03 1.92 -0.04 0.00 -0.22 0.00 0.00 54.13 55.77 2fee s LEU 178 Cb -0.14 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 42.99 2fee s LEU 178 CO 0.03 0.01 0.16 -1.58 -1.32 0.00 0.00 176.35 173.65 2fee s GLN 179 N -0.63 0.13 -1.16 1.98 0.74 0.25 -4.94 119.66 116.03 2fee s GLN 179 Ca 0.45 0.35 -0.00 0.00 0.05 0.00 0.00 55.36 56.21 2fee s GLN 179 Cb -0.26 -0.10 0.00 0.00 1.10 0.00 0.00 33.01 33.75 2fee s GLN 179 CO 0.32 -0.13 0.00 0.00 -0.55 0.00 0.00 175.29 174.94 2fee n ALA 180 N 3.89 -1.75 -1.45 1.58 0.00 -1.26 -0.03 120.51 121.49 2fee n ALA 180 Ca -0.23 -0.31 -0.11 0.00 0.00 0.00 0.00 53.44 52.79 2fee n ALA 180 Cb 0.54 -0.60 -0.04 0.00 0.00 0.00 0.00 19.45 19.35 2fee n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fee n ALA 181 N -3.68 -0.19 -2.78 0.00 0.00 -1.26 -5.05 120.51 107.55 2fee n ALA 181 Ca -0.24 0.17 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 2fee n ALA 181 Cb 0.52 -1.35 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 2fee n ALA 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fee s LEU 182 N -2.65 2.30 -0.05 0.00 1.43 0.96 -4.83 118.68 115.83 2fee s LEU 182 Ca 0.00 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.45 2fee s LEU 182 Cb 0.00 0.08 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 2fee s LEU 182 CO 0.00 -0.35 0.15 -0.31 0.23 0.00 0.00 176.35 176.07 2fee s TYR 183 N -1.96 3.51 -0.07 0.29 1.51 0.30 0.86 117.35 121.79 2fee s TYR 183 Ca -0.10 0.38 0.02 0.00 -1.01 0.00 0.00 57.07 56.36 2fee s TYR 183 Cb -0.06 -1.85 0.02 0.00 -0.11 0.00 0.00 41.96 39.95 2fee s TYR 183 CO -0.03 0.65 -0.10 0.99 -1.11 0.00 0.00 175.55 175.96 2fee s THR 184 N -1.19 1.02 0.09 -0.71 2.01 -0.47 -0.95 115.64 115.44 2fee s THR 184 Ca 0.22 -0.40 0.05 0.00 0.31 0.00 0.00 61.69 61.88 2fee s THR 184 Cb -0.12 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 71.40 2fee s THR 184 CO 0.13 0.33 -0.13 -1.48 -0.69 0.00 0.00 174.62 172.78 2fee s LEU 185 N 0.82 2.35 0.25 4.42 0.05 -0.67 -1.38 118.68 124.52 2fee s LEU 185 Ca -0.12 -0.72 0.10 0.00 0.05 0.00 0.00 54.13 53.44 2fee s LEU 185 Cb -0.15 -0.48 -0.05 0.00 -2.05 0.00 0.00 46.19 43.46 2fee s LEU 185 CO 0.02 -0.14 -0.11 -0.94 -0.55 0.00 0.00 176.35 174.63 2fee s SER 186 N -2.14 4.08 -0.08 1.48 1.04 -1.26 0.15 113.70 116.97 2fee s SER 186 Ca 0.03 -0.78 -0.03 0.00 0.48 0.00 0.00 55.95 55.66 2fee s SER 186 Cb -0.07 -0.59 0.04 0.00 0.10 0.00 0.00 66.02 65.50 2fee s SER 186 CO 0.02 0.04 0.09 -0.55 0.98 0.00 0.00 173.24 173.82 2fee s SER 187 N -3.37 1.32 0.47 7.02 0.15 0.06 -1.52 113.70 117.84 2fee s SER 187 Ca 0.29 -0.03 -0.02 0.00 0.70 0.00 0.00 55.95 56.89 2fee s SER 187 Cb -0.07 -0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.15 2fee s SER 187 CO 0.16 -0.27 0.73 -0.94 1.20 0.00 0.00 173.24 174.12 2fee s SER 188 N 2.19 5.96 -0.49 5.45 1.04 0.19 -1.87 113.70 126.16 2fee s SER 188 Ca 0.04 0.56 0.06 0.00 0.48 0.00 0.00 55.95 57.09 2fee s SER 188 Cb -0.13 -1.83 0.22 0.00 0.10 0.00 0.00 66.02 64.39 2fee s SER 188 CO -0.05 -0.69 0.84 0.55 0.98 0.00 0.00 173.24 174.88 2fee n VAL 189 N -2.19 0.00 -1.72 5.02 3.14 -1.25 -2.22 118.33 119.11 2fee n VAL 189 Ca 0.01 -1.24 -0.34 0.00 -2.96 0.00 0.00 64.34 59.82 2fee n VAL 189 Cb 0.57 1.26 -0.04 0.00 -1.06 0.00 0.00 33.84 34.57 2fee n VAL 189 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2fee s THR 190 N 0.76 3.13 0.33 1.55 2.01 -0.84 -3.85 115.64 118.73 2fee s THR 190 Ca 0.31 0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.41 2fee s THR 190 Cb 0.13 -3.32 -0.01 0.00 0.01 0.00 0.00 72.50 69.31 2fee s THR 190 CO -0.16 -0.31 0.47 0.68 -0.69 0.00 0.00 174.62 174.60 2fee s VAL 191 N 11.56 4.06 0.75 3.82 -7.23 0.02 -4.82 120.40 128.56 2fee s VAL 191 Ca 0.87 -1.01 -0.11 0.00 -1.81 0.00 0.00 61.98 59.93 2fee s VAL 191 Cb -0.15 -3.40 0.04 0.00 0.56 0.00 0.00 36.38 33.44 2fee s VAL 191 CO 0.21 -0.16 1.08 -2.84 -0.31 0.00 0.00 175.10 173.09 2fee s PRO 192 N -4.17 2.43 0.41 4.82 0.02 -1.26 0.21 135.00 137.46 2fee s PRO 192 Ca 0.45 1.12 0.11 0.00 0.02 0.00 0.00 61.00 62.70 2fee s PRO 192 Cb -0.09 -1.92 0.92 0.00 0.02 0.00 0.00 34.50 33.42 2fee s PRO 192 CO 0.31 -1.51 1.97 1.03 -0.33 0.00 0.00 177.00 178.48 2fee h SER 193 N -1.00 0.48 1.24 2.53 0.87 0.09 -2.16 113.55 115.60 2fee h SER 193 Ca -0.44 0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.03 2fee h SER 193 Cb 1.23 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 63.08 2fee h SER 193 CO 0.53 0.30 -0.50 0.77 -0.53 0.00 0.00 176.83 177.40 2fee h SER 194 N 0.54 0.00 -0.59 6.23 4.64 -1.90 -3.30 113.55 119.18 2fee h SER 194 Ca 0.29 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.72 2fee h SER 194 Cb 0.42 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.43 2fee h SER 194 CO -0.09 0.50 0.12 0.28 -0.87 0.00 0.00 176.83 176.78 2fee h SER 195 N 0.00 0.00 -4.35 4.97 0.02 -1.75 -3.42 113.55 109.03 2fee h SER 195 Ca -0.01 0.11 -0.38 0.00 -0.84 0.00 0.00 61.79 60.68 2fee h SER 195 Cb 1.26 0.15 -0.25 0.00 0.14 0.00 0.00 62.40 63.70 2fee h SER 195 CO 0.07 0.01 -0.77 0.86 -1.14 0.00 0.00 176.83 175.86 2fee s TRP 196 N -6.11 0.93 -1.65 3.45 -0.00 -1.24 -0.84 118.94 113.47 2fee s TRP 196 Ca -0.13 -0.33 0.28 0.00 -0.00 0.00 0.00 56.10 55.91 2fee s TRP 196 Cb 0.17 -0.56 1.49 0.00 -0.00 0.00 0.00 33.47 34.57 2fee s TRP 196 CO 0.74 -0.01 1.96 -2.30 -0.00 0.00 0.00 176.95 177.35 2fee n PRO 197 N 2.03 0.58 0.30 5.86 -0.02 -1.26 -4.85 135.00 137.64 2fee n PRO 197 Ca -0.18 0.02 0.16 0.00 -2.02 0.00 0.00 63.50 61.48 2fee n PRO 197 Cb 0.55 -1.50 0.97 0.00 -0.02 0.00 0.00 33.50 33.50 2fee n PRO 197 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2fee h SER 198 N 0.00 0.00 -4.00 2.55 4.64 -1.81 -3.40 113.55 111.54 2fee h SER 198 Ca 0.00 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 2fee h SER 198 Cb 0.16 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.02 2fee h SER 198 CO 0.00 0.00 -0.86 -0.70 -0.87 0.00 0.00 176.83 174.40 2fee s GLU 199 N -4.55 1.61 -0.42 4.77 2.12 -0.02 -5.11 118.70 117.09 2fee s GLU 199 Ca -0.05 -1.24 -0.29 0.00 0.36 0.00 0.00 54.97 53.76 2fee s GLU 199 Cb 0.15 -1.97 0.02 0.00 0.26 0.00 0.00 34.13 32.58 2fee s GLU 199 CO 0.53 0.48 1.26 0.99 -0.54 0.00 0.00 175.26 177.97 2fee s THR 200 N -0.99 4.10 -0.29 -1.70 2.01 -1.26 -4.60 115.64 112.91 2fee s THR 200 Ca 0.14 1.15 -0.09 0.00 0.31 0.00 0.00 61.69 63.20 2fee s THR 200 Cb -0.10 -4.39 -0.02 0.00 0.01 0.00 0.00 72.50 68.00 2fee s THR 200 CO 0.05 -0.82 0.13 -0.69 -0.69 0.00 0.00 174.62 172.60 2fee s VAL 201 N 4.77 4.55 0.11 3.82 1.01 -1.26 -4.98 120.40 128.42 2fee s VAL 201 Ca 0.54 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.27 2fee s VAL 201 Cb -0.11 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2fee s VAL 201 CO 0.30 0.15 -0.11 -0.89 0.00 0.00 0.00 175.10 174.56 2fee s THR 202 N 1.62 3.32 -0.06 3.92 2.01 -1.26 -2.12 115.64 123.07 2fee s THR 202 Ca 0.05 -1.29 0.05 0.00 0.31 0.00 0.00 61.69 60.81 2fee s THR 202 Cb -0.16 -2.55 -0.02 0.00 0.01 0.00 0.00 72.50 69.78 2fee s THR 202 CO 0.06 0.11 -0.21 0.00 -0.69 0.00 0.00 174.62 173.89 2fee s ASN 204 N -0.32 4.20 -0.09 0.00 -0.87 0.30 -0.21 114.94 117.94 2fee s ASN 204 Ca 0.02 -0.36 0.00 0.00 -1.57 0.00 0.00 52.86 50.95 2fee s ASN 204 Cb -0.13 -1.69 0.02 0.00 -0.02 0.00 0.00 41.25 39.43 2fee s ASN 204 CO 0.02 0.05 -0.09 -0.69 -2.57 0.00 0.00 177.10 173.83 2fee s VAL 205 N 1.06 1.01 -0.08 1.60 1.01 0.20 -1.17 120.40 124.03 2fee s VAL 205 Ca 0.00 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2fee s VAL 205 Cb -0.15 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 2fee s VAL 205 CO -0.01 0.35 -0.13 0.00 0.00 0.00 0.00 175.10 175.32 2fee s ALA 206 N 1.36 2.70 -0.33 5.51 0.00 -0.54 0.40 121.76 130.87 2fee s ALA 206 Ca -0.02 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 2fee s ALA 206 Cb -0.14 -1.09 0.11 0.00 0.00 0.00 0.00 23.12 22.01 2fee s ALA 206 CO -0.04 0.46 0.15 -1.58 0.00 0.00 0.00 175.76 174.75 2fee s HIS 207 N -0.41 1.13 0.05 0.00 2.46 -0.30 -0.35 115.29 117.87 2fee s HIS 207 Ca 0.05 -1.55 0.09 0.00 0.47 0.00 0.00 55.06 54.12 2fee s HIS 207 Cb -0.12 -1.33 -0.16 0.00 -0.13 0.00 0.00 32.58 30.84 2fee s HIS 207 CO 0.02 -0.84 1.25 -1.00 -2.47 0.00 0.00 174.74 171.70 2fee h PRO 208 N 7.79 0.00 -0.95 2.88 0.13 -1.78 -0.90 132.00 139.17 2fee h PRO 208 Ca -0.10 0.00 0.35 0.00 -0.87 0.00 0.00 66.00 65.38 2fee h PRO 208 Cb 0.99 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.95 2fee h PRO 208 CO 0.42 0.86 0.33 0.00 -0.23 0.00 0.00 178.00 179.37 2fee n ALA 209 N -2.34 0.79 -1.59 -0.56 0.00 -1.26 -0.41 120.51 115.13 2fee n ALA 209 Ca -0.01 0.98 -0.09 0.00 0.00 0.00 0.00 53.44 54.32 2fee n ALA 209 Cb 0.91 -0.88 0.16 0.00 0.00 0.00 0.00 19.45 19.64 2fee n ALA 209 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2fee n SER 210 N -5.24 3.17 -0.92 0.00 3.41 -1.14 -4.96 113.62 107.95 2fee n SER 210 Ca 0.31 -3.81 -0.04 0.00 -0.26 0.00 0.00 58.87 55.07 2fee n SER 210 Cb 1.03 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 64.38 2fee n SER 210 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2fee n SER 211 N -1.03 -1.26 -4.67 4.04 7.64 0.45 -4.84 113.62 113.95 2fee n SER 211 Ca 0.35 0.09 -0.43 0.00 1.01 0.00 0.00 58.87 59.90 2fee n SER 211 Cb 0.94 -1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 2fee n SER 211 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2fee s THR 212 N -1.18 4.69 -0.12 0.44 2.01 -0.36 -4.96 115.64 116.16 2fee s THR 212 Ca 0.00 2.01 0.03 0.00 0.31 0.00 0.00 61.69 64.04 2fee s THR 212 Cb 0.00 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.22 2fee s THR 212 CO 0.00 -0.11 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.06 2fee s LYS 213 N 2.80 2.92 -0.01 4.92 1.02 -1.26 -1.15 119.74 128.98 2fee s LYS 213 Ca 0.46 -0.82 -0.01 0.00 0.02 0.00 0.00 55.97 55.61 2fee s LYS 213 Cb -0.17 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.82 2fee s LYS 213 CO 0.11 0.03 0.04 0.54 -0.92 0.00 0.00 175.35 175.15 2fee s VAL 214 N 0.70 0.01 -0.24 3.17 0.11 0.16 -4.99 120.40 119.33 2fee s VAL 214 Ca -0.10 -0.11 -0.00 0.00 -2.93 0.00 0.00 61.98 58.83 2fee s VAL 214 Cb -0.16 -0.09 0.03 0.00 -1.53 0.00 0.00 36.38 34.62 2fee s VAL 214 CO 0.01 -0.06 -0.09 -1.81 -3.33 0.00 0.00 175.10 169.82 2fee s ASP 215 N -0.17 4.15 -0.24 3.54 1.01 -1.26 0.61 116.67 124.31 2fee s ASP 215 Ca -0.02 -0.93 -0.01 0.00 0.71 0.00 0.00 52.55 52.30 2fee s ASP 215 Cb -0.01 -1.61 0.03 0.00 1.01 0.00 0.00 42.92 42.33 2fee s ASP 215 CO -0.00 -0.12 -0.09 -0.75 0.21 0.00 0.00 175.17 174.42 2fee s LYS 216 N 1.28 2.77 -0.08 8.23 2.47 0.70 -4.94 119.74 130.17 2fee s LYS 216 Ca -0.01 -1.01 -0.29 0.00 -1.56 0.00 0.00 55.97 53.10 2fee s LYS 216 Cb -0.17 -2.91 -0.02 0.00 -1.46 0.00 0.00 37.83 33.27 2fee s LYS 216 CO -0.06 -0.40 0.96 0.21 0.16 0.00 0.00 175.35 176.23 2fee s LYS 217 N 1.29 4.44 -1.05 4.03 2.20 -1.26 -0.96 119.74 128.44 2fee s LYS 217 Ca -0.00 1.33 -0.21 0.00 -0.36 0.00 0.00 55.97 56.72 2fee s LYS 217 Cb -0.17 -3.52 0.08 0.00 -1.51 0.00 0.00 37.83 32.71 2fee s LYS 217 CO -0.06 -0.23 1.42 0.42 -0.36 0.00 0.00 175.35 176.54 2fee s ILE 218 N 1.70 4.18 0.22 5.43 -1.09 -0.90 -4.89 121.20 125.86 2fee s ILE 218 Ca 0.47 -1.20 -0.23 0.00 -2.23 0.00 0.00 60.65 57.46 2fee s ILE 218 Cb -0.19 -5.01 -0.08 0.00 -1.58 0.00 0.00 42.46 35.60 2fee s ILE 218 CO 0.20 -1.84 0.78 0.68 -1.23 0.00 0.00 174.94 173.53 2fee s VAL 219 N 4.19 4.43 0.78 2.92 -7.23 -1.26 -4.66 120.40 119.56 2fee s VAL 219 Ca 0.44 1.54 -0.14 0.00 -1.81 0.00 0.00 61.98 62.01 2fee s VAL 219 Cb -0.01 -3.99 0.07 0.00 0.56 0.00 0.00 36.38 33.01 2fee s VAL 219 CO -0.07 0.31 1.19 -2.16 -0.31 0.00 0.00 175.10 174.07 2fee s PRO 220 N -1.68 1.85 -0.72 4.82 0.04 -1.26 -4.68 135.00 133.37 2fee s PRO 220 Ca 0.42 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.91 2fee s PRO 220 Cb -0.19 -1.80 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 2fee s PRO 220 CO 0.23 -2.05 2.07 1.03 0.04 0.00 0.00 177.00 178.33 2fee s ARG 221 N -4.12 2.34 0.00 4.56 0.52 -1.26 -5.08 118.95 115.92 2fee s ARG 221 Ca 0.72 0.42 0.10 0.00 -0.52 0.00 0.00 55.73 56.46 2fee s ARG 221 Cb -0.28 -4.71 0.58 0.00 0.52 0.00 0.00 34.95 31.07 2fee s ARG 221 CO 0.49 -3.32 1.03 0.00 0.02 0.00 0.00 175.30 173.51