#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fef s ASP 8 N 0.00 4.93 -1.84 1.96 1.01 -1.26 -1.13 116.67 120.34 3fef s ASP 8 Ca 0.00 -0.81 0.00 0.00 0.71 0.00 0.00 52.55 52.45 3fef s ASP 8 Cb 0.00 -0.56 0.00 0.00 1.01 0.00 0.00 42.92 43.37 3fef s ASP 8 CO 0.00 -0.63 0.00 0.00 0.21 0.00 0.00 175.17 174.75 3fef n GLN 9 N -1.48 -1.59 -2.09 8.23 6.02 -0.87 -4.90 117.38 120.71 3fef n GLN 9 Ca 0.03 1.04 -0.41 0.00 -0.01 0.00 0.00 57.00 57.64 3fef n GLN 9 Cb 0.62 -5.62 -0.02 0.00 1.02 0.00 0.00 30.24 26.24 3fef n GLN 9 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3fef s ILE 10 N -2.96 2.74 -0.18 5.09 -1.09 -0.65 -4.85 121.20 119.29 3fef s ILE 10 Ca 0.00 0.68 -0.01 0.00 -2.23 0.00 0.00 60.65 59.09 3fef s ILE 10 Cb 0.00 -3.44 -0.00 0.00 -1.58 0.00 0.00 42.46 37.44 3fef s ILE 10 CO 0.00 0.14 -0.12 -0.75 -1.23 0.00 0.00 174.94 172.98 3fef s LYS 11 N -1.19 3.25 -0.17 2.79 2.20 -1.26 -0.39 119.74 124.97 3fef s LYS 11 Ca 0.53 -0.71 -0.04 0.00 -0.36 0.00 0.00 55.97 55.39 3fef s LYS 11 Cb -0.40 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.12 3fef s LYS 11 CO 0.49 -0.10 -0.04 0.42 -0.36 0.00 0.00 175.35 175.76 3fef s ILE 12 N 1.15 3.81 -0.17 5.43 1.01 -0.51 0.30 121.20 132.21 3fef s ILE 12 Ca 0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.17 3fef s ILE 12 Cb -0.14 -2.68 -0.05 0.00 0.01 0.00 0.00 42.46 39.60 3fef s ILE 12 CO -0.04 0.47 0.20 0.00 0.00 0.00 0.00 174.94 175.57 3fef s ALA 13 N 0.60 3.67 -0.30 9.38 0.00 0.44 -1.06 121.76 134.50 3fef s ALA 13 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.35 3fef s ALA 13 Cb -0.14 -2.24 0.06 0.00 0.00 0.00 0.00 23.12 20.80 3fef s ALA 13 CO 0.02 0.18 -0.02 -0.47 0.00 0.00 0.00 175.76 175.47 3fef s TYR 14 N 0.26 3.33 -0.35 0.00 5.04 0.12 -0.76 117.35 124.98 3fef s TYR 14 Ca 0.12 -2.16 -0.19 0.00 -2.44 0.00 0.00 57.07 52.39 3fef s TYR 14 Cb -0.12 -2.18 -0.00 0.00 0.35 0.00 0.00 41.96 40.01 3fef s TYR 14 CO 0.01 -0.85 0.58 0.42 -1.34 0.00 0.00 175.55 174.37 3fef s ILE 15 N 1.16 4.95 0.00 3.14 1.01 0.23 -0.40 121.20 131.29 3fef s ILE 15 Ca -0.04 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.09 3fef s ILE 15 Cb -0.20 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.25 3fef s ILE 15 CO -0.03 -0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.26 3fef n GLY 16 N 4.71 1.79 0.00 6.18 0.00 0.89 -1.24 105.19 117.52 3fef n GLY 16 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.07 3fef n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fef n GLY 17 N -0.62 -0.80 0.93 -0.02 0.00 -0.08 -0.89 105.19 103.70 3fef n GLY 17 Ca 0.00 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.03 3fef n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fef n GLY 18 N 0.07 1.33 3.75 -0.02 0.00 -1.26 -4.49 105.19 104.58 3fef n GLY 18 Ca 0.08 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 3fef n GLY 18 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fef s SER 19 N -1.07 6.36 -0.14 1.61 0.15 -0.07 -4.71 113.70 115.83 3fef s SER 19 Ca 0.34 2.97 0.18 0.00 0.70 0.00 0.00 55.95 60.14 3fef s SER 19 Cb 0.18 -2.64 0.75 0.00 -1.71 0.00 0.00 66.02 62.60 3fef s SER 19 CO 0.24 -0.92 1.66 0.00 1.20 0.00 0.00 173.24 175.42 3fef n GLN 20 N 2.00 3.98 0.00 5.44 6.02 -1.26 -4.19 117.38 129.36 3fef n GLN 20 Ca 0.07 -2.96 0.00 0.00 -0.01 0.00 0.00 57.00 54.10 3fef n GLN 20 Cb 0.37 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.66 3fef n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fef n GLY 21 N 1.06 0.40 0.30 1.08 0.00 -1.26 -4.74 105.19 102.03 3fef n GLY 21 Ca 0.27 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.33 3fef n GLY 21 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3fef h TRP 22 N 0.00 0.80 -0.46 1.61 4.06 -1.96 -1.73 115.95 118.27 3fef h TRP 22 Ca 0.00 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.96 3fef h TRP 22 Cb 0.00 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 27.91 3fef h TRP 22 CO 0.00 0.26 0.19 0.00 -3.56 0.00 0.00 178.44 175.33 3fef h ALA 23 N 1.50 0.60 -0.42 1.49 0.00 -1.89 0.31 119.26 120.84 3fef h ALA 23 Ca 0.42 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3fef h ALA 23 Cb 0.50 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3fef h ALA 23 CO -0.30 0.20 0.27 0.00 0.00 0.00 0.00 179.25 179.41 3fef h ARG 24 N 0.60 0.53 -0.69 0.00 2.47 -1.66 -2.67 114.38 112.96 3fef h ARG 24 Ca 0.15 -0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 3fef h ARG 24 Cb 0.18 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.35 3fef h ARG 24 CO -0.01 0.35 0.32 1.03 0.56 0.00 0.00 179.97 182.22 3fef h SER 25 N 0.55 0.89 0.00 7.04 0.87 -1.07 -0.46 113.55 121.37 3fef h SER 25 Ca 0.16 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 3fef h SER 25 Cb -0.03 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.70 3fef h SER 25 CO -0.05 0.76 0.00 -0.11 -0.53 0.00 0.00 176.83 176.89 3fef n LEU 26 N -4.33 1.84 0.00 2.23 7.94 0.08 -2.67 117.00 122.09 3fef n LEU 26 Ca 0.06 -0.89 0.00 0.00 -1.11 0.00 0.00 56.01 54.08 3fef n LEU 26 Cb 0.14 -0.34 0.00 0.00 0.53 0.00 0.00 43.42 43.75 3fef n LEU 26 CO 0.39 0.32 0.00 -1.20 -1.11 0.00 0.00 177.39 175.79 3fef n SER 28 N 0.98 0.00 -0.10 1.96 7.64 -0.18 -1.10 113.62 122.81 3fef n SER 28 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 3fef n SER 28 Cb 0.26 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.44 3fef n SER 28 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3fef h ASP 29 N 0.00 0.98 -0.76 6.43 3.32 -1.75 -2.44 116.42 122.21 3fef h ASP 29 Ca 0.00 -0.47 0.01 0.00 0.02 0.00 0.00 57.03 56.59 3fef h ASP 29 Cb 0.00 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.23 3fef h ASP 29 CO 0.00 1.27 0.50 -0.07 -1.72 0.00 0.00 179.24 179.22 3fef h LEU 30 N 0.73 0.85 -1.49 1.55 3.38 -1.40 -2.62 115.31 116.31 3fef h LEU 30 Ca 0.05 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3fef h LEU 30 Cb 1.04 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 3fef h LEU 30 CO 0.10 0.61 -0.16 0.77 0.09 0.00 0.00 178.44 179.85 3fef h SER 31 N 1.00 0.00 -0.01 -0.43 4.64 -1.68 -3.07 113.55 114.00 3fef h SER 31 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3fef h SER 31 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3fef h SER 31 CO -0.07 0.16 -0.45 2.30 -0.87 0.00 0.00 176.83 177.91 3fef n ILE 32 N -3.45 0.00 -3.04 0.95 -5.35 -1.03 -4.61 119.36 102.84 3fef n ILE 32 Ca -0.01 -0.28 -0.43 0.00 -0.27 0.00 0.00 62.75 61.77 3fef n ILE 32 Cb 0.34 1.21 -0.06 0.00 -1.74 0.00 0.00 39.64 39.38 3fef n ILE 32 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3fef s ASP 33 N -2.24 6.39 0.00 7.28 -1.08 -1.02 -4.90 116.67 121.11 3fef s ASP 33 Ca 0.15 -0.13 0.29 0.00 -0.52 0.00 0.00 52.55 52.34 3fef s ASP 33 Cb 0.15 -2.35 1.23 0.00 -1.46 0.00 0.00 42.92 40.49 3fef s ASP 33 CO 0.51 -0.81 1.90 -0.62 0.52 0.00 0.00 175.17 176.68 3fef n GLU 34 N 6.43 0.15 0.00 4.34 1.02 -1.26 -4.86 120.64 126.46 3fef n GLU 34 Ca 0.00 -0.02 0.04 0.00 -0.02 0.00 0.00 57.16 57.17 3fef n GLU 34 Cb 0.48 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 30.65 3fef n GLU 34 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3fef n ARG 35 N -1.41 0.25 -3.59 3.49 1.74 -1.26 -4.81 116.66 111.06 3fef n ARG 35 Ca 0.09 0.03 -0.05 0.00 -0.77 0.00 0.00 57.85 57.15 3fef n ARG 35 Cb 0.31 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.24 3fef n ARG 35 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3fef s SER 37 N -2.08 -0.21 0.00 0.55 1.04 -0.29 -1.70 113.70 111.02 3fef s SER 37 Ca 0.12 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.46 3fef s SER 37 Cb 0.06 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.46 3fef s SER 37 CO 0.10 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.45 3fef n GLY 38 N -0.27 -0.56 3.34 7.32 0.00 -1.00 -1.64 105.19 112.37 3fef n GLY 38 Ca -0.05 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 3fef n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fef s THR 39 N -4.00 1.94 -0.22 2.61 -4.23 0.48 -1.58 115.64 110.63 3fef s THR 39 Ca 0.00 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 58.79 3fef s THR 39 Cb 0.00 -1.79 0.03 0.00 1.34 0.00 0.00 72.50 72.09 3fef s THR 39 CO 0.00 -0.08 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.18 3fef s VAL 40 N -1.37 2.32 -0.34 2.29 1.01 0.22 -1.42 120.40 123.11 3fef s VAL 40 Ca 0.12 -1.17 -0.26 0.00 0.00 0.00 0.00 61.98 60.66 3fef s VAL 40 Cb -0.09 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.15 3fef s VAL 40 CO 0.06 0.27 0.93 0.00 0.00 0.00 0.00 175.10 176.37 3fef s ALA 41 N 1.24 3.47 -0.39 5.51 0.00 -0.22 -0.94 121.76 130.43 3fef s ALA 41 Ca -0.01 -0.33 -0.19 0.00 0.00 0.00 0.00 51.96 51.44 3fef s ALA 41 Cb -0.16 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.45 3fef s ALA 41 CO -0.08 -1.47 0.54 -0.51 0.00 0.00 0.00 175.76 174.24 3fef s LEU 42 N 3.39 4.47 -0.12 0.00 1.43 0.75 0.15 118.68 128.76 3fef s LEU 42 Ca 0.39 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.29 3fef s LEU 42 Cb -0.13 -2.60 -0.01 0.00 0.03 0.00 0.00 46.19 43.49 3fef s LEU 42 CO 0.16 -0.58 -0.18 -0.47 0.23 0.00 0.00 176.35 175.51 3fef s TYR 43 N 2.47 2.70 -0.08 0.29 5.04 0.46 -0.98 117.35 127.26 3fef s TYR 43 Ca 0.19 -0.83 -0.09 0.00 -2.44 0.00 0.00 57.07 53.89 3fef s TYR 43 Cb -0.15 -1.78 0.02 0.00 0.35 0.00 0.00 41.96 40.39 3fef s TYR 43 CO 0.15 -0.31 0.25 0.34 -1.34 0.00 0.00 175.55 174.64 3fef s ASP 44 N 0.35 -0.23 0.55 4.32 -1.08 -1.26 -0.08 116.67 119.25 3fef s ASP 44 Ca -0.14 0.39 0.27 0.00 -0.52 0.00 0.00 52.55 52.55 3fef s ASP 44 Cb -0.17 0.46 1.45 0.00 -1.46 0.00 0.00 42.92 43.21 3fef s ASP 44 CO 0.07 -0.16 1.97 -0.07 0.52 0.00 0.00 175.17 177.51 3fef h LEU 45 N 5.39 0.00 -7.82 -1.34 3.38 -1.97 -3.27 115.31 109.67 3fef h LEU 45 Ca -0.27 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 56.95 3fef h LEU 45 Cb 1.19 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.65 3fef h LEU 45 CO 0.36 0.00 -0.15 -0.62 0.09 0.00 0.00 178.44 178.12 3fef s ASP 46 N -5.89 6.12 0.39 -0.43 -1.08 -1.26 -4.94 116.67 109.58 3fef s ASP 46 Ca -0.05 -2.48 0.06 0.00 -0.52 0.00 0.00 52.55 49.57 3fef s ASP 46 Cb 0.19 -2.09 0.78 0.00 -1.46 0.00 0.00 42.92 40.34 3fef s ASP 46 CO 0.68 -0.58 2.00 0.15 0.52 0.00 0.00 175.17 177.94 3fef h PHE 47 N 7.86 0.52 -0.70 -5.34 3.04 -1.97 -2.24 116.94 118.10 3fef h PHE 47 Ca -0.03 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.96 3fef h PHE 47 Cb 1.03 -0.17 -0.05 0.00 2.56 0.00 0.00 35.95 39.32 3fef h PHE 47 CO 0.84 0.39 0.42 1.49 -2.02 0.00 0.00 178.31 179.43 3fef h GLU 48 N 0.53 0.77 -0.36 1.11 4.81 -1.92 -0.76 114.58 118.77 3fef h GLU 48 Ca 0.14 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 3fef h GLU 48 Cb 0.06 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3fef h GLU 48 CO -0.02 0.51 -0.40 0.00 -0.73 0.00 0.00 179.01 178.37 3fef h ALA 49 N 1.33 0.61 -0.69 2.92 0.00 -1.75 -2.84 119.26 118.84 3fef h ALA 49 Ca 0.30 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 54.79 3fef h ALA 49 Cb 0.11 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3fef h ALA 49 CO -0.15 0.68 0.46 0.00 0.00 0.00 0.00 179.25 180.23 3fef h ALA 50 N 0.82 1.61 -0.07 0.00 0.00 -1.16 -2.47 119.26 118.00 3fef h ALA 50 Ca 0.06 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 3fef h ALA 50 Cb 0.98 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3fef h ALA 50 CO 0.09 0.32 -0.80 0.37 0.00 0.00 0.00 179.25 179.23 3fef h GLN 51 N 0.83 0.47 -0.69 0.00 -0.00 -1.07 -1.01 115.11 113.64 3fef h GLN 51 Ca 0.28 -0.42 -0.04 0.00 -0.00 0.00 0.00 58.65 58.47 3fef h GLN 51 Cb 0.07 0.10 -0.03 0.00 0.00 0.00 0.00 27.48 27.62 3fef h GLN 51 CO -0.08 1.06 0.26 0.87 0.00 0.00 0.00 178.83 180.94 3fef h LYS 52 N 0.30 1.02 -0.24 1.69 1.57 -1.29 -1.03 116.57 118.60 3fef h LYS 52 Ca -0.05 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 3fef h LYS 52 Cb 1.40 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 3fef h LYS 52 CO 0.14 0.84 -0.18 -0.91 -0.57 0.00 0.00 179.45 178.77 3fef h ASN 53 N 1.00 0.40 -0.63 0.86 2.35 -1.18 0.15 115.58 118.53 3fef h ASN 53 Ca 0.23 -0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.81 3fef h ASN 53 Cb 0.21 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 3fef h ASN 53 CO -0.02 0.61 0.18 -0.08 -1.65 0.00 0.00 177.43 176.47 3fef h GLU 54 N 0.38 0.98 -0.19 0.81 4.81 -0.60 0.32 114.58 121.09 3fef h GLU 54 Ca 0.07 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.01 3fef h GLU 54 Cb 0.54 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 3fef h GLU 54 CO 0.04 0.87 -0.15 0.28 -0.73 0.00 0.00 179.01 179.32 3fef h VAL 55 N 0.90 1.32 -0.47 0.32 2.07 -0.97 -2.01 116.25 117.42 3fef h VAL 55 Ca 0.20 -1.28 -0.07 0.00 0.82 0.00 0.00 66.70 66.37 3fef h VAL 55 Cb 0.31 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 3fef h VAL 55 CO -0.00 0.39 0.02 0.40 0.02 0.00 0.00 177.57 178.39 3fef h ILE 56 N 0.12 1.26 -0.61 4.57 2.04 -0.87 -2.84 117.51 121.17 3fef h ILE 56 Ca 0.04 -1.02 -0.04 0.00 1.00 0.00 0.00 64.86 64.83 3fef h ILE 56 Cb 0.68 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 3fef h ILE 56 CO 0.04 0.36 0.24 1.23 0.00 0.00 0.00 178.15 180.01 3fef h GLY 57 N 0.67 0.99 1.79 5.37 0.00 -0.37 -2.02 103.07 109.50 3fef h GLY 57 Ca 0.14 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.91 3fef h GLY 57 CO 0.02 0.52 0.00 0.70 0.00 0.00 0.00 176.54 177.78 3fef n ASN 58 N -4.44 0.00 -0.82 0.19 3.02 -0.76 -1.31 115.26 111.14 3fef n ASN 58 Ca 0.04 0.29 0.12 0.00 -0.03 0.00 0.00 54.58 55.00 3fef n ASN 58 Cb 0.18 -0.40 0.15 0.00 -0.61 0.00 0.00 39.78 39.10 3fef n ASN 58 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3fef n HIS 59 N -1.40 0.00 -3.52 3.10 8.25 -0.77 -4.93 115.22 115.95 3fef n HIS 59 Ca 0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.14 3fef n HIS 59 Cb 0.14 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 3fef n HIS 59 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3fef s SER 60 N -2.07 6.76 1.03 0.41 0.01 -0.43 -3.74 113.70 115.66 3fef s SER 60 Ca 0.28 0.92 0.00 0.00 1.31 0.00 0.00 55.95 58.46 3fef s SER 60 Cb 0.20 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 64.20 3fef s SER 60 CO 0.34 0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.89 3fef n GLY 61 N 1.57 2.93 0.08 3.44 0.00 -1.26 -4.09 105.19 107.86 3fef n GLY 61 Ca -0.12 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 3fef n GLY 61 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fef h ASN 62 N 9.21 -0.04 0.00 1.61 -0.26 -1.94 -3.46 115.58 120.69 3fef h ASN 62 Ca 0.00 -0.47 0.00 0.00 -0.56 0.00 0.00 56.30 55.27 3fef h ASN 62 Cb 0.00 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 3fef h ASN 62 CO 0.00 0.67 0.00 0.61 -1.06 0.00 0.00 177.43 177.65 3fef n GLY 63 N 1.48 0.18 0.37 2.83 0.00 -1.26 -5.00 105.19 103.79 3fef n GLY 63 Ca -0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.08 3fef n GLY 63 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3fef h ARG 64 N 0.00 0.62 -4.65 1.61 2.43 -1.90 -3.40 114.38 109.09 3fef h ARG 64 Ca 0.00 -0.04 -0.56 0.00 -0.81 0.00 0.00 59.98 58.57 3fef h ARG 64 Cb 0.00 -0.14 -0.34 0.00 -0.42 0.00 0.00 29.97 29.06 3fef h ARG 64 CO 0.00 0.41 -0.83 -1.58 -1.51 0.00 0.00 179.97 176.47 3fef s TRP 65 N -5.61 1.80 -0.22 2.20 0.52 -1.26 -2.38 118.94 113.98 3fef s TRP 65 Ca -0.09 -0.81 -0.10 0.00 0.02 0.00 0.00 56.10 55.12 3fef s TRP 65 Cb 0.21 -1.32 -0.05 0.00 -1.15 0.00 0.00 33.47 31.16 3fef s TRP 65 CO 0.78 -0.43 0.15 0.50 0.02 0.00 0.00 176.95 177.97 3fef s ARG 66 N 0.97 4.12 -0.08 4.98 3.52 -0.62 -4.75 118.95 127.09 3fef s ARG 66 Ca -0.08 -0.25 -0.05 0.00 -0.13 0.00 0.00 55.73 55.23 3fef s ARG 66 Cb -0.15 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.71 3fef s ARG 66 CO -0.01 0.16 0.13 0.71 -0.81 0.00 0.00 175.30 175.48 3fef s TYR 67 N 0.78 3.51 -0.03 5.12 1.51 -1.26 -0.61 117.35 126.37 3fef s TYR 67 Ca 0.08 0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 56.55 3fef s TYR 67 Cb -0.13 -1.88 0.03 0.00 -0.11 0.00 0.00 41.96 39.88 3fef s TYR 67 CO 0.02 0.67 0.05 -2.00 -1.11 0.00 0.00 175.55 173.18 3fef s GLU 68 N -1.30 -0.03 -0.10 -0.62 2.12 -0.11 -4.90 118.70 113.76 3fef s GLU 68 Ca 0.18 0.30 -0.30 0.00 0.36 0.00 0.00 54.97 55.52 3fef s GLU 68 Cb -0.12 -0.44 -0.03 0.00 0.26 0.00 0.00 34.13 33.80 3fef s GLU 68 CO 0.08 -0.27 1.23 0.00 -0.54 0.00 0.00 175.26 175.76 3fef s ALA 69 N 1.77 3.57 0.29 6.30 0.00 -1.26 -0.18 121.76 132.24 3fef s ALA 69 Ca -0.00 0.56 0.11 0.00 0.00 0.00 0.00 51.96 52.63 3fef s ALA 69 Cb -0.12 -3.56 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 3fef s ALA 69 CO -0.03 -0.94 -0.18 0.14 0.00 0.00 0.00 175.76 174.75 3fef s VAL 70 N 2.75 2.39 -0.14 0.00 -7.23 -0.15 -4.91 120.40 113.12 3fef s VAL 70 Ca 0.56 -2.37 0.19 0.00 -1.81 0.00 0.00 61.98 58.55 3fef s VAL 70 Cb -0.24 -2.34 -0.15 0.00 0.56 0.00 0.00 36.38 34.21 3fef s VAL 70 CO 0.19 -0.38 0.72 -1.54 -0.31 0.00 0.00 175.10 173.78 3fef n SER 71 N -0.63 0.61 -4.23 4.85 3.41 -1.26 -4.54 113.62 111.83 3fef n SER 71 Ca -0.05 0.26 -0.13 0.00 -0.26 0.00 0.00 58.87 58.69 3fef n SER 71 Cb 0.61 0.63 -0.10 0.00 -0.26 0.00 0.00 64.21 65.08 3fef n SER 71 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3fef s THR 72 N -3.07 0.80 0.07 6.66 -4.23 -1.26 -4.97 115.64 109.64 3fef s THR 72 Ca -0.04 -1.99 -0.24 0.00 -1.18 0.00 0.00 61.69 58.24 3fef s THR 72 Cb 0.09 -1.97 -0.16 0.00 1.34 0.00 0.00 72.50 71.80 3fef s THR 72 CO 0.83 -0.62 1.64 -0.07 -0.54 0.00 0.00 174.62 175.86 3fef h LEU 73 N 2.76 -0.03 -0.78 4.79 3.38 -2.00 -2.51 115.31 120.93 3fef h LEU 73 Ca -0.36 -0.09 0.16 0.00 0.09 0.00 0.00 57.88 57.68 3fef h LEU 73 Cb 1.19 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.84 3fef h LEU 73 CO 0.63 0.07 0.28 0.50 0.09 0.00 0.00 178.44 180.02 3fef h LYS 74 N -0.13 0.37 -0.58 1.13 3.64 -1.96 -0.08 116.57 118.95 3fef h LYS 74 Ca -0.00 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 3fef h LYS 74 Cb 0.12 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3fef h LYS 74 CO 0.01 0.24 0.03 -0.22 -2.27 0.00 0.00 179.45 177.24 3fef h LYS 75 N 0.38 0.97 -0.49 1.90 3.64 -1.92 -1.81 116.57 119.24 3fef h LYS 75 Ca 0.45 -0.28 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 3fef h LYS 75 Cb 0.75 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 3fef h LYS 75 CO -0.47 0.94 0.11 0.00 -2.27 0.00 0.00 179.45 177.77 3fef h ALA 76 N 1.12 0.65 0.00 5.00 0.00 -0.63 -3.27 119.26 122.13 3fef h ALA 76 Ca 0.17 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3fef h ALA 76 Cb 0.49 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3fef h ALA 76 CO 0.02 0.35 -0.68 -0.07 0.00 0.00 0.00 179.25 178.87 3fef h LEU 77 N 0.67 0.00 -9.23 0.00 3.38 -1.07 -3.41 115.31 105.66 3fef h LEU 77 Ca 0.15 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.45 3fef h LEU 77 Cb 0.34 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.11 3fef h LEU 77 CO 0.00 0.44 0.95 -0.24 0.09 0.00 0.00 178.44 179.68 3fef n SER 78 N -3.11 2.83 -0.30 -0.43 2.88 -0.69 0.40 113.62 115.20 3fef n SER 78 Ca -0.00 1.03 -0.04 0.00 -1.33 0.00 0.00 58.87 58.53 3fef n SER 78 Cb 0.73 -1.26 -0.02 0.00 -0.75 0.00 0.00 64.21 62.91 3fef n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3fef n ALA 79 N 5.64 -0.06 -1.83 -1.46 0.00 -1.26 -4.97 120.51 116.57 3fef n ALA 79 Ca 0.24 0.06 -0.41 0.00 0.00 0.00 0.00 53.44 53.34 3fef n ALA 79 Cb 0.21 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 3fef n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fef s ALA 80 N -1.60 3.45 -0.06 0.00 0.00 0.16 -4.71 121.76 119.01 3fef s ALA 80 Ca 0.00 1.04 0.11 0.00 0.00 0.00 0.00 51.96 53.11 3fef s ALA 80 Cb 0.00 -3.40 -0.23 0.00 0.00 0.00 0.00 23.12 19.48 3fef s ALA 80 CO 0.00 -0.38 0.60 -0.25 0.00 0.00 0.00 175.76 175.73 3fef n ASP 81 N 1.40 0.94 -4.06 0.00 8.00 0.15 -4.46 116.55 118.53 3fef n ASP 81 Ca 0.01 0.37 -0.21 0.00 0.71 0.00 0.00 54.79 55.67 3fef n ASP 81 Cb 0.44 -0.08 -0.15 0.00 -0.02 0.00 0.00 41.12 41.30 3fef n ASP 81 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fef s ILE 82 N -2.59 0.92 -0.13 0.53 -1.09 -1.00 -2.36 121.20 115.48 3fef s ILE 82 Ca -0.07 -0.48 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 3fef s ILE 82 Cb 0.08 -0.78 0.01 0.00 -1.58 0.00 0.00 42.46 40.18 3fef s ILE 82 CO 0.82 0.27 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.89 3fef s VAL 83 N -0.14 2.15 -0.09 2.92 1.01 0.46 -0.42 120.40 126.29 3fef s VAL 83 Ca 0.02 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 3fef s VAL 83 Cb -0.06 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 3fef s VAL 83 CO -0.00 0.55 -0.07 -0.63 0.00 0.00 0.00 175.10 174.95 3fef s ILE 84 N 0.70 3.67 -0.10 2.22 1.01 0.06 0.26 121.20 129.03 3fef s ILE 84 Ca -0.09 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.09 3fef s ILE 84 Cb -0.16 -2.53 0.02 0.00 0.01 0.00 0.00 42.46 39.80 3fef s ILE 84 CO 0.01 0.57 -0.12 -0.63 0.00 0.00 0.00 174.94 174.77 3fef s ILE 85 N -0.43 1.23 -0.48 2.92 1.01 -0.26 -0.60 121.20 124.59 3fef s ILE 85 Ca 0.06 -0.48 0.06 0.00 0.00 0.00 0.00 60.65 60.30 3fef s ILE 85 Cb -0.12 -1.16 0.19 0.00 0.01 0.00 0.00 42.46 41.37 3fef s ILE 85 CO 0.02 0.39 0.61 -0.24 0.00 0.00 0.00 174.94 175.72 3fef n SER 86 N 4.35 -2.32 -4.77 3.58 2.88 -0.38 -0.10 113.62 116.87 3fef n SER 86 Ca -0.18 -2.77 -0.25 0.00 -1.33 0.00 0.00 58.87 54.34 3fef n SER 86 Cb 0.51 0.93 -0.06 0.00 -0.75 0.00 0.00 64.21 64.83 3fef n SER 86 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 3fef s ILE 87 N 0.51 2.25 -0.26 2.46 -4.36 -1.26 -4.35 121.20 116.18 3fef s ILE 87 Ca 0.31 -1.65 -0.03 0.00 -0.26 0.00 0.00 60.65 59.03 3fef s ILE 87 Cb 0.04 -2.90 0.02 0.00 1.25 0.00 0.00 42.46 40.88 3fef s ILE 87 CO -0.12 0.00 -0.03 -0.22 0.24 0.00 0.00 174.94 174.82 3fef s LEU 88 N -3.96 3.36 -1.05 0.37 2.96 -1.26 -4.67 118.68 114.42 3fef s LEU 88 Ca 0.40 -0.84 -0.24 0.00 -0.22 0.00 0.00 54.13 53.23 3fef s LEU 88 Cb 0.02 -1.71 -0.07 0.00 0.50 0.00 0.00 46.19 44.93 3fef s LEU 88 CO 0.22 -0.14 1.95 -2.84 -1.32 0.00 0.00 176.35 174.22 3fef s PRO 89 N 1.36 2.48 0.00 0.98 0.02 -1.26 -4.76 135.00 133.82 3fef s PRO 89 Ca 0.01 -0.74 0.00 0.00 0.02 0.00 0.00 61.00 60.28 3fef s PRO 89 Cb -0.17 -5.15 0.00 0.00 0.02 0.00 0.00 34.50 29.20 3fef s PRO 89 CO -0.03 -3.75 0.00 0.41 -0.33 0.00 0.00 177.00 173.30 3fef n GLY 90 N 6.29 -0.66 3.76 0.52 0.00 -1.26 -4.85 105.19 108.99 3fef n GLY 90 Ca 0.43 -2.17 -0.32 0.00 0.00 0.00 0.00 46.02 43.96 3fef n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fef s SER 91 N -4.00 4.16 0.42 1.61 1.04 -1.26 -5.00 113.70 110.67 3fef s SER 91 Ca 0.00 -1.59 0.16 0.00 0.48 0.00 0.00 55.95 55.00 3fef s SER 91 Cb 0.00 0.42 0.92 0.00 0.10 0.00 0.00 66.02 67.46 3fef s SER 91 CO 0.00 -0.84 1.91 -0.07 0.98 0.00 0.00 173.24 175.22 3fef h LEU 92 N 1.33 0.00 -0.36 2.42 3.38 -2.00 -2.07 115.31 118.01 3fef h LEU 92 Ca -0.43 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 3fef h LEU 92 Cb 1.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 3fef h LEU 92 CO 0.73 0.27 0.12 0.44 0.09 0.00 0.00 178.44 180.10 3fef h ASP 93 N 0.00 0.52 0.00 -0.43 5.19 -2.02 0.14 116.42 119.82 3fef h ASP 93 Ca -0.00 -0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.21 3fef h ASP 93 Cb 0.51 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.89 3fef h ASP 93 CO 0.04 0.58 0.00 0.47 -3.12 0.00 0.00 179.24 177.21 3fef n ASP 94 N -4.64 0.00 0.00 6.45 8.00 -0.78 -2.55 116.55 123.03 3fef n ASP 94 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.49 3fef n ASP 94 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 3fef n ASP 94 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3fef n GLU 96 N 0.63 0.00 0.11 -1.24 2.13 0.48 -0.86 120.64 121.88 3fef n GLU 96 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 3fef n GLU 96 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.64 3fef n GLU 96 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3fef h VAL 97 N 0.00 0.81 -0.62 6.31 2.07 -1.77 -0.60 116.25 122.45 3fef h VAL 97 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 3fef h VAL 97 Cb 0.00 0.81 -0.12 0.00 -1.52 0.00 0.00 31.29 30.46 3fef h VAL 97 CO 0.00 0.00 -0.35 0.44 0.02 0.00 0.00 177.57 177.68 3fef h ASP 98 N -0.23 -1.21 0.34 0.57 3.32 -1.29 -2.39 116.42 115.53 3fef h ASP 98 Ca -0.01 0.23 -0.33 0.00 0.02 0.00 0.00 57.03 56.95 3fef h ASP 98 Cb 0.19 0.60 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 3fef h ASP 98 CO 0.01 -0.31 -1.66 0.58 -1.72 0.00 0.00 179.24 176.15 3fef h VAL 99 N -0.16 1.01 0.00 -1.35 2.07 -1.82 -3.27 116.25 112.74 3fef h VAL 99 Ca 0.23 -2.65 -0.22 0.00 0.82 0.00 0.00 66.70 64.88 3fef h VAL 99 Cb 0.56 2.72 -0.04 0.00 -1.52 0.00 0.00 31.29 33.00 3fef h VAL 99 CO -0.70 0.82 -1.82 1.41 0.02 0.00 0.00 177.57 177.30 3fef n HIS 100 N -3.48 0.00 -0.28 1.57 8.25 -0.24 -4.51 115.22 116.54 3fef n HIS 100 Ca -0.21 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.33 3fef n HIS 100 Cb 1.06 -0.58 0.23 0.00 1.12 0.00 0.00 29.99 31.81 3fef n HIS 100 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3fef h LEU 101 N 0.00 0.31 -1.71 2.41 5.85 -1.51 0.76 115.31 121.43 3fef h LEU 101 Ca -0.32 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3fef h LEU 101 Cb 1.70 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.83 3fef h LEU 101 CO 0.01 0.08 0.05 -0.65 -0.34 0.00 0.00 178.44 177.59 3fef h PRO 102 N 0.45 0.00 -0.25 5.25 0.11 -1.82 -1.08 132.00 134.65 3fef h PRO 102 Ca 0.47 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.64 3fef h PRO 102 Cb 0.77 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 3fef h PRO 102 CO -0.45 0.00 0.18 0.93 -0.21 0.00 0.00 178.00 178.45 3fef h GLU 103 N 0.00 0.07 0.00 1.05 5.08 -0.67 0.14 114.58 120.24 3fef h GLU 103 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3fef h GLU 103 Cb 0.11 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3fef h GLU 103 CO 0.00 0.04 0.00 2.89 -1.00 0.00 0.00 179.01 180.94 3fef n ARG 104 N -4.48 0.14 -0.15 2.33 1.85 -0.41 -0.39 116.66 115.55 3fef n ARG 104 Ca 0.03 0.58 0.07 0.00 -1.00 0.00 0.00 57.85 57.52 3fef n ARG 104 Cb 0.29 -1.91 0.15 0.00 -1.05 0.00 0.00 32.46 29.93 3fef n ARG 104 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3fef n GLY 106 N 0.73 0.75 3.59 0.00 0.00 0.47 -4.99 105.19 105.74 3fef n GLY 106 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3fef n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fef s ILE 107 N -2.58 5.06 0.03 -0.61 1.01 -1.00 -4.96 121.20 118.16 3fef s ILE 107 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.30 3fef s ILE 107 Cb 0.00 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 3fef s ILE 107 CO 0.00 -0.02 0.13 -0.31 0.00 0.00 0.00 174.94 174.74 3fef s TYR 108 N 2.32 3.35 -0.02 3.97 2.02 -1.26 -2.82 117.35 124.91 3fef s TYR 108 Ca 0.20 0.20 0.02 0.00 -0.37 0.00 0.00 57.07 57.12 3fef s TYR 108 Cb -0.16 -1.72 0.00 0.00 -0.40 0.00 0.00 41.96 39.69 3fef s TYR 108 CO 0.11 0.57 -0.06 -0.65 -1.57 0.00 0.00 175.55 173.94 3fef s GLN 109 N -2.14 0.68 0.03 -0.62 -0.21 -1.26 -4.98 119.66 111.16 3fef s GLN 109 Ca 0.28 -0.21 -0.02 0.00 0.02 0.00 0.00 55.36 55.43 3fef s GLN 109 Cb -0.12 -0.67 -0.27 0.00 1.00 0.00 0.00 33.01 32.94 3fef s GLN 109 CO 0.20 0.07 0.97 0.66 -2.12 0.00 0.00 175.29 175.08 3fef h SER 110 N 6.39 0.37 0.00 5.90 4.64 -1.91 -3.43 113.55 125.52 3fef h SER 110 Ca -0.33 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.53 3fef h SER 110 Cb 1.17 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3fef h SER 110 CO 0.49 1.38 -0.27 0.52 -0.87 0.00 0.00 176.83 178.08 3fef n VAL 111 N -3.46 0.51 -0.89 0.95 0.31 -1.26 -0.51 118.33 113.97 3fef n VAL 111 Ca -0.13 0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3fef n VAL 111 Cb 1.03 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.75 3fef n VAL 111 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fef n GLY 112 N 2.71 0.46 0.25 2.92 0.00 -1.26 -4.87 105.19 105.40 3fef n GLY 112 Ca 0.00 -0.86 0.03 0.00 0.00 0.00 0.00 46.02 45.18 3fef n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fef n ASP 113 N 1.57 1.65 0.00 1.61 5.75 -1.26 -2.96 116.55 122.91 3fef n ASP 113 Ca 0.00 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 53.41 3fef n ASP 113 Cb 0.00 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 3fef n ASP 113 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 3fef n THR 114 N 0.27 0.00 -2.39 2.12 -1.04 -1.26 -2.31 114.28 109.68 3fef n THR 114 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 3fef n THR 114 Cb 0.18 -0.69 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 3fef n THR 114 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 3fef n VAL 115 N -2.44 0.00 -3.76 12.58 0.24 -1.26 -4.45 118.33 119.24 3fef n VAL 115 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3fef n VAL 115 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3fef n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fef n GLY 116 N 4.51 -0.56 0.14 7.63 0.00 -1.26 -0.34 105.19 115.31 3fef n GLY 116 Ca 0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.18 3fef n GLY 116 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fef h PRO 117 N 0.00 0.38 -0.46 1.61 0.10 -1.92 0.16 132.00 131.88 3fef h PRO 117 Ca 0.00 -0.02 0.06 0.00 0.10 0.00 0.00 66.00 66.14 3fef h PRO 117 Cb 0.00 -0.09 -0.05 0.00 0.10 0.00 0.00 31.00 30.96 3fef h PRO 117 CO 0.00 0.26 0.17 0.78 0.10 0.00 0.00 178.00 179.30 3fef h GLY 118 N 0.39 0.61 1.04 -0.55 0.00 -1.70 -1.25 103.07 101.61 3fef h GLY 118 Ca 0.11 -0.09 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 3fef h GLY 118 CO -0.02 0.02 -0.05 -1.33 0.00 0.00 0.00 176.54 175.16 3fef h GLY 119 N 0.34 1.02 0.96 4.60 0.00 -0.28 0.20 103.07 109.91 3fef h GLY 119 Ca 0.22 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 3fef h GLY 119 CO -0.22 0.72 0.18 -2.22 0.00 0.00 0.00 176.54 175.00 3fef h ILE 120 N 0.81 1.13 -0.08 2.60 1.08 -0.69 -0.29 117.51 122.07 3fef h ILE 120 Ca 0.14 -0.33 -0.14 0.00 -0.39 0.00 0.00 64.86 64.14 3fef h ILE 120 Cb 0.59 0.77 0.01 0.00 -3.07 0.00 0.00 36.82 35.12 3fef h ILE 120 CO 0.04 0.13 -0.49 0.40 -0.69 0.00 0.00 178.15 177.53 3fef h ILE 121 N 0.40 1.38 -0.76 -0.67 1.08 -1.02 -2.34 117.51 115.58 3fef h ILE 121 Ca 0.11 -1.85 0.06 0.00 -0.39 0.00 0.00 64.86 62.79 3fef h ILE 121 Cb 0.05 2.28 -0.06 0.00 -3.07 0.00 0.00 36.82 36.02 3fef h ILE 121 CO -0.02 0.55 0.45 -0.09 -0.69 0.00 0.00 178.15 178.35 3fef h ARG 122 N 0.04 0.80 -0.71 2.37 2.43 -0.60 -2.12 114.38 116.60 3fef h ARG 122 Ca -0.04 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3fef h ARG 122 Cb 1.15 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.47 3fef h ARG 122 CO 0.10 0.53 0.43 0.78 -1.51 0.00 0.00 179.97 180.31 3fef h GLY 123 N 0.83 1.03 0.93 2.80 0.00 -0.97 -0.79 103.07 106.90 3fef h GLY 123 Ca 0.33 -0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.36 3fef h GLY 123 CO -0.17 0.25 0.26 1.41 0.00 0.00 0.00 176.54 178.29 3fef h LEU 124 N 0.83 0.44 -1.59 3.11 -0.00 -0.91 -1.64 115.31 115.55 3fef h LEU 124 Ca 0.30 -0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.18 3fef h LEU 124 Cb 0.08 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 40.62 3fef h LEU 124 CO -0.13 0.32 0.29 -0.09 -0.00 0.00 0.00 178.44 178.82 3fef h ARG 125 N 0.54 0.55 0.00 1.13 2.43 -1.09 -2.96 114.38 114.98 3fef h ARG 125 Ca 0.17 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 3fef h ARG 125 Cb -0.02 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 3fef h ARG 125 CO -0.06 0.36 -0.56 0.00 -1.51 0.00 0.00 179.97 178.20 3fef h ALA 126 N 1.73 0.69 0.09 2.80 0.00 -0.25 -3.38 119.26 120.94 3fef h ALA 126 Ca 0.16 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.58 3fef h ALA 126 Cb -0.04 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 3fef h ALA 126 CO -0.04 0.71 -0.45 0.28 0.00 0.00 0.00 179.25 179.75 3fef h VAL 127 N 0.00 0.11 0.00 0.00 2.07 -1.19 -0.48 116.25 116.77 3fef h VAL 127 Ca -0.01 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 3fef h VAL 127 Cb 1.35 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3fef h VAL 127 CO 0.07 0.00 -0.21 1.55 0.02 0.00 0.00 177.57 179.00 3fef h PRO 128 N -0.67 0.00 -0.33 1.57 0.13 -1.76 0.33 132.00 131.28 3fef h PRO 128 Ca 0.02 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 3fef h PRO 128 Cb 0.70 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 3fef h PRO 128 CO -0.27 0.21 0.12 0.82 -0.23 0.00 0.00 178.00 178.66 3fef h ILE 129 N 0.00 1.19 -0.06 -3.56 2.04 -1.55 -2.49 117.51 113.09 3fef h ILE 129 Ca -0.00 -0.58 -0.20 0.00 1.00 0.00 0.00 64.86 65.08 3fef h ILE 129 Cb 0.42 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 3fef h ILE 129 CO 0.03 0.20 -0.79 -0.26 0.00 0.00 0.00 178.15 177.33 3fef h PHE 130 N 0.38 0.56 -0.56 1.37 0.04 -0.28 -2.42 116.94 116.02 3fef h PHE 130 Ca 0.11 -0.26 0.10 0.00 2.80 0.00 0.00 57.97 60.72 3fef h PHE 130 Cb 0.20 -0.08 -0.08 0.00 2.20 0.00 0.00 35.95 38.19 3fef h PHE 130 CO -0.00 1.04 0.09 0.00 -0.60 0.00 0.00 178.31 178.83 3fef h ALA 131 N 0.88 0.62 -0.47 2.45 0.00 -0.39 0.33 119.26 122.68 3fef h ALA 131 Ca -0.04 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3fef h ALA 131 Cb 1.38 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.35 3fef h ALA 131 CO 0.14 -0.33 -0.13 1.49 0.00 0.00 0.00 179.25 180.42 3fef h GLU 132 N 0.21 0.88 -0.36 0.00 4.81 -1.30 -1.99 114.58 116.84 3fef h GLU 132 Ca 0.29 -0.32 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 3fef h GLU 132 Cb 0.43 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 3fef h GLU 132 CO -0.40 0.96 -0.08 0.82 -0.73 0.00 0.00 179.01 179.58 3fef h ILE 133 N 0.79 1.28 -0.87 2.32 2.04 -1.11 -2.19 117.51 119.77 3fef h ILE 133 Ca 0.13 -1.14 0.09 0.00 1.00 0.00 0.00 64.86 64.93 3fef h ILE 133 Cb 0.65 1.27 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 3fef h ILE 133 CO 0.05 0.38 0.52 0.00 0.00 0.00 0.00 178.15 179.09 3fef h ALA 134 N 0.83 1.23 -0.25 1.87 0.00 -0.77 -0.32 119.26 121.84 3fef h ALA 134 Ca 0.09 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3fef h ALA 134 Cb 0.59 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3fef h ALA 134 CO 0.03 0.19 -0.34 0.00 0.00 0.00 0.00 179.25 179.14 3fef h ARG 135 N 0.89 0.52 -0.36 0.00 3.08 -1.27 0.01 114.38 117.26 3fef h ARG 135 Ca 0.40 -0.24 -0.16 0.00 0.07 0.00 0.00 59.98 60.06 3fef h ARG 135 Cb 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 3fef h ARG 135 CO -0.22 0.79 -0.41 0.00 -1.07 0.00 0.00 179.97 179.06 3fef h ALA 136 N 1.19 0.53 -0.40 0.04 0.00 -0.84 -0.42 119.26 119.36 3fef h ALA 136 Ca 0.05 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 3fef h ALA 136 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3fef h ALA 136 CO 0.07 0.65 -0.29 0.82 0.00 0.00 0.00 179.25 180.50 3fef h ILE 137 N 0.71 1.27 -0.39 0.00 2.04 -0.96 0.24 117.51 120.43 3fef h ILE 137 Ca 0.05 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.47 3fef h ILE 137 Cb 1.01 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 3fef h ILE 137 CO 0.10 0.48 0.24 -0.09 0.00 0.00 0.00 178.15 178.88 3fef h ARG 138 N 0.72 0.52 -0.13 2.37 2.43 -0.81 -0.90 114.38 118.59 3fef h ARG 138 Ca 0.08 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 59.03 3fef h ARG 138 Cb 0.84 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.27 3fef h ARG 138 CO 0.07 0.38 -0.69 -0.44 -1.51 0.00 0.00 179.97 177.79 3fef h ASP 139 N 0.51 0.62 0.00 -3.80 3.32 -0.69 -3.38 116.42 113.00 3fef h ASP 139 Ca 0.14 -0.38 -0.06 0.00 0.02 0.00 0.00 57.03 56.74 3fef h ASP 139 Cb -0.02 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 3fef h ASP 139 CO -0.03 1.13 -1.51 -1.22 -1.72 0.00 0.00 179.24 175.89 3fef n TYR 140 N -3.89 0.00 -2.85 4.55 4.01 0.80 -4.83 117.16 114.95 3fef n TYR 140 Ca -0.05 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.58 3fef n TYR 140 Cb 0.68 -0.31 0.06 0.00 -0.31 0.00 0.00 39.34 39.46 3fef n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3fef n ALA 141 N -2.03 0.48 0.31 -0.72 0.00 -0.42 -4.20 120.51 113.94 3fef n ALA 141 Ca -0.07 -2.09 0.16 0.00 0.00 0.00 0.00 53.44 51.44 3fef n ALA 141 Cb 0.46 -1.06 0.69 0.00 0.00 0.00 0.00 19.45 19.54 3fef n ALA 141 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3fef h PRO 142 N 2.89 0.00 -0.24 0.00 0.13 -1.53 -2.41 132.00 130.84 3fef h PRO 142 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 3fef h PRO 142 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3fef h PRO 142 CO 0.23 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.39 3fef n GLU 143 N -2.79 2.32 -1.88 0.86 -0.58 -1.26 -4.66 120.64 112.65 3fef n GLU 143 Ca 0.00 -2.09 -0.33 0.00 -0.42 0.00 0.00 57.16 54.33 3fef n GLU 143 Cb 0.24 -1.47 0.03 0.00 -0.57 0.00 0.00 31.44 29.67 3fef n GLU 143 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3fef s SER 144 N -1.61 5.50 -0.07 1.62 1.04 -0.91 -5.02 113.70 114.25 3fef s SER 144 Ca 0.33 1.84 -0.20 0.00 0.48 0.00 0.00 55.95 58.41 3fef s SER 144 Cb 0.21 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.75 3fef s SER 144 CO 0.29 -1.36 0.54 0.26 0.98 0.00 0.00 173.24 173.96 3fef s TRP 145 N -2.51 3.58 -0.15 5.02 0.52 -0.99 -4.29 118.94 120.11 3fef s TRP 145 Ca 0.64 1.04 -0.04 0.00 0.02 0.00 0.00 56.10 57.76 3fef s TRP 145 Cb -0.17 -2.60 -0.03 0.00 -1.15 0.00 0.00 33.47 29.52 3fef s TRP 145 CO 0.41 0.22 -0.03 0.08 0.02 0.00 0.00 176.95 177.66 3fef s VAL 146 N 0.37 4.01 -0.22 4.03 1.01 0.34 -0.41 120.40 129.53 3fef s VAL 146 Ca 0.29 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.96 3fef s VAL 146 Cb -0.16 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.49 3fef s VAL 146 CO 0.14 0.50 -0.13 -0.63 0.00 0.00 0.00 175.10 174.97 3fef s ILE 147 N 0.28 2.33 -0.19 2.22 1.01 0.14 -0.52 121.20 126.47 3fef s ILE 147 Ca -0.02 -1.18 -0.12 0.00 0.00 0.00 0.00 60.65 59.33 3fef s ILE 147 Cb -0.14 -2.16 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 3fef s ILE 147 CO 0.03 0.27 0.21 0.21 0.00 0.00 0.00 174.94 175.65 3fef s ASN 148 N 1.24 6.29 -0.00 3.58 2.47 0.13 -1.11 114.94 127.54 3fef s ASN 148 Ca -0.01 0.33 0.13 0.00 0.42 0.00 0.00 52.86 53.73 3fef s ASN 148 Cb -0.16 -2.13 -0.15 0.00 -1.45 0.00 0.00 41.25 37.36 3fef s ASN 148 CO -0.08 0.12 0.56 -1.22 -3.72 0.00 0.00 177.10 172.76 3fef n TYR 149 N 3.69 0.00 -2.27 0.43 4.01 0.86 -0.22 117.16 123.65 3fef n TYR 149 Ca -0.14 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.21 3fef n TYR 149 Cb 0.52 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.52 3fef n TYR 149 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3fef s THR 150 N -2.27 3.09 0.12 -0.72 2.01 -1.22 -4.94 115.64 111.71 3fef s THR 150 Ca 0.05 0.97 0.04 0.00 0.31 0.00 0.00 61.69 63.05 3fef s THR 150 Cb 0.10 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 3fef s THR 150 CO 0.55 0.13 0.14 0.20 -0.69 0.00 0.00 174.62 174.95 3fef s ASN 151 N -0.99 5.70 1.03 3.53 0.01 -1.26 -4.84 114.94 118.12 3fef s ASN 151 Ca 0.55 -0.01 -0.04 0.00 -0.71 0.00 0.00 52.86 52.64 3fef s ASN 151 Cb -0.32 -1.56 0.06 0.00 0.41 0.00 0.00 41.25 39.83 3fef s ASN 151 CO 0.41 0.11 0.26 -0.81 -1.51 0.00 0.00 177.10 175.57 3fef n PRO 152 N -0.02 -1.03 0.00 -0.60 -0.04 -0.98 -4.75 135.00 127.59 3fef n PRO 152 Ca -0.08 -0.41 0.00 0.00 -0.04 0.00 0.00 63.50 62.97 3fef n PRO 152 Cb 0.53 -0.34 0.00 0.00 -0.04 0.00 0.00 33.50 33.65 3fef n PRO 152 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3fef n SER 154 N -3.33 0.00 -0.04 3.54 7.64 -1.26 -2.12 113.62 118.05 3fef n SER 154 Ca 0.03 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.77 3fef n SER 154 Cb 0.13 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.25 3fef n SER 154 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3fef h VAL 155 N 0.00 1.38 -0.38 0.44 2.07 -1.96 -2.34 116.25 115.47 3fef h VAL 155 Ca 0.00 -1.56 -0.00 0.00 0.82 0.00 0.00 66.70 65.95 3fef h VAL 155 Cb 0.00 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 3fef h VAL 155 CO 0.00 0.46 0.22 0.00 0.02 0.00 0.00 177.57 178.27 3fef h THR 157 N 0.49 1.27 -0.79 0.00 2.02 -1.82 -2.55 112.91 111.53 3fef h THR 157 Ca 0.13 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.21 3fef h THR 157 Cb 0.02 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 3fef h THR 157 CO -0.02 0.36 0.46 -0.09 0.37 0.00 0.00 175.52 176.59 3fef h ARG 158 N 0.42 1.08 -0.81 6.66 9.65 -1.21 -1.69 114.38 128.48 3fef h ARG 158 Ca 0.09 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3fef h ARG 158 Cb 0.55 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.87 3fef h ARG 158 CO 0.03 0.77 0.47 0.28 2.80 0.00 0.00 179.97 184.32 3fef h VAL 159 N 1.09 1.23 -0.59 0.20 2.07 -1.09 -0.01 116.25 119.16 3fef h VAL 159 Ca 0.28 -0.54 0.12 0.00 0.82 0.00 0.00 66.70 67.38 3fef h VAL 159 Cb -0.02 0.13 -0.10 0.00 -1.52 0.00 0.00 31.29 29.78 3fef h VAL 159 CO -0.05 0.25 -0.02 -0.07 0.02 0.00 0.00 177.57 177.70 3fef h LEU 160 N 1.11 -0.29 -0.39 2.57 3.38 -0.88 -1.04 115.31 119.77 3fef h LEU 160 Ca 0.29 0.15 -0.17 0.00 0.09 0.00 0.00 57.88 58.23 3fef h LEU 160 Cb -0.01 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3fef h LEU 160 CO -0.05 -0.11 -0.81 1.88 0.09 0.00 0.00 178.44 179.44 3fef h TYR 161 N 0.10 0.01 -0.49 1.13 -1.99 -1.23 -1.15 116.97 113.36 3fef h TYR 161 Ca 0.30 -0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.94 3fef h TYR 161 Cb 0.48 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.19 3fef h TYR 161 CO -0.37 0.81 -0.02 0.87 -0.00 0.00 0.00 178.16 179.45 3fef h LYS 162 N 0.01 0.88 0.13 4.88 1.57 -0.61 -2.91 116.57 120.52 3fef h LYS 162 Ca -0.01 -0.29 -0.30 0.00 -1.87 0.00 0.00 60.65 58.18 3fef h LYS 162 Cb 1.43 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.66 3fef h LYS 162 CO 0.11 0.93 -1.42 0.28 -0.57 0.00 0.00 179.45 178.77 3fef h VAL 163 N 0.74 1.29 -2.76 0.50 2.07 -1.21 -3.40 116.25 113.48 3fef h VAL 163 Ca 0.14 -2.89 -0.60 0.00 0.82 0.00 0.00 66.70 64.16 3fef h VAL 163 Cb 0.55 2.84 -0.40 0.00 -1.52 0.00 0.00 31.29 32.76 3fef h VAL 163 CO 0.03 0.84 -0.78 0.12 0.02 0.00 0.00 177.57 177.80 3fef s PHE 164 N -2.63 2.14 0.42 1.57 5.36 -0.44 -4.90 117.98 119.49 3fef s PHE 164 Ca -0.07 -2.68 0.19 0.00 -0.96 0.00 0.00 56.93 53.41 3fef s PHE 164 Cb 0.07 -1.75 1.12 0.00 -0.34 0.00 0.00 43.02 42.11 3fef s PHE 164 CO 0.87 -0.72 1.82 -1.35 -1.46 0.00 0.00 175.22 174.38 3fef h PRO 165 N 5.83 0.37 -0.40 10.12 0.11 -1.73 -0.35 132.00 145.95 3fef h PRO 165 Ca 0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3fef h PRO 165 Cb 0.86 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.89 3fef h PRO 165 CO 0.51 0.24 0.00 0.41 -0.21 0.00 0.00 178.00 178.96 3fef n GLY 166 N -1.52 0.81 3.76 -0.55 0.00 -1.26 -4.95 105.19 101.49 3fef n GLY 166 Ca 0.22 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 3fef n GLY 166 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3fef s ILE 167 N -1.56 2.77 -0.69 -0.61 2.07 -0.14 -4.98 121.20 118.06 3fef s ILE 167 Ca 0.24 0.56 -0.08 0.00 -1.41 0.00 0.00 60.65 59.97 3fef s ILE 167 Cb 0.13 -3.28 0.18 0.00 0.13 0.00 0.00 42.46 39.62 3fef s ILE 167 CO 0.15 -0.02 0.56 -0.54 -1.91 0.00 0.00 174.94 173.18 3fef s LYS 168 N -2.84 2.97 0.01 3.50 1.02 -1.26 -5.01 119.74 118.12 3fef s LYS 168 Ca 0.68 -2.44 0.02 0.00 0.02 0.00 0.00 55.97 54.25 3fef s LYS 168 Cb -0.32 -4.02 -0.01 0.00 -0.52 0.00 0.00 37.83 32.96 3fef s LYS 168 CO 0.38 -1.22 -0.08 0.00 -0.92 0.00 0.00 175.35 173.51 3fef s ALA 169 N 0.14 0.63 0.13 5.17 0.00 -1.26 -0.51 121.76 126.06 3fef s ALA 169 Ca 0.16 -0.42 0.05 0.00 0.00 0.00 0.00 51.96 51.75 3fef s ALA 169 Cb -0.17 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3fef s ALA 169 CO -0.05 0.12 -0.11 0.96 0.00 0.00 0.00 175.76 176.68 3fef s ILE 170 N -0.42 1.18 -0.11 0.00 -4.36 0.32 -4.89 121.20 112.91 3fef s ILE 170 Ca 0.00 -1.90 -0.04 0.00 -0.26 0.00 0.00 60.65 58.45 3fef s ILE 170 Cb -0.04 -1.68 -0.04 0.00 1.25 0.00 0.00 42.46 41.95 3fef s ILE 170 CO -0.00 -0.63 0.05 -0.83 0.24 0.00 0.00 174.94 173.77 3fef s GLY 171 N -2.86 1.94 -0.05 6.27 0.00 -0.36 0.18 107.32 112.45 3fef s GLY 171 Ca 0.13 -0.75 0.06 0.00 0.00 0.00 0.00 44.72 44.16 3fef s GLY 171 CO 0.01 -0.40 -0.23 0.00 0.00 0.00 0.00 173.10 172.48 3fef n HIS 174 N 1.69 0.00 -0.16 0.00 1.44 -1.26 -4.62 115.22 112.30 3fef n HIS 174 Ca -0.23 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.49 3fef n HIS 174 Cb 0.55 -0.00 0.28 0.00 0.12 0.00 0.00 29.99 30.94 3fef n HIS 174 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 3fef h GLU 175 N 4.09 0.88 -0.10 -1.40 4.39 -1.97 -1.27 114.58 119.20 3fef h GLU 175 Ca 0.00 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 3fef h GLU 175 Cb 0.92 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 3fef h GLU 175 CO 0.00 0.60 -0.17 0.28 -1.16 0.00 0.00 179.01 178.55 3fef h VAL 176 N 0.90 1.18 -0.90 3.13 2.07 -1.82 -2.47 116.25 118.34 3fef h VAL 176 Ca 0.24 -0.80 0.04 0.00 0.82 0.00 0.00 66.70 67.00 3fef h VAL 176 Cb -0.08 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 3fef h VAL 176 CO -0.05 0.24 0.59 -0.26 0.02 0.00 0.00 177.57 178.11 3fef h PHE 177 N 0.15 1.08 -0.19 1.57 0.04 -1.55 -1.26 116.94 116.78 3fef h PHE 177 Ca 0.03 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.78 3fef h PHE 177 Cb 0.40 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 3fef h PHE 177 CO 0.00 0.62 -0.08 0.78 -0.60 0.00 0.00 178.31 179.03 3fef h GLY 178 N 1.12 0.32 1.38 -1.45 0.00 -1.48 -1.50 103.07 101.45 3fef h GLY 178 Ca 0.36 -0.18 -0.27 0.00 0.00 0.00 0.00 47.33 47.24 3fef h GLY 178 CO -0.11 0.17 -1.11 -0.84 0.00 0.00 0.00 176.54 174.65 3fef h THR 179 N 0.28 1.35 -0.69 4.70 2.02 -1.28 -2.11 112.91 117.19 3fef h THR 179 Ca 0.06 -2.49 0.04 0.00 0.77 0.00 0.00 66.41 64.79 3fef h THR 179 Cb 0.33 2.57 -0.04 0.00 -1.74 0.00 0.00 68.15 69.27 3fef h THR 179 CO 0.02 0.75 0.45 1.56 0.37 0.00 0.00 175.52 178.67 3fef h GLN 180 N 0.26 0.79 -0.44 6.66 4.20 -1.02 -0.11 115.11 125.45 3fef h GLN 180 Ca -0.14 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.41 3fef h GLN 180 Cb 1.77 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.36 3fef h GLN 180 CO 0.20 0.52 -0.19 0.87 -0.67 0.00 0.00 178.83 179.57 3fef h LYS 181 N 0.81 0.90 -0.57 1.46 1.57 -1.15 0.99 116.57 120.58 3fef h LYS 181 Ca 0.28 -0.38 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 3fef h LYS 181 Cb 0.08 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 3fef h LYS 181 CO -0.08 1.04 0.35 1.25 -0.57 0.00 0.00 179.45 181.44 3fef h LEU 182 N 0.73 0.57 -0.63 2.94 5.85 -0.82 -1.17 115.31 122.79 3fef h LEU 182 Ca 0.10 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.69 3fef h LEU 182 Cb 0.75 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 3fef h LEU 182 CO 0.06 0.40 -0.40 -0.07 -0.34 0.00 0.00 178.44 178.09 3fef h LEU 183 N 0.70 0.66 -0.40 2.25 3.38 -0.69 -2.96 115.31 118.23 3fef h LEU 183 Ca 0.23 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.93 3fef h LEU 183 Cb 0.01 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3fef h LEU 183 CO -0.09 0.98 0.21 0.00 0.09 0.00 0.00 178.44 179.63 3fef h ALA 184 N 1.05 0.50 0.00 1.53 0.00 -0.34 -1.33 119.26 120.67 3fef h ALA 184 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fef h ALA 184 Cb 0.92 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3fef h ALA 184 CO 0.08 -0.15 0.00 0.39 0.00 0.00 0.00 179.25 179.57 3fef n GLU 185 N -4.91 0.34 0.00 0.00 1.02 -0.48 -2.56 120.64 114.05 3fef n GLU 185 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3fef n GLU 185 Cb 0.09 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 3fef n GLU 185 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fef n VAL 187 N 1.14 0.00 -0.02 2.62 0.31 -0.50 -0.67 118.33 121.21 3fef n VAL 187 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 3fef n VAL 187 Cb 0.17 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.01 3fef n VAL 187 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3fef h THR 188 N 0.00 1.32 -0.37 2.52 2.02 -1.49 -0.22 112.91 116.68 3fef h THR 188 Ca 0.00 -0.97 -0.09 0.00 0.77 0.00 0.00 66.41 66.12 3fef h THR 188 Cb 0.00 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 3fef h THR 188 CO 0.00 0.26 -0.12 -0.08 0.37 0.00 0.00 175.52 175.95 3fef h GLU 189 N -0.29 0.66 0.04 6.66 4.81 -1.20 0.19 114.58 125.46 3fef h GLU 189 Ca 0.01 -0.21 -0.31 0.00 -0.13 0.00 0.00 59.36 58.72 3fef h GLU 189 Cb 0.43 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 3fef h GLU 189 CO 0.01 0.77 -1.79 0.54 -0.73 0.00 0.00 179.01 177.80 3fef n ARG 190 N -4.17 0.67 0.00 1.92 5.12 -1.24 -4.50 116.66 114.46 3fef n ARG 190 Ca 0.01 0.29 0.03 0.00 -1.93 0.00 0.00 57.85 56.25 3fef n ARG 190 Cb 0.35 -1.77 -0.03 0.00 -1.16 0.00 0.00 32.46 29.86 3fef n ARG 190 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3fef n LEU 191 N -3.18 0.38 0.00 0.55 4.77 -0.10 -5.00 117.00 114.42 3fef n LEU 191 Ca -0.21 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 3fef n LEU 191 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 3fef n LEU 191 CO 0.44 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3fef n GLY 192 N 1.06 0.41 3.73 -0.72 0.00 0.68 -4.98 105.19 105.36 3fef n GLY 192 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 3fef n GLY 192 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fef s ILE 193 N -1.92 4.73 0.33 -0.61 -4.36 -1.25 -4.97 121.20 113.16 3fef s ILE 193 Ca 0.00 -0.08 -0.27 0.00 -0.26 0.00 0.00 60.65 60.04 3fef s ILE 193 Cb 0.00 -3.03 -0.09 0.00 1.25 0.00 0.00 42.46 40.58 3fef s ILE 193 CO 0.00 0.59 1.05 -1.61 0.24 0.00 0.00 174.94 175.21 3fef s GLU 194 N -0.75 4.45 -0.23 0.37 0.41 -1.26 -3.33 118.70 118.35 3fef s GLU 194 Ca 0.12 1.62 -0.00 0.00 -0.41 0.00 0.00 54.97 56.30 3fef s GLU 194 Cb -0.12 -2.89 0.03 0.00 -1.78 0.00 0.00 34.13 29.37 3fef s GLU 194 CO 0.03 0.09 -0.11 0.08 -0.49 0.00 0.00 175.26 174.86 3fef s VAL 195 N -1.41 2.53 0.15 2.63 1.01 -1.26 -5.02 120.40 119.03 3fef s VAL 195 Ca 0.50 -1.12 -0.18 0.00 0.00 0.00 0.00 61.98 61.18 3fef s VAL 195 Cb -0.26 -2.27 0.02 0.00 0.00 0.00 0.00 36.38 33.86 3fef s VAL 195 CO 0.33 0.24 1.70 -0.65 0.00 0.00 0.00 175.10 176.73 3fef h PRO 196 N 7.95 0.06 -3.52 2.72 0.11 -1.99 -3.45 132.00 133.88 3fef h PRO 196 Ca -0.33 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.62 3fef h PRO 196 Cb 1.10 -0.01 -0.22 0.00 0.11 0.00 0.00 31.00 31.98 3fef h PRO 196 CO 0.57 0.04 -0.52 1.03 -0.21 0.00 0.00 178.00 178.91 3fef s ARG 197 N -6.19 0.39 0.60 1.05 0.52 -1.26 -5.03 118.95 109.03 3fef s ARG 197 Ca -0.13 -0.27 0.35 0.00 -0.52 0.00 0.00 55.73 55.16 3fef s ARG 197 Cb 0.12 0.16 1.92 0.00 0.52 0.00 0.00 34.95 37.67 3fef s ARG 197 CO 0.70 -0.09 2.23 0.07 0.02 0.00 0.00 175.30 178.23 3fef h ARG 198 N 4.71 0.00 0.00 3.54 -0.00 -1.90 -0.38 114.38 120.36 3fef h ARG 198 Ca -0.29 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.68 3fef h ARG 198 Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.17 3fef h ARG 198 CO 0.41 0.03 -0.01 0.93 -0.00 0.00 0.00 179.97 181.32 3fef h GLU 199 N 0.00 0.00 0.00 0.08 3.07 -1.96 -1.28 114.58 114.50 3fef h GLU 199 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3fef h GLU 199 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 3fef h GLU 199 CO 0.00 0.01 0.00 -0.25 -1.40 0.00 0.00 179.01 177.38 3fef n ASP 200 N -3.92 0.00 -4.48 1.42 8.00 -0.15 -4.35 116.55 113.07 3fef n ASP 200 Ca -0.03 0.24 -0.43 0.00 0.71 0.00 0.00 54.79 55.29 3fef n ASP 200 Cb 0.10 -0.39 -0.04 0.00 -0.02 0.00 0.00 41.12 40.77 3fef n ASP 200 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fef s ILE 201 N -2.77 4.46 -0.41 0.53 -1.09 -0.48 -4.35 121.20 117.09 3fef s ILE 201 Ca 0.13 -0.10 -0.18 0.00 -2.23 0.00 0.00 60.65 58.27 3fef s ILE 201 Cb 0.12 -4.55 0.01 0.00 -1.58 0.00 0.00 42.46 36.47 3fef s ILE 201 CO 0.30 -1.18 0.52 -0.13 -1.23 0.00 0.00 174.94 173.22 3fef s ARG 202 N 3.73 3.30 0.09 2.79 1.81 -0.13 -4.92 118.95 125.62 3fef s ARG 202 Ca 0.24 -0.48 0.10 0.00 -1.72 0.00 0.00 55.73 53.87 3fef s ARG 202 Cb -0.15 -3.92 -0.04 0.00 -0.45 0.00 0.00 34.95 30.40 3fef s ARG 202 CO 0.15 -0.83 -0.25 0.14 -0.68 0.00 0.00 175.30 173.82 3fef s VAL 203 N 2.40 2.33 -0.50 3.52 -7.23 -1.26 -0.93 120.40 118.74 3fef s VAL 203 Ca 0.17 -1.54 -0.14 0.00 -1.81 0.00 0.00 61.98 58.66 3fef s VAL 203 Cb -0.16 -1.99 0.11 0.00 0.56 0.00 0.00 36.38 34.91 3fef s VAL 203 CO 0.15 0.22 0.42 0.21 -0.31 0.00 0.00 175.10 175.79 3fef s ASN 204 N -1.70 6.03 -0.05 4.85 2.47 0.46 -4.96 114.94 122.04 3fef s ASN 204 Ca 0.14 -1.69 0.03 0.00 0.42 0.00 0.00 52.86 51.76 3fef s ASN 204 Cb -0.10 -2.14 -0.03 0.00 -1.45 0.00 0.00 41.25 37.53 3fef s ASN 204 CO 0.05 -0.75 -0.11 0.54 -3.72 0.00 0.00 177.10 173.10 3fef s VAL 205 N 1.54 3.31 0.18 -5.21 0.11 -1.26 -1.90 120.40 117.17 3fef s VAL 205 Ca 0.04 -0.66 -0.21 0.00 -2.93 0.00 0.00 61.98 58.22 3fef s VAL 205 Cb -0.27 -2.33 0.05 0.00 -1.53 0.00 0.00 36.38 32.30 3fef s VAL 205 CO 0.03 0.57 0.58 -1.48 -3.33 0.00 0.00 175.10 171.47 3fef s LEU 206 N -0.84 -0.27 0.00 2.54 2.34 0.06 -3.97 118.68 118.55 3fef s LEU 206 Ca 0.12 -0.23 0.00 0.00 0.06 0.00 0.00 54.13 54.08 3fef s LEU 206 Cb -0.11 2.43 0.00 0.00 -0.56 0.00 0.00 46.19 47.95 3fef s LEU 206 CO 0.01 -1.03 0.00 0.61 -1.06 0.00 0.00 176.35 174.89 3fef n GLY 207 N -0.36 0.54 3.33 -3.48 0.00 -1.02 -0.12 105.19 104.08 3fef n GLY 207 Ca -0.13 -1.55 -0.18 0.00 0.00 0.00 0.00 46.02 44.15 3fef n GLY 207 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fef s ILE 208 N -3.32 1.67 0.14 -0.61 -4.36 -1.12 -0.55 121.20 113.04 3fef s ILE 208 Ca 0.00 -2.12 -0.34 0.00 -0.26 0.00 0.00 60.65 57.93 3fef s ILE 208 Cb 0.00 -1.96 -0.16 0.00 1.25 0.00 0.00 42.46 41.59 3fef s ILE 208 CO 0.00 -0.56 1.22 -3.20 0.24 0.00 0.00 174.94 172.64 3fef n ASN 209 N -0.21 1.44 0.00 4.36 5.15 -1.26 -0.48 115.26 124.26 3fef n ASN 209 Ca -0.09 1.13 0.00 0.00 -0.60 0.00 0.00 54.58 55.02 3fef n ASN 209 Cb 0.60 -1.20 0.00 0.00 -0.53 0.00 0.00 39.78 38.64 3fef n ASN 209 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 3fef n HIS 210 N 1.86 0.00 -2.94 1.20 8.25 -1.26 -4.82 115.22 117.51 3fef n HIS 210 Ca 0.16 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.49 3fef n HIS 210 Cb 0.23 -0.84 0.01 0.00 1.12 0.00 0.00 29.99 30.50 3fef n HIS 210 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3fef n PHE 211 N -2.13 0.21 -3.99 4.41 7.35 0.37 -4.08 117.46 119.61 3fef n PHE 211 Ca 0.00 -3.23 -0.25 0.00 -0.76 0.00 0.00 57.45 53.21 3fef n PHE 211 Cb 0.07 -0.17 -0.03 0.00 0.35 0.00 0.00 39.48 39.69 3fef n PHE 211 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3fef s THR 212 N -2.39 5.08 -0.03 -2.13 -4.23 -1.18 -2.81 115.64 107.96 3fef s THR 212 Ca 0.33 -0.87 -0.03 0.00 -1.18 0.00 0.00 61.69 59.94 3fef s THR 212 Cb 0.39 -3.65 0.01 0.00 1.34 0.00 0.00 72.50 70.59 3fef s THR 212 CO -0.03 -0.16 0.07 0.26 -0.54 0.00 0.00 174.62 174.22 3fef s TRP 213 N -1.82 -0.06 -0.29 3.99 0.52 0.83 -0.19 118.94 121.92 3fef s TRP 213 Ca 0.34 0.16 -0.07 0.00 0.02 0.00 0.00 56.10 56.54 3fef s TRP 213 Cb -0.10 0.02 -0.00 0.00 -1.15 0.00 0.00 33.47 32.23 3fef s TRP 213 CO 0.27 -0.06 0.09 0.42 0.02 0.00 0.00 176.95 177.70 3fef s ILE 214 N -0.08 4.13 -0.25 2.03 1.01 0.56 -0.76 121.20 127.83 3fef s ILE 214 Ca -0.01 -0.55 0.21 0.00 0.00 0.00 0.00 60.65 60.30 3fef s ILE 214 Cb -0.01 -3.08 -0.30 0.00 0.01 0.00 0.00 42.46 39.08 3fef s ILE 214 CO 0.00 0.13 0.55 0.35 0.00 0.00 0.00 174.94 175.98 3fef n THR 215 N 4.90 0.00 -3.91 2.92 -2.24 -0.80 -1.11 114.28 114.04 3fef n THR 215 Ca -0.15 -0.36 -0.11 0.00 -2.27 0.00 0.00 64.05 61.16 3fef n THR 215 Cb 0.49 0.26 -0.12 0.00 -2.10 0.00 0.00 70.33 68.87 3fef n THR 215 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3fef s LYS 216 N -3.31 0.27 -0.06 -0.78 1.02 -1.25 -5.00 119.74 110.63 3fef s LYS 216 Ca -0.04 -0.32 -0.25 0.00 0.02 0.00 0.00 55.97 55.38 3fef s LYS 216 Cb 0.14 0.11 0.06 0.00 -0.52 0.00 0.00 37.83 37.61 3fef s LYS 216 CO 0.85 -0.05 0.57 0.00 -0.92 0.00 0.00 175.35 175.80 3fef s ALA 217 N -0.92 -1.47 0.04 5.17 0.00 -1.26 -0.40 121.76 122.92 3fef s ALA 217 Ca -0.10 1.09 -0.14 0.00 0.00 0.00 0.00 51.96 52.81 3fef s ALA 217 Cb -0.06 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.98 3fef s ALA 217 CO -0.00 -0.33 0.30 -1.54 0.00 0.00 0.00 175.76 174.19 3fef s SER 218 N -1.05 -0.12 -0.21 0.00 1.04 -0.10 -1.16 113.70 112.09 3fef s SER 218 Ca -0.10 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.14 3fef s SER 218 Cb -0.02 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.48 3fef s SER 218 CO 0.07 -0.61 -0.14 -0.47 0.98 0.00 0.00 173.24 173.07 3fef s TYR 219 N -2.55 2.94 0.00 5.02 5.04 -0.70 -0.96 117.35 126.14 3fef s TYR 219 Ca -0.05 -1.66 0.00 0.00 -2.44 0.00 0.00 57.07 52.92 3fef s TYR 219 Cb -0.01 -1.97 0.00 0.00 0.35 0.00 0.00 41.96 40.33 3fef s TYR 219 CO -0.03 -0.78 0.00 0.54 -1.34 0.00 0.00 175.55 173.94 3fef n ARG 220 N 4.62 0.00 0.00 4.97 1.74 -1.26 -0.60 116.66 126.13 3fef n ARG 220 Ca -0.19 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.04 3fef n ARG 220 Cb 0.48 0.00 0.68 0.00 -1.02 0.00 0.00 32.46 32.60 3fef n ARG 220 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 3fef n HIS 221 N 13.61 0.00 -3.53 -1.55 1.44 -1.26 -4.86 115.22 119.08 3fef n HIS 221 Ca 0.00 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.34 3fef n HIS 221 Cb 0.00 -0.03 -0.08 0.00 0.12 0.00 0.00 29.99 30.01 3fef n HIS 221 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3fef s ILE 222 N -2.08 5.29 -0.11 0.61 1.01 0.24 -5.05 121.20 121.11 3fef s ILE 222 Ca 0.40 0.49 -0.30 0.00 0.00 0.00 0.00 60.65 61.25 3fef s ILE 222 Cb 0.21 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 3fef s ILE 222 CO 0.37 0.33 1.11 -0.62 0.00 0.00 0.00 174.94 176.13 3fef s ASP 223 N 0.80 7.13 0.18 3.58 -1.08 -1.26 -1.72 116.67 124.30 3fef s ASP 223 Ca 0.15 1.64 0.23 0.00 -0.52 0.00 0.00 52.55 54.04 3fef s ASP 223 Cb -0.14 -2.55 0.08 0.00 -1.46 0.00 0.00 42.92 38.85 3fef s ASP 223 CO 0.05 -0.55 1.11 -0.07 0.52 0.00 0.00 175.17 176.22 3fef h LEU 224 N 8.40 0.00 0.17 -1.34 3.38 -1.50 -3.39 115.31 121.02 3fef h LEU 224 Ca -0.30 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 3fef h LEU 224 Cb 1.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 3fef h LEU 224 CO 0.89 0.03 -0.11 -0.07 0.09 0.00 0.00 178.44 179.27 3fef h LEU 225 N 0.00 -0.27 -1.81 1.67 4.07 -1.92 0.73 115.31 117.78 3fef h LEU 225 Ca 0.00 0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.04 3fef h LEU 225 Cb 0.93 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.74 3fef h LEU 225 CO 0.00 -0.18 0.26 -0.65 -1.08 0.00 0.00 178.44 176.80 3fef h PRO 226 N -0.27 0.23 -0.22 1.13 0.11 -1.97 -0.67 132.00 130.34 3fef h PRO 226 Ca -0.01 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.88 3fef h PRO 226 Cb 0.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.29 3fef h PRO 226 CO 0.01 0.15 -0.66 0.82 -0.21 0.00 0.00 178.00 178.12 3fef h ILE 227 N 0.24 1.28 -0.11 4.15 2.04 -1.62 -2.95 117.51 120.54 3fef h ILE 227 Ca 0.17 -1.85 -0.06 0.00 1.00 0.00 0.00 64.86 64.12 3fef h ILE 227 Cb 0.38 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 3fef h ILE 227 CO -0.03 0.59 -0.19 0.15 0.00 0.00 0.00 178.15 178.67 3fef h PHE 228 N 0.59 0.19 -0.31 1.37 3.04 0.10 -0.55 116.94 121.37 3fef h PHE 228 Ca -0.02 -0.03 0.07 0.00 3.98 0.00 0.00 57.97 61.98 3fef h PHE 228 Cb 1.27 -0.05 -0.07 0.00 2.56 0.00 0.00 35.95 39.66 3fef h PHE 228 CO 0.08 0.37 -0.16 -0.09 -2.02 0.00 0.00 178.31 176.48 3fef h ARG 229 N 0.17 -0.11 -0.03 1.11 9.65 -0.99 0.29 114.38 124.46 3fef h ARG 229 Ca 0.03 0.01 -0.19 0.00 -1.10 0.00 0.00 59.98 58.73 3fef h ARG 229 Cb 0.44 0.03 0.01 0.00 -1.39 0.00 0.00 29.97 29.06 3fef h ARG 229 CO 0.03 -0.08 -0.73 0.93 2.80 0.00 0.00 179.97 182.92 3fef h GLU 230 N -0.12 0.56 -0.47 0.20 5.08 -1.36 -1.63 114.58 116.85 3fef h GLU 230 Ca 0.16 -0.55 0.09 0.00 -1.00 0.00 0.00 59.36 58.05 3fef h GLU 230 Cb 0.36 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 29.69 3fef h GLU 230 CO -0.39 1.18 0.03 0.35 -1.00 0.00 0.00 179.01 179.18 3fef h PHE 231 N 0.15 0.03 -0.63 4.33 3.57 -0.98 0.12 116.94 123.53 3fef h PHE 231 Ca -0.08 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.40 3fef h PHE 231 Cb 1.41 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 3fef h PHE 231 CO 0.12 -0.07 0.19 1.03 -2.23 0.00 0.00 178.31 177.35 3fef h SER 232 N 0.15 0.92 -0.60 0.41 0.87 -0.38 -2.17 113.55 112.75 3fef h SER 232 Ca 0.23 -0.21 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 3fef h SER 232 Cb 0.34 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3fef h SER 232 CO -0.36 0.89 0.01 0.00 -0.53 0.00 0.00 176.83 176.84 3fef h ALA 233 N 1.07 0.80 -0.29 6.23 0.00 -0.55 -0.51 119.26 126.00 3fef h ALA 233 Ca 0.20 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 3fef h ALA 233 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3fef h ALA 233 CO -0.01 0.63 -0.22 1.25 0.00 0.00 0.00 179.25 180.91 3fef h HIS 234 N 0.94 0.78 -0.53 0.00 6.17 -0.69 -3.32 115.15 118.50 3fef h HIS 234 Ca 0.17 -0.22 0.00 0.00 0.71 0.00 0.00 60.37 61.03 3fef h HIS 234 Cb 0.54 -0.17 0.00 0.00 2.52 0.00 0.00 27.41 30.30 3fef h HIS 234 CO 0.04 0.93 0.00 0.66 0.71 0.00 0.00 177.93 180.27 3fef n TYR 235 N -4.33 0.93 -0.36 5.26 4.01 -0.82 -4.61 117.16 117.23 3fef n TYR 235 Ca -0.04 -0.57 0.02 0.00 -0.16 0.00 0.00 57.90 57.16 3fef n TYR 235 Cb 0.42 -0.10 0.17 0.00 -0.31 0.00 0.00 39.34 39.52 3fef n TYR 235 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3fef h GLY 236 N 3.21 1.48 0.67 2.72 0.00 -1.19 0.69 103.07 110.64 3fef h GLY 236 Ca 0.00 -0.48 -0.26 0.00 0.00 0.00 0.00 47.33 46.59 3fef h GLY 236 CO 0.08 0.38 -1.29 0.83 0.00 0.00 0.00 176.54 176.54 3fef h GLU 237 N 1.21 0.29 0.00 4.80 4.39 -1.86 -3.37 114.58 120.04 3fef h GLU 237 Ca 0.41 -0.50 -0.19 0.00 0.34 0.00 0.00 59.36 59.43 3fef h GLU 237 Cb 0.09 0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.90 3fef h GLU 237 CO -0.15 1.24 -0.90 0.66 -1.16 0.00 0.00 179.01 178.70 3fef h SER 238 N -0.26 0.00 -4.02 1.42 4.64 -1.83 -3.50 113.55 109.99 3fef h SER 238 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3fef h SER 238 Cb 1.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.88 3fef h SER 238 CO 0.11 0.88 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 3fef n GLY 239 N 1.33 -1.68 2.74 -0.77 0.00 0.24 -4.97 105.19 102.08 3fef n GLY 239 Ca 0.00 -1.52 -0.19 0.00 0.00 0.00 0.00 46.02 44.31 3fef n GLY 239 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fef s TYR 240 N -1.70 0.20 -0.14 1.61 5.04 0.14 -4.83 117.35 117.67 3fef s TYR 240 Ca 0.00 0.11 -0.07 0.00 -2.44 0.00 0.00 57.07 54.67 3fef s TYR 240 Cb 0.00 -0.46 -0.04 0.00 0.35 0.00 0.00 41.96 41.81 3fef s TYR 240 CO 0.00 -0.18 0.12 -1.21 -1.34 0.00 0.00 175.55 172.94 3fef s GLU 241 N 1.66 3.57 0.78 4.97 2.02 -1.26 -4.25 118.70 126.20 3fef s GLU 241 Ca -0.01 -0.20 -0.15 0.00 0.02 0.00 0.00 54.97 54.64 3fef s GLU 241 Cb -0.13 -3.19 0.02 0.00 0.10 0.00 0.00 34.13 30.93 3fef s GLU 241 CO -0.03 0.64 0.80 1.28 0.02 0.00 0.00 175.26 177.97 3fef n LEU 242 N 2.42 2.28 -4.75 1.80 4.77 -1.26 -4.88 117.00 117.37 3fef n LEU 242 Ca -0.19 0.57 -0.42 0.00 -0.03 0.00 0.00 56.01 55.94 3fef n LEU 242 Cb 0.54 -1.34 -0.01 0.00 -2.33 0.00 0.00 43.42 40.28 3fef n LEU 242 CO 0.32 -2.55 1.20 1.21 -1.33 0.00 0.00 177.39 176.23 3fef n GLU 243 N -1.83 2.67 -1.00 3.23 4.07 -1.26 -1.93 120.64 124.59 3fef n GLU 243 Ca 0.11 0.94 0.00 0.00 -0.06 0.00 0.00 57.16 58.16 3fef n GLU 243 Cb 0.50 -2.70 0.00 0.00 -0.06 0.00 0.00 31.44 29.18 3fef n GLU 243 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3fef n GLY 244 N 1.57 0.33 3.37 8.31 0.00 -1.26 -5.00 105.19 112.51 3fef n GLY 244 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3fef n GLY 244 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fef s GLU 245 N -0.68 1.38 -0.00 1.61 2.02 -0.81 -5.14 118.70 117.08 3fef s GLU 245 Ca 0.00 -1.43 0.04 0.00 0.02 0.00 0.00 54.97 53.60 3fef s GLU 245 Cb 0.00 -1.62 -0.01 0.00 0.10 0.00 0.00 34.13 32.60 3fef s GLU 245 CO 0.00 0.35 -0.13 0.00 0.02 0.00 0.00 175.26 175.50 3fef h TRP 247 N 5.71 0.00 -0.00 0.00 5.08 -1.92 -0.33 115.95 124.49 3fef h TRP 247 Ca -0.34 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.63 3fef h TRP 247 Cb 1.17 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.33 3fef h TRP 247 CO 0.42 0.03 -0.04 0.54 -1.28 0.00 0.00 178.44 178.11 3fef n ARG 248 N -3.67 0.97 -0.27 0.12 1.74 -1.26 -4.17 116.66 110.12 3fef n ARG 248 Ca -0.03 -0.26 0.01 0.00 -0.77 0.00 0.00 57.85 56.81 3fef n ARG 248 Cb 0.12 -1.49 0.22 0.00 -1.02 0.00 0.00 32.46 30.29 3fef n ARG 248 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3fef h ASP 249 N 0.63 0.93 -5.06 0.55 3.32 -1.44 -3.46 116.42 111.89 3fef h ASP 249 Ca 0.00 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.04 3fef h ASP 249 Cb 0.24 -0.22 -0.08 0.00 0.22 0.00 0.00 39.33 39.48 3fef h ASP 249 CO 0.00 0.65 0.12 -0.94 -1.72 0.00 0.00 179.24 177.35 3fef s SER 250 N -6.21 -0.29 0.35 6.45 1.04 -1.26 -5.02 113.70 108.75 3fef s SER 250 Ca -0.11 -0.50 0.25 0.00 0.48 0.00 0.00 55.95 56.07 3fef s SER 250 Cb 0.18 0.64 1.23 0.00 0.10 0.00 0.00 66.02 68.17 3fef s SER 250 CO 0.79 -1.16 1.76 -0.37 0.98 0.00 0.00 173.24 175.25 3fef h VAL 251 N 2.10 0.00 0.00 5.02 -1.51 -1.89 -1.03 116.25 118.94 3fef h VAL 251 Ca -0.26 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.10 3fef h VAL 251 Cb 1.26 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 3fef h VAL 251 CO 0.32 0.00 -0.26 0.49 -1.23 0.00 0.00 177.57 176.88 3fef n PHE 252 N -2.38 0.20 -2.66 5.19 3.72 -1.26 -4.39 117.46 115.89 3fef n PHE 252 Ca -0.00 0.06 -0.27 0.00 -0.05 0.00 0.00 57.45 57.19 3fef n PHE 252 Cb 0.12 -0.50 0.00 0.00 -0.94 0.00 0.00 39.48 38.17 3fef n PHE 252 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fef s SER 254 N -4.13 -0.15 -0.13 0.00 1.04 -1.26 -4.31 113.70 104.75 3fef s SER 254 Ca 0.48 -0.80 0.15 0.00 0.48 0.00 0.00 55.95 56.26 3fef s SER 254 Cb -0.10 0.75 0.42 0.00 0.10 0.00 0.00 66.02 67.19 3fef s SER 254 CO 0.44 -1.43 1.32 0.00 0.98 0.00 0.00 173.24 174.55 3fef n ALA 255 N -0.48 2.66 -1.67 5.32 0.00 -0.87 -4.57 120.51 120.90 3fef n ALA 255 Ca -0.05 -2.09 -0.21 0.00 0.00 0.00 0.00 53.44 51.10 3fef n ALA 255 Cb 0.59 -0.56 -0.08 0.00 0.00 0.00 0.00 19.45 19.40 3fef n ALA 255 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3fef n HIS 256 N -0.50 -0.09 -0.18 0.00 -0.00 -1.26 0.25 115.22 113.44 3fef n HIS 256 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.88 3fef n HIS 256 Cb 0.73 -3.49 0.21 0.00 -0.00 0.00 0.00 29.99 27.43 3fef n HIS 256 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3fef h ARG 257 N 0.00 0.93 -0.28 -0.41 3.08 -1.90 -1.10 114.38 114.70 3fef h ARG 257 Ca -0.43 -0.12 -0.12 0.00 0.07 0.00 0.00 59.98 59.37 3fef h ARG 257 Cb 1.35 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.22 3fef h ARG 257 CO 0.62 0.72 -0.31 0.28 -1.07 0.00 0.00 179.97 180.21 3fef h VAL 258 N 0.93 1.30 -0.34 2.04 2.07 -1.89 -1.14 116.25 119.22 3fef h VAL 258 Ca 0.23 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 3fef h VAL 258 Cb 0.10 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3fef h VAL 258 CO -0.03 0.48 0.19 0.00 0.02 0.00 0.00 177.57 178.22 3fef h ALA 259 N 0.69 0.43 -0.51 1.67 0.00 -1.90 -0.67 119.26 118.97 3fef h ALA 259 Ca 0.04 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3fef h ALA 259 Cb 0.89 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3fef h ALA 259 CO 0.08 -0.05 0.33 0.74 0.00 0.00 0.00 179.25 180.35 3fef h PHE 260 N 0.42 0.63 -0.29 0.00 0.04 -1.11 0.36 116.94 117.00 3fef h PHE 260 Ca 0.12 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.92 3fef h PHE 260 Cb 0.05 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 3fef h PHE 260 CO -0.03 0.39 0.16 0.22 -0.60 0.00 0.00 178.31 178.45 3fef h ASP 261 N 0.68 0.25 -0.65 2.17 3.58 -1.00 -2.13 116.42 119.33 3fef h ASP 261 Ca 0.19 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.60 3fef h ASP 261 Cb -0.07 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 3fef h ASP 261 CO -0.05 0.19 0.25 -0.07 -2.88 0.00 0.00 179.24 176.68 3fef h LEU 262 N 0.33 0.92 -0.58 2.28 3.38 -0.83 -2.59 115.31 118.23 3fef h LEU 262 Ca 0.12 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3fef h LEU 262 Cb 0.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 3fef h LEU 262 CO -0.07 0.84 0.36 0.15 0.09 0.00 0.00 178.44 179.81 3fef h PHE 263 N 0.98 0.75 -0.72 1.13 3.57 -0.71 -0.46 116.94 121.47 3fef h PHE 263 Ca 0.22 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.78 3fef h PHE 263 Cb 0.22 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 3fef h PHE 263 CO 0.02 0.50 0.42 0.93 -2.23 0.00 0.00 178.31 177.95 3fef h GLU 264 N 0.78 0.76 -0.24 1.11 4.39 -1.15 0.14 114.58 120.36 3fef h GLU 264 Ca 0.21 -0.05 -0.17 0.00 0.34 0.00 0.00 59.36 59.70 3fef h GLU 264 Cb -0.04 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.44 3fef h GLU 264 CO -0.04 0.50 -0.49 1.15 -1.16 0.00 0.00 179.01 178.97 3fef h THR 265 N 0.78 1.30 0.00 1.13 2.02 -1.11 -3.39 112.91 113.63 3fef h THR 265 Ca 0.31 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.80 3fef h THR 265 Cb 0.16 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 3fef h THR 265 CO -0.17 0.54 -1.34 -1.22 0.37 0.00 0.00 175.52 173.71 3fef n TYR 266 N -4.11 0.00 -0.92 3.16 4.01 -0.21 -5.02 117.16 114.07 3fef n TYR 266 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 3fef n TYR 266 Cb 0.59 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 3fef n TYR 266 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fef n GLY 267 N 1.95 0.72 3.47 2.72 0.00 0.46 -4.82 105.19 109.70 3fef n GLY 267 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 3fef n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fef s ALA 268 N -2.79 2.70 -0.31 4.61 0.00 -1.26 -4.99 121.76 119.72 3fef s ALA 268 Ca 0.00 -1.71 -0.24 0.00 0.00 0.00 0.00 51.96 50.01 3fef s ALA 268 Cb 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3fef s ALA 268 CO 0.00 0.37 0.80 0.42 0.00 0.00 0.00 175.76 177.35 3fef s ILE 269 N -2.03 4.78 0.24 0.00 1.01 -0.27 -4.27 121.20 120.67 3fef s ILE 269 Ca 0.25 1.17 -0.31 0.00 0.00 0.00 0.00 60.65 61.76 3fef s ILE 269 Cb -0.07 -4.16 -0.11 0.00 0.01 0.00 0.00 42.46 38.13 3fef s ILE 269 CO 0.13 -0.28 1.65 -2.84 0.00 0.00 0.00 174.94 173.60 3fef s PRO 270 N 2.99 4.13 -0.39 2.79 0.02 -1.26 -0.32 135.00 142.96 3fef s PRO 270 Ca 0.33 2.57 0.07 0.00 0.02 0.00 0.00 61.00 63.99 3fef s PRO 270 Cb -0.14 -3.06 0.43 0.00 0.02 0.00 0.00 34.50 31.76 3fef s PRO 270 CO 0.13 -0.68 1.12 0.00 -0.33 0.00 0.00 177.00 177.23 3fef n ALA 271 N 3.17 4.87 -3.16 -1.55 0.00 0.73 -4.87 120.51 119.69 3fef n ALA 271 Ca 0.12 -4.08 -0.09 0.00 0.00 0.00 0.00 53.44 49.39 3fef n ALA 271 Cb 0.36 -0.53 -0.05 0.00 0.00 0.00 0.00 19.45 19.24 3fef n ALA 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fef s ALA 272 N -3.53 -0.62 0.64 0.00 0.00 -1.26 -3.70 121.76 113.30 3fef s ALA 272 Ca 0.46 -0.48 -0.18 0.00 0.00 0.00 0.00 51.96 51.77 3fef s ALA 272 Cb 0.40 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 24.39 3fef s ALA 272 CO -0.12 -0.78 1.29 0.20 0.00 0.00 0.00 175.76 176.35 3fef s GLY 273 N -2.92 2.85 0.33 0.00 0.00 -1.26 -4.72 107.32 101.60 3fef s GLY 273 Ca 0.13 1.19 0.11 0.00 0.00 0.00 0.00 44.72 46.15 3fef s GLY 273 CO -0.00 1.62 1.65 -0.55 0.00 0.00 0.00 173.10 175.82 3fef h ASP 274 N 0.60 0.34 0.03 1.64 5.19 -1.96 -0.65 116.42 121.60 3fef h ASP 274 Ca -0.51 0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.08 3fef h ASP 274 Cb 1.33 0.19 -0.00 0.00 0.18 0.00 0.00 39.33 41.03 3fef h ASP 274 CO 0.53 -0.16 -0.05 0.08 -3.12 0.00 0.00 179.24 176.52 3fef h ARG 275 N 0.28 0.07 0.00 3.56 0.11 -1.90 -1.66 114.38 114.84 3fef h ARG 275 Ca 0.68 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.72 3fef h ARG 275 Cb 1.52 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 32.58 3fef h ARG 275 CO -0.63 0.13 -0.20 0.45 0.10 0.00 0.00 179.97 179.81 3fef h HIS 276 N 0.07 0.00 -1.00 4.08 3.86 -1.48 -3.37 115.15 117.31 3fef h HIS 276 Ca 0.02 0.00 0.18 0.00 -1.16 0.00 0.00 60.37 59.41 3fef h HIS 276 Cb 0.14 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.51 3fef h HIS 276 CO 0.00 1.03 0.60 -0.07 0.86 0.00 0.00 177.93 180.35 3fef h LEU 277 N -1.00 0.79 -2.34 2.43 3.38 -1.23 -2.07 115.31 115.28 3fef h LEU 277 Ca -0.05 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3fef h LEU 277 Cb 1.00 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3fef h LEU 277 CO -0.03 0.30 -0.04 0.00 0.09 0.00 0.00 178.44 178.75 3fef h ALA 278 N 1.63 1.25 0.00 1.53 0.00 -1.47 -2.36 119.26 119.85 3fef h ALA 278 Ca 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.44 3fef h ALA 278 Cb 0.84 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3fef h ALA 278 CO -0.37 0.05 -0.13 0.39 0.00 0.00 0.00 179.25 179.19 3fef n GLU 279 N -3.50 0.14 0.07 0.00 1.02 -0.78 -4.11 120.64 113.49 3fef n GLU 279 Ca -0.02 0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.33 3fef n GLU 279 Cb 0.15 -1.64 0.11 0.00 -0.02 0.00 0.00 31.44 30.04 3fef n GLU 279 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 3fef h PHE 280 N 0.00 0.00 -3.45 -0.32 0.04 -1.57 -3.41 116.94 108.22 3fef h PHE 280 Ca 0.00 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 3fef h PHE 280 Cb 0.62 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 38.64 3fef h PHE 280 CO 0.00 0.00 -0.15 -0.48 -0.60 0.00 0.00 178.31 177.08 3fef s LEU 281 N -4.57 0.66 0.39 1.54 0.05 -1.26 -4.85 118.68 110.64 3fef s LEU 281 Ca 0.04 -0.36 -0.26 0.00 0.05 0.00 0.00 54.13 53.59 3fef s LEU 281 Cb 0.12 1.62 -0.11 0.00 -2.05 0.00 0.00 46.19 45.77 3fef s LEU 281 CO 0.75 -0.80 1.27 -2.65 -0.55 0.00 0.00 176.35 174.37 3fef n PRO 282 N -0.09 1.99 0.00 1.48 -0.02 -1.26 -4.97 135.00 132.13 3fef n PRO 282 Ca -0.16 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3fef n PRO 282 Cb 0.63 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 3fef n PRO 282 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fef n GLY 283 N 0.81 0.83 0.00 -1.23 0.00 -1.26 -4.96 105.19 99.38 3fef n GLY 283 Ca 0.06 -0.98 0.08 0.00 0.00 0.00 0.00 46.02 45.18 3fef n GLY 283 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fef n PRO 284 N -0.45 0.87 0.06 1.61 -0.04 -1.26 -4.47 135.00 131.31 3fef n PRO 284 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 3fef n PRO 284 Cb 0.00 -1.27 -0.08 0.00 -0.04 0.00 0.00 33.50 32.11 3fef n PRO 284 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3fef h TYR 285 N 0.00 -0.08 0.00 0.54 0.05 -1.92 -2.71 116.97 112.85 3fef h TYR 285 Ca 0.00 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 3fef h TYR 285 Cb 0.00 0.03 -0.00 0.00 1.01 0.00 0.00 36.73 37.76 3fef h TYR 285 CO 0.00 0.06 -0.05 -0.07 -1.05 0.00 0.00 178.16 177.05 3fef h LEU 286 N -0.20 0.00 -0.73 3.88 3.38 -1.87 -2.68 115.31 117.08 3fef h LEU 286 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3fef h LEU 286 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3fef h LEU 286 CO 0.01 0.05 -0.57 0.29 0.09 0.00 0.00 178.44 178.32 3fef n LYS 287 N -3.14 1.11 -3.06 1.13 5.02 -1.20 -4.47 118.16 113.54 3fef n LYS 287 Ca 0.01 -0.72 -0.17 0.00 -2.02 0.00 0.00 58.31 55.41 3fef n LYS 287 Cb 0.39 -1.43 -0.02 0.00 -0.02 0.00 0.00 35.03 33.95 3fef n LYS 287 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3fef n GLN 288 N -0.40 1.18 -0.10 1.97 6.02 -1.03 -4.97 117.38 120.05 3fef n GLN 288 Ca 0.07 -3.46 -0.01 0.00 -0.01 0.00 0.00 57.00 53.59 3fef n GLN 288 Cb 0.41 -1.66 0.25 0.00 1.02 0.00 0.00 30.24 30.26 3fef n GLN 288 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3fef h PRO 289 N 2.99 0.75 -0.35 -1.09 0.13 -1.71 -1.90 132.00 130.82 3fef h PRO 289 Ca 0.07 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 3fef h PRO 289 Cb 0.98 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 3fef h PRO 289 CO 0.52 0.64 0.23 1.05 -0.23 0.00 0.00 178.00 180.21 3fef h GLU 290 N 0.74 0.47 -0.16 0.86 9.09 -1.89 0.23 114.58 123.91 3fef h GLU 290 Ca 0.18 -0.03 -0.02 0.00 0.05 0.00 0.00 59.36 59.54 3fef h GLU 290 Cb 0.18 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 27.16 3fef h GLU 290 CO -0.01 0.31 0.01 0.28 0.05 0.00 0.00 179.01 179.64 3fef h VAL 291 N 0.48 1.10 -0.13 -1.06 2.07 -1.78 -2.14 116.25 114.80 3fef h VAL 291 Ca 0.13 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3fef h VAL 291 Cb -0.05 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3fef h VAL 291 CO -0.03 0.13 0.00 0.79 0.02 0.00 0.00 177.57 178.48 3fef n TRP 292 N -4.41 0.14 -3.58 1.57 7.02 -0.77 -4.97 117.44 112.44 3fef n TRP 292 Ca -0.01 -0.07 -0.23 0.00 -1.02 0.00 0.00 57.50 56.18 3fef n TRP 292 Cb 0.16 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.13 3fef n TRP 292 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 3fef n LYS 293 N 0.88 -7.38 -3.94 -0.99 5.02 0.73 -4.34 118.16 108.13 3fef n LYS 293 Ca 0.17 0.81 -0.17 0.00 -2.02 0.00 0.00 58.31 57.11 3fef n LYS 293 Cb 0.49 -5.83 -0.06 0.00 -0.02 0.00 0.00 35.03 29.60 3fef n LYS 293 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 3fef n PHE 294 N -4.75 -0.84 -4.31 2.13 -1.74 -0.88 -2.04 117.46 105.03 3fef n PHE 294 Ca -0.07 -2.42 -0.19 0.00 -0.56 0.00 0.00 57.45 54.20 3fef n PHE 294 Cb 0.59 0.31 -0.11 0.00 1.52 0.00 0.00 39.48 41.79 3fef n PHE 294 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 3fef s HIS 295 N -3.19 1.66 0.36 2.97 3.76 -1.26 -4.11 115.29 115.48 3fef s HIS 295 Ca 0.34 -0.54 -0.12 0.00 -0.15 0.00 0.00 55.06 54.59 3fef s HIS 295 Cb 0.01 -0.82 -0.08 0.00 1.11 0.00 0.00 32.58 32.81 3fef s HIS 295 CO 0.24 0.29 0.75 -0.51 -0.85 0.00 0.00 174.74 174.66 3fef s LEU 296 N -2.88 3.95 -0.42 0.89 1.43 -1.26 -4.79 118.68 115.60 3fef s LEU 296 Ca 0.17 1.19 -0.11 0.00 -1.03 0.00 0.00 54.13 54.35 3fef s LEU 296 Cb -0.03 -4.03 0.06 0.00 0.03 0.00 0.00 46.19 42.22 3fef s LEU 296 CO 0.06 -0.30 0.27 -0.89 0.23 0.00 0.00 176.35 175.72 3fef s THR 297 N -2.18 4.55 0.62 5.49 2.01 0.34 -4.95 115.64 121.53 3fef s THR 297 Ca 0.52 -1.16 -0.07 0.00 0.31 0.00 0.00 61.69 61.30 3fef s THR 297 Cb -0.10 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.73 3fef s THR 297 CO 0.25 -0.44 0.95 -2.16 -0.69 0.00 0.00 174.62 172.53 3fef s PRO 298 N 1.51 2.82 0.47 4.92 0.04 -1.26 -4.76 135.00 138.74 3fef s PRO 298 Ca 0.03 0.05 0.25 0.00 0.04 0.00 0.00 61.00 61.37 3fef s PRO 298 Cb -0.22 -2.22 1.08 0.00 0.04 0.00 0.00 34.50 33.19 3fef s PRO 298 CO 0.05 -0.82 1.90 0.82 0.04 0.00 0.00 177.00 178.98 3fef h ILE 299 N -0.31 0.55 -0.76 0.56 1.08 -1.98 -2.52 117.51 114.12 3fef h ILE 299 Ca -0.45 -0.95 -0.03 0.00 -0.39 0.00 0.00 64.86 63.03 3fef h ILE 299 Cb 1.26 1.65 -0.04 0.00 -3.07 0.00 0.00 36.82 36.62 3fef h ILE 299 CO 0.61 0.19 0.36 0.77 -0.69 0.00 0.00 178.15 179.39 3fef h SER 300 N 0.00 1.00 -0.51 1.72 4.64 -1.99 0.30 113.55 118.71 3fef h SER 300 Ca -0.00 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3fef h SER 300 Cb 0.63 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 3fef h SER 300 CO 0.03 0.85 0.30 0.15 -0.87 0.00 0.00 176.83 177.28 3fef h PHE 301 N 1.09 0.69 -0.59 4.77 3.57 -1.84 -0.07 116.94 124.55 3fef h PHE 301 Ca 0.26 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.66 3fef h PHE 301 Cb 0.12 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 3fef h PHE 301 CO 0.01 0.49 -0.02 0.00 -2.23 0.00 0.00 178.31 176.57 3fef h ARG 302 N 0.69 1.05 -0.35 1.11 3.08 -1.27 0.70 114.38 119.39 3fef h ARG 302 Ca 0.18 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 3fef h ARG 302 Cb 0.01 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3fef h ARG 302 CO -0.03 1.04 0.16 0.87 -1.07 0.00 0.00 179.97 180.94 3fef h LYS 303 N 0.96 0.51 -0.42 0.04 1.57 -0.70 0.05 116.57 118.58 3fef h LYS 303 Ca 0.17 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3fef h LYS 303 Cb 0.57 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3fef h LYS 303 CO 0.03 0.47 0.17 0.37 -0.57 0.00 0.00 179.45 179.92 3fef h GLN 304 N 0.43 0.63 -0.57 3.15 4.15 -0.83 -1.91 115.11 120.16 3fef h GLN 304 Ca 0.12 -0.11 -0.09 0.00 0.77 0.00 0.00 58.65 59.34 3fef h GLN 304 Cb 0.13 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 3fef h GLN 304 CO -0.01 0.58 0.01 0.22 -1.93 0.00 0.00 178.83 177.70 3fef h ASP 305 N 0.53 0.95 -0.63 -0.69 3.58 -0.56 -1.54 116.42 118.06 3fef h ASP 305 Ca 0.14 -0.26 0.02 0.00 0.42 0.00 0.00 57.03 57.35 3fef h ASP 305 Cb 0.19 -0.26 -0.04 0.00 1.72 0.00 0.00 39.33 40.95 3fef h ASP 305 CO -0.01 1.01 0.40 -0.09 -2.88 0.00 0.00 179.24 177.67 3fef h ARG 306 N 0.90 0.78 -0.59 0.28 2.43 -0.84 -1.34 114.38 116.01 3fef h ARG 306 Ca 0.17 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.21 3fef h ARG 306 Cb 0.52 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 3fef h ARG 306 CO 0.03 0.52 0.07 0.00 -1.51 0.00 0.00 179.97 179.07 3fef h ALA 307 N 1.26 1.01 0.00 2.80 0.00 -0.60 -0.57 119.26 123.16 3fef h ALA 307 Ca 0.25 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3fef h ALA 307 Cb -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3fef h ALA 307 CO -0.08 0.62 -0.33 1.05 0.00 0.00 0.00 179.25 180.51 3fef h GLU 308 N 0.91 0.00 -0.37 0.00 4.11 -1.12 -1.53 114.58 116.58 3fef h GLU 308 Ca 0.18 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.53 3fef h GLU 308 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3fef h GLU 308 CO 0.01 0.33 -0.09 0.87 0.07 0.00 0.00 179.01 180.21 3fef h LYS 309 N 0.00 0.71 -0.45 1.06 1.57 -0.95 -0.51 116.57 117.99 3fef h LYS 309 Ca -0.00 -0.27 0.05 0.00 -1.87 0.00 0.00 60.65 58.56 3fef h LYS 309 Cb 1.14 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.36 3fef h LYS 309 CO 0.04 0.86 0.17 0.00 -0.57 0.00 0.00 179.45 179.95 3fef h ARG 310 N 0.50 0.34 -0.66 3.15 3.08 -0.98 0.62 114.38 120.43 3fef h ARG 310 Ca 0.09 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3fef h ARG 310 Cb 0.60 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3fef h ARG 310 CO 0.04 0.22 0.36 1.96 -1.07 0.00 0.00 179.97 181.48 3fef h GLN 311 N 0.35 0.92 0.34 0.04 4.20 -1.12 -1.40 115.11 118.44 3fef h GLN 311 Ca 0.21 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 3fef h GLN 311 Cb 0.19 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3fef h GLN 311 CO -0.20 0.70 -0.29 1.49 -0.67 0.00 0.00 178.83 179.86 3fef h GLU 312 N 0.90 -0.62 -0.79 1.46 4.81 -0.45 -1.29 114.58 118.61 3fef h GLU 312 Ca 0.23 0.04 0.16 0.00 -0.13 0.00 0.00 59.36 59.66 3fef h GLU 312 Cb 0.05 0.14 -0.15 0.00 0.63 0.00 0.00 28.75 29.42 3fef h GLU 312 CO -0.04 -0.41 -0.18 1.15 -0.73 0.00 0.00 179.01 178.80 3fef h THR 313 N -0.64 0.22 -0.26 0.32 2.02 -0.70 -0.36 112.91 113.50 3fef h THR 313 Ca -0.02 -0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.05 3fef h THR 313 Cb 0.57 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 3fef h THR 313 CO -0.02 0.00 -0.29 -0.33 0.37 0.00 0.00 175.52 175.25 3fef h GLU 314 N 0.01 0.53 0.18 6.66 4.39 -0.95 -2.25 114.58 123.14 3fef h GLU 314 Ca 0.38 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.85 3fef h GLU 314 Cb 0.60 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 3fef h GLU 314 CO -0.80 0.77 -0.08 -0.09 -1.16 0.00 0.00 179.01 177.64 3fef h ARG 315 N 0.46 -0.23 -0.91 2.33 2.43 -0.31 -1.11 114.38 117.04 3fef h ARG 315 Ca 0.06 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.39 3fef h ARG 315 Cb 0.74 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.27 3fef h ARG 315 CO 0.06 -0.09 0.58 -0.07 -1.51 0.00 0.00 179.97 178.94 3fef h LEU 316 N -0.31 0.69 0.39 3.80 3.38 -0.80 -0.22 115.31 122.23 3fef h LEU 316 Ca -0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3fef h LEU 316 Cb 0.24 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3fef h LEU 316 CO 0.04 0.34 -0.19 0.40 0.09 0.00 0.00 178.44 179.13 3fef h ILE 317 N 0.73 0.25 -0.92 1.22 2.04 -1.29 0.15 117.51 119.68 3fef h ILE 317 Ca 0.46 -0.67 0.26 0.00 1.00 0.00 0.00 64.86 65.92 3fef h ILE 317 Cb 0.71 0.39 -0.16 0.00 -0.74 0.00 0.00 36.82 37.03 3fef h ILE 317 CO -0.22 0.06 0.21 0.58 0.00 0.00 0.00 178.15 178.78 3fef h VAL 318 N -1.06 0.21 -0.11 1.67 2.07 -0.72 0.88 116.25 119.18 3fef h VAL 318 Ca -0.05 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3fef h VAL 318 Cb 0.49 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 3fef h VAL 318 CO 0.09 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.70 3fef n GLN 319 N -5.30 1.59 -3.79 1.57 6.02 -0.14 -4.94 117.38 112.40 3fef n GLN 319 Ca 0.23 -0.89 -0.29 0.00 -0.01 0.00 0.00 57.00 56.05 3fef n GLN 319 Cb 0.76 -1.40 0.02 0.00 1.02 0.00 0.00 30.24 30.64 3fef n GLN 319 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3fef n GLN 320 N 0.10 -4.95 -3.99 -1.09 6.02 0.30 -4.98 117.38 108.79 3fef n GLN 320 Ca 0.17 0.58 -0.23 0.00 -0.01 0.00 0.00 57.00 57.51 3fef n GLN 320 Cb 0.29 -5.43 -0.03 0.00 1.02 0.00 0.00 30.24 26.09 3fef n GLN 320 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3fef s ARG 321 N -6.48 3.33 0.00 -1.09 0.52 0.42 -4.97 118.95 110.67 3fef s ARG 321 Ca 0.61 -0.78 0.00 0.00 -0.52 0.00 0.00 55.73 55.04 3fef s ARG 321 Cb -0.31 -2.84 0.00 0.00 0.52 0.00 0.00 34.95 32.32 3fef s ARG 321 CO 0.75 0.45 0.00 0.41 0.02 0.00 0.00 175.30 176.93 3fef n GLY 322 N -1.12 2.24 3.82 -3.53 0.00 -1.25 -4.60 105.19 100.75 3fef n GLY 322 Ca -0.08 -2.12 -0.30 0.00 0.00 0.00 0.00 46.02 43.52 3fef n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fef s VAL 323 N 1.02 3.11 0.35 1.61 -7.23 -1.26 -4.94 120.40 113.07 3fef s VAL 323 Ca 0.00 0.36 -0.29 0.00 -1.81 0.00 0.00 61.98 60.25 3fef s VAL 323 Cb 0.00 -3.15 -0.11 0.00 0.56 0.00 0.00 36.38 33.68 3fef s VAL 323 CO 0.00 -0.47 1.49 0.00 -0.31 0.00 0.00 175.10 175.81 3fef n ALA 324 N -3.36 2.29 -2.62 1.32 0.00 -1.26 -4.79 120.51 112.08 3fef n ALA 324 Ca 0.07 0.35 -0.43 0.00 0.00 0.00 0.00 53.44 53.43 3fef n ALA 324 Cb 0.56 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.60 3fef n ALA 324 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3fef n GLU 325 N 0.87 3.31 -3.72 0.00 1.02 -1.26 -4.49 120.64 116.37 3fef n GLU 325 Ca 0.03 -3.51 -0.12 0.00 -0.02 0.00 0.00 57.16 53.54 3fef n GLU 325 Cb 0.38 -3.17 -0.11 0.00 -0.02 0.00 0.00 31.44 28.51 3fef n GLU 325 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3fef s LYS 326 N 2.27 0.34 0.30 3.49 2.20 -1.26 -4.97 119.74 122.10 3fef s LYS 326 Ca 0.46 0.62 -0.28 0.00 -0.36 0.00 0.00 55.97 56.40 3fef s LYS 326 Cb 0.03 0.01 -0.13 0.00 -1.51 0.00 0.00 37.83 36.22 3fef s LYS 326 CO 0.02 -0.13 1.14 0.00 -0.36 0.00 0.00 175.35 176.01 3fef n ALA 327 N 3.86 0.35 0.28 3.13 0.00 -1.26 -4.55 120.51 122.32 3fef n ALA 327 Ca -0.21 0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.73 3fef n ALA 327 Cb 0.55 -2.12 0.08 0.00 0.00 0.00 0.00 19.45 17.97 3fef n ALA 327 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3fef h SER 328 N 2.38 0.00 0.00 0.00 4.64 -1.93 -3.48 113.55 115.16 3fef h SER 328 Ca -0.42 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3fef h SER 328 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3fef h SER 328 CO 0.63 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 3fef n GLY 329 N 1.22 0.78 3.93 -0.77 0.00 -1.26 -5.07 105.19 104.03 3fef n GLY 329 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 3fef n GLY 329 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fef s GLU 330 N -0.39 2.45 0.00 1.61 0.41 -1.26 -5.02 118.70 116.50 3fef s GLU 330 Ca 0.00 -0.22 0.07 0.00 -0.41 0.00 0.00 54.97 54.42 3fef s GLU 330 Cb 0.00 -2.23 0.14 0.00 -1.78 0.00 0.00 34.13 30.27 3fef s GLU 330 CO 0.00 -1.03 0.98 0.39 -0.49 0.00 0.00 175.26 175.11 3fef n GLU 331 N -2.77 1.64 0.04 1.61 -0.58 -1.26 -4.76 120.64 114.55 3fef n GLU 331 Ca 0.07 -1.46 -0.11 0.00 -0.42 0.00 0.00 57.16 55.24 3fef n GLU 331 Cb 0.59 -1.17 -0.04 0.00 -0.57 0.00 0.00 31.44 30.26 3fef n GLU 331 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3fef h GLY 332 N 1.42 -0.25 1.26 0.62 0.00 -1.99 0.28 103.07 104.40 3fef h GLY 332 Ca 0.00 0.25 -0.14 0.00 0.00 0.00 0.00 47.33 47.44 3fef h GLY 332 CO 0.00 -0.18 -0.30 -2.08 0.00 0.00 0.00 176.54 173.97 3fef h VAL 333 N -0.31 1.28 -0.75 4.60 2.07 -1.95 -0.83 116.25 120.35 3fef h VAL 333 Ca 0.07 -1.46 0.04 0.00 0.82 0.00 0.00 66.70 66.18 3fef h VAL 333 Cb 0.41 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 3fef h VAL 333 CO -0.22 0.48 0.46 0.78 0.02 0.00 0.00 177.57 179.10 3fef h ASN 334 N 0.71 0.74 -0.29 0.57 2.35 -1.76 0.31 115.58 118.20 3fef h ASN 334 Ca 0.08 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 3fef h ASN 334 Cb 0.85 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 3fef h ASN 334 CO 0.07 0.50 0.03 0.40 -1.65 0.00 0.00 177.43 176.78 3fef h ILE 335 N 0.88 1.24 -0.50 2.81 2.04 -0.13 0.08 117.51 123.93 3fef h ILE 335 Ca 0.32 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.38 3fef h ILE 335 Cb 0.09 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 3fef h ILE 335 CO -0.14 0.27 0.25 0.40 0.00 0.00 0.00 178.15 178.93 3fef h ILE 336 N 0.31 0.95 -0.20 -0.67 2.04 -0.84 0.29 117.51 119.38 3fef h ILE 336 Ca 0.09 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 3fef h ILE 336 Cb 0.37 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3fef h ILE 336 CO 0.01 0.09 0.12 0.00 0.00 0.00 0.00 178.15 178.37 3fef h ALA 337 N 1.28 0.26 -0.29 1.87 0.00 -0.72 -1.69 119.26 119.97 3fef h ALA 337 Ca 0.22 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.15 3fef h ALA 337 Cb 0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3fef h ALA 337 CO -0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 179.25 178.79 3fef h ALA 338 N 1.03 0.20 -0.00 0.00 0.00 -0.39 -0.68 119.26 119.42 3fef h ALA 338 Ca 0.07 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3fef h ALA 338 Cb 0.03 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3fef h ALA 338 CO -0.01 -0.46 0.00 -0.07 0.00 0.00 0.00 179.25 178.71 3fef h LEU 339 N 0.01 0.00 -0.85 0.00 3.38 -0.06 0.40 115.31 118.19 3fef h LEU 339 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3fef h LEU 339 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3fef h LEU 339 CO -0.29 0.00 -0.18 0.18 0.09 0.00 0.00 178.44 178.24 3fef n LEU 340 N -3.73 1.50 0.00 1.67 4.77 -0.53 -0.26 117.00 120.42 3fef n LEU 340 Ca -0.03 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 3fef n LEU 340 Cb 0.08 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3fef n LEU 340 CO 0.26 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3fef n GLY 341 N 1.30 0.83 1.30 -0.72 0.00 0.12 -4.91 105.19 103.11 3fef n GLY 341 Ca 0.14 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.05 3fef n GLY 341 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fef n LEU 342 N 0.00 3.76 0.00 0.99 4.77 -0.38 -4.89 117.00 121.25 3fef n LEU 342 Ca 0.00 -1.87 0.00 0.00 -0.03 0.00 0.00 56.01 54.11 3fef n LEU 342 Cb 0.00 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 3fef n LEU 342 CO 0.00 0.94 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 3fef n GLY 343 N 1.62 2.41 3.76 -0.72 0.00 -1.26 -4.84 105.19 106.16 3fef n GLY 343 Ca 0.23 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 46.06 3fef n GLY 343 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3fef s GLU 344 N -0.66 2.09 -0.20 1.61 -1.05 -1.26 -3.78 118.70 115.45 3fef s GLU 344 Ca 0.00 1.10 -0.18 0.00 -0.15 0.00 0.00 54.97 55.74 3fef s GLU 344 Cb 0.00 -1.88 0.05 0.00 -0.44 0.00 0.00 34.13 31.86 3fef s GLU 344 CO 0.00 -1.74 0.53 -1.17 0.95 0.00 0.00 175.26 173.83 3fef s LEU 345 N -5.97 -0.04 -0.26 1.83 2.96 -0.41 -4.99 118.68 111.80 3fef s LEU 345 Ca 0.61 1.06 -0.02 0.00 -0.22 0.00 0.00 54.13 55.56 3fef s LEU 345 Cb -0.17 1.80 0.03 0.00 0.50 0.00 0.00 46.19 48.34 3fef s LEU 345 CO 0.56 -0.18 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.69 3fef s VAL 346 N 0.36 3.07 0.16 1.68 1.01 -1.26 0.36 120.40 125.78 3fef s VAL 346 Ca -0.01 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 60.89 3fef s VAL 346 Cb -0.04 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 3fef s VAL 346 CO -0.00 0.15 0.27 0.28 0.00 0.00 0.00 175.10 175.79 3fef s THR 347 N 1.35 0.07 0.01 3.92 -1.32 -0.87 -4.92 115.64 113.89 3fef s THR 347 Ca 0.00 -1.41 -0.26 0.00 -1.21 0.00 0.00 61.69 58.81 3fef s THR 347 Cb -0.17 -1.83 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 3fef s THR 347 CO -0.03 -0.32 0.83 0.54 -2.21 0.00 0.00 174.62 173.42 3fef s ASN 348 N -2.97 7.23 0.09 8.08 4.22 -1.26 -0.84 114.94 129.50 3fef s ASN 348 Ca 0.17 1.48 -0.04 0.00 -2.14 0.00 0.00 52.86 52.33 3fef s ASN 348 Cb 0.04 -2.49 -0.03 0.00 1.28 0.00 0.00 41.25 40.04 3fef s ASN 348 CO -0.00 -0.09 0.08 0.68 -2.04 0.00 0.00 177.10 175.72 3fef s VAL 349 N 0.42 0.16 -0.03 3.54 -7.23 0.35 -4.77 120.40 112.83 3fef s VAL 349 Ca 0.43 -1.64 -0.03 0.00 -1.81 0.00 0.00 61.98 58.93 3fef s VAL 349 Cb -0.20 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 3fef s VAL 349 CO 0.24 -0.72 0.16 0.20 -0.31 0.00 0.00 175.10 174.67 3fef s ASN 350 N -2.94 6.25 0.15 4.85 0.01 -0.08 -1.60 114.94 121.58 3fef s ASN 350 Ca 0.12 0.34 -0.28 0.00 -0.71 0.00 0.00 52.86 52.32 3fef s ASN 350 Cb 0.07 -1.95 -0.07 0.00 0.41 0.00 0.00 41.25 39.70 3fef s ASN 350 CO -0.06 0.30 0.89 -2.84 -1.51 0.00 0.00 177.10 173.87 3fef s PRO 352 N -1.70 4.70 -0.10 -0.60 0.02 -1.26 -1.22 135.00 134.83 3fef s PRO 352 Ca 0.24 1.35 -0.30 0.00 0.02 0.00 0.00 61.00 62.31 3fef s PRO 352 Cb -0.12 -3.32 -0.02 0.00 0.02 0.00 0.00 34.50 31.05 3fef s PRO 352 CO 0.15 0.39 1.16 1.21 -0.33 0.00 0.00 177.00 179.58 3fef s ASN 353 N -0.61 7.07 -0.15 2.53 2.47 0.22 -4.77 114.94 121.70 3fef s ASN 353 Ca 0.42 1.71 0.14 0.00 0.42 0.00 0.00 52.86 55.55 3fef s ASN 353 Cb -0.24 -2.55 0.40 0.00 -1.45 0.00 0.00 41.25 37.41 3fef s ASN 353 CO 0.29 -0.60 1.20 0.00 -3.72 0.00 0.00 177.10 174.27 3fef n GLN 354 N 5.51 1.19 0.00 0.43 1.13 -1.26 0.60 117.38 124.97 3fef n GLN 354 Ca 0.11 -2.90 0.00 0.00 -1.94 0.00 0.00 57.00 52.27 3fef n GLN 354 Cb 0.46 -1.25 0.00 0.00 0.11 0.00 0.00 30.24 29.57 3fef n GLN 354 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fef n GLY 355 N -0.79 1.33 0.19 1.08 0.00 -1.26 -5.00 105.19 100.74 3fef n GLY 355 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 3fef n GLY 355 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3fef h GLN 356 N 0.00 0.00 -4.68 1.61 -0.00 -1.91 -3.37 115.11 106.76 3fef h GLN 356 Ca 0.00 0.00 -0.59 0.00 -0.00 0.00 0.00 58.65 58.06 3fef h GLN 356 Cb 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 27.48 27.13 3fef h GLN 356 CO 0.00 0.00 -0.83 0.08 -0.00 0.00 0.00 178.83 178.08 3fef s VAL 357 N -3.38 1.50 0.56 1.86 1.01 -1.26 -1.20 120.40 119.48 3fef s VAL 357 Ca 0.05 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 3fef s VAL 357 Cb 0.09 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 3fef s VAL 357 CO 0.53 0.44 1.16 -0.76 0.00 0.00 0.00 175.10 176.46 3fef s LEU 358 N 1.24 3.73 -0.54 3.92 1.43 0.75 -3.94 118.68 125.27 3fef s LEU 358 Ca -0.01 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.34 3fef s LEU 358 Cb -0.14 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.50 3fef s LEU 358 CO -0.06 -1.32 0.00 0.59 0.23 0.00 0.00 176.35 175.79 3fef n ASN 359 N -1.36 -4.82 -4.57 2.29 3.02 -1.26 -4.73 115.26 103.84 3fef n ASN 359 Ca 0.12 0.13 -0.30 0.00 -0.03 0.00 0.00 54.58 54.50 3fef n ASN 359 Cb 0.50 -2.77 -0.10 0.00 -0.61 0.00 0.00 39.78 36.80 3fef n ASN 359 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fef s LEU 360 N -1.17 3.02 0.44 3.41 1.02 -1.25 -4.99 118.68 119.16 3fef s LEU 360 Ca 0.00 -0.35 -0.24 0.00 0.02 0.00 0.00 54.13 53.56 3fef s LEU 360 Cb 0.00 -1.80 -0.10 0.00 0.02 0.00 0.00 46.19 44.31 3fef s LEU 360 CO 0.00 0.20 1.00 -2.65 0.02 0.00 0.00 176.35 174.92 3fef n PRO 361 N 0.93 1.31 -2.65 1.29 -0.02 -1.26 -4.94 135.00 129.66 3fef n PRO 361 Ca -0.14 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 3fef n PRO 361 Cb 0.52 -2.05 -0.05 0.00 -0.02 0.00 0.00 33.50 31.90 3fef n PRO 361 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3fef s ILE 362 N -1.30 4.01 0.00 4.25 -4.36 -1.26 -3.16 121.20 119.38 3fef s ILE 362 Ca 0.64 1.26 0.00 0.00 -0.26 0.00 0.00 60.65 62.29 3fef s ILE 362 Cb -0.54 -3.51 0.00 0.00 1.25 0.00 0.00 42.46 39.66 3fef s ILE 362 CO 0.56 -0.27 0.00 0.00 0.24 0.00 0.00 174.94 175.47 3fef n GLN 363 N -0.84 0.00 -2.01 0.37 1.13 0.20 -4.85 117.38 111.37 3fef n GLN 363 Ca 0.08 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.76 3fef n GLN 363 Cb 0.53 -0.68 0.01 0.00 0.11 0.00 0.00 30.24 30.21 3fef n GLN 363 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fef s ALA 364 N -1.07 3.03 -0.37 -1.58 0.00 -1.19 -4.12 121.76 116.47 3fef s ALA 364 Ca 0.00 1.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.86 3fef s ALA 364 Cb 0.00 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.64 3fef s ALA 364 CO 0.00 -0.97 1.36 0.42 0.00 0.00 0.00 175.76 176.57 3fef s ILE 365 N -1.36 4.00 0.16 0.00 -1.09 -1.26 0.71 121.20 122.37 3fef s ILE 365 Ca 0.64 1.07 0.11 0.00 -2.23 0.00 0.00 60.65 60.24 3fef s ILE 365 Cb -0.36 -4.19 -0.04 0.00 -1.58 0.00 0.00 42.46 36.28 3fef s ILE 365 CO 0.45 -0.65 -0.24 0.68 -1.23 0.00 0.00 174.94 173.94 3fef s VAL 366 N 4.98 2.23 -0.24 2.92 -7.23 -1.26 -4.72 120.40 117.07 3fef s VAL 366 Ca 0.59 -1.90 -0.10 0.00 -1.81 0.00 0.00 61.98 58.77 3fef s VAL 366 Cb -0.15 -2.02 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 3fef s VAL 366 CO 0.29 -0.06 0.14 -0.70 -0.31 0.00 0.00 175.10 174.46 3fef s GLU 367 N -2.42 3.96 0.30 4.82 2.12 0.29 -4.20 118.70 123.56 3fef s GLU 367 Ca 0.17 -0.33 -0.07 0.00 0.36 0.00 0.00 54.97 55.10 3fef s GLU 367 Cb -0.09 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.81 3fef s GLU 367 CO 0.08 -0.01 0.47 0.95 -0.54 0.00 0.00 175.26 176.21 3fef s THR 368 N 1.23 0.00 0.58 -1.70 -4.23 -0.63 -2.43 115.64 108.46 3fef s THR 368 Ca 0.07 -1.52 -0.20 0.00 -1.18 0.00 0.00 61.69 58.86 3fef s THR 368 Cb -0.14 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 3fef s THR 368 CO 0.05 0.00 1.26 0.20 -0.54 0.00 0.00 174.62 175.59 3fef s ASN 369 N -3.14 5.16 0.04 3.99 0.01 -1.25 -0.50 114.94 119.25 3fef s ASN 369 Ca 0.27 2.52 -0.04 0.00 -0.71 0.00 0.00 52.86 54.90 3fef s ASN 369 Cb -0.00 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 3fef s ASN 369 CO 0.15 -1.62 0.06 0.00 -1.51 0.00 0.00 177.10 174.17 3fef s ALA 370 N -1.48 0.07 -0.19 0.60 0.00 -0.02 -1.59 121.76 119.16 3fef s ALA 370 Ca 0.76 -0.70 -0.17 0.00 0.00 0.00 0.00 51.96 51.86 3fef s ALA 370 Cb -0.34 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 3fef s ALA 370 CO 0.38 -0.31 0.43 0.12 0.00 0.00 0.00 175.76 176.38 3fef s PHE 371 N -2.77 3.39 -0.15 0.00 5.36 0.12 -2.05 117.98 121.88 3fef s PHE 371 Ca -0.04 0.68 0.02 0.00 -0.96 0.00 0.00 56.93 56.64 3fef s PHE 371 Cb -0.00 -2.56 0.01 0.00 -0.34 0.00 0.00 43.02 40.13 3fef s PHE 371 CO -0.05 -0.00 -0.21 0.42 -1.46 0.00 0.00 175.22 173.92 3fef s ILE 372 N 1.28 1.99 0.00 3.12 1.01 0.16 -0.82 121.20 127.94 3fef s ILE 372 Ca 0.21 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.93 3fef s ILE 372 Cb -0.15 -1.78 0.00 0.00 0.01 0.00 0.00 42.46 40.54 3fef s ILE 372 CO 0.08 0.53 0.00 1.07 0.00 0.00 0.00 174.94 176.63 3fef n THR 373 N 4.27 0.00 -1.66 2.92 5.66 -0.53 -1.29 114.28 123.65 3fef n THR 373 Ca -0.20 0.00 -0.52 0.00 -3.05 0.00 0.00 64.05 60.28 3fef n THR 373 Cb 0.51 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.23 3fef n THR 373 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3fef n ARG 374 N 0.00 1.70 -1.96 1.09 0.63 -1.17 -0.99 116.66 115.95 3fef n ARG 374 Ca 0.00 0.60 -0.17 0.00 -0.92 0.00 0.00 57.85 57.36 3fef n ARG 374 Cb 0.00 -2.46 -0.04 0.00 0.45 0.00 0.00 32.46 30.41 3fef n ARG 374 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 3fef n ASN 375 N 6.84 -4.72 -3.70 6.15 5.15 0.63 -4.94 115.26 120.67 3fef n ASN 375 Ca 0.27 0.25 -0.18 0.00 -0.60 0.00 0.00 54.58 54.31 3fef n ASN 375 Cb 0.24 -4.11 -0.17 0.00 -0.53 0.00 0.00 39.78 35.21 3fef n ASN 375 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3fef s ARG 376 N -4.25 -0.05 -0.21 1.20 0.52 -0.16 -5.11 118.95 110.90 3fef s ARG 376 Ca 0.00 0.37 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 3fef s ARG 376 Cb 0.00 -0.40 0.02 0.00 0.52 0.00 0.00 34.95 35.09 3fef s ARG 376 CO 0.00 -0.28 -0.14 0.08 0.02 0.00 0.00 175.30 174.97 3fef s VAL 377 N 1.90 2.38 -0.26 3.52 1.01 -1.26 -1.45 120.40 126.24 3fef s VAL 377 Ca 0.01 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 60.99 3fef s VAL 377 Cb -0.12 -2.11 0.08 0.00 0.00 0.00 0.00 36.38 34.23 3fef s VAL 377 CO -0.04 0.39 0.03 -1.10 0.00 0.00 0.00 175.10 174.38 3fef s GLN 378 N 1.29 1.03 0.66 2.72 -0.21 -0.00 -4.96 119.66 120.20 3fef s GLN 378 Ca 0.02 -0.96 -0.17 0.00 0.02 0.00 0.00 55.36 54.27 3fef s GLN 378 Cb -0.15 -2.30 -0.01 0.00 1.00 0.00 0.00 33.01 31.55 3fef s GLN 378 CO -0.09 -0.78 1.15 -2.30 -2.12 0.00 0.00 175.29 171.15 3fef n PRO 379 N 4.79 0.90 -4.05 2.91 -0.02 -1.26 -0.71 135.00 137.57 3fef n PRO 379 Ca -0.06 0.36 -0.35 0.00 -2.02 0.00 0.00 63.50 61.44 3fef n PRO 379 Cb 0.44 -2.39 -0.10 0.00 -0.02 0.00 0.00 33.50 31.43 3fef n PRO 379 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3fef s ILE 380 N -1.53 4.74 0.05 4.25 1.01 -0.62 -4.79 121.20 124.30 3fef s ILE 380 Ca 0.79 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 61.09 3fef s ILE 380 Cb -0.38 -3.12 -0.09 0.00 0.01 0.00 0.00 42.46 38.88 3fef s ILE 380 CO 0.44 0.48 1.88 -0.76 0.00 0.00 0.00 174.94 176.98 3fef s LEU 381 N 0.21 4.41 0.00 2.97 1.43 -1.26 -4.72 118.68 121.72 3fef s LEU 381 Ca 0.04 2.63 0.03 0.00 -1.03 0.00 0.00 54.13 55.79 3fef s LEU 381 Cb -0.12 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.57 3fef s LEU 381 CO 0.01 -1.02 0.53 -1.20 0.23 0.00 0.00 176.35 174.89 3fef n SER 382 N 7.01 1.09 0.00 2.29 7.64 -0.34 -5.05 113.62 126.25 3fef n SER 382 Ca 0.19 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 59.03 3fef n SER 382 Cb 0.41 0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 3fef n SER 382 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fef n GLY 383 N 0.27 -0.05 3.54 0.23 0.00 -1.24 -4.95 105.19 103.00 3fef n GLY 383 Ca 0.01 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 3fef n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fef s ALA 384 N -1.49 2.84 0.65 4.61 0.00 -1.26 -0.18 121.76 126.93 3fef s ALA 384 Ca 0.00 -1.33 -0.10 0.00 0.00 0.00 0.00 51.96 50.53 3fef s ALA 384 Cb 0.00 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 3fef s ALA 384 CO 0.00 0.59 1.02 -0.51 0.00 0.00 0.00 175.76 176.87 3fef s LEU 385 N -2.29 3.08 0.62 0.00 1.43 -1.26 -4.99 118.68 115.27 3fef s LEU 385 Ca 0.21 1.09 -0.18 0.00 -1.03 0.00 0.00 54.13 54.21 3fef s LEU 385 Cb -0.10 -3.95 -0.03 0.00 0.03 0.00 0.00 46.19 42.14 3fef s LEU 385 CO 0.12 -1.14 1.16 -2.65 0.23 0.00 0.00 176.35 174.08 3fef n PRO 386 N -2.82 1.06 -0.26 1.29 -0.02 -1.26 -4.72 135.00 128.26 3fef n PRO 386 Ca 0.06 0.41 0.02 0.00 -2.02 0.00 0.00 63.50 61.97 3fef n PRO 386 Cb 0.56 -2.39 0.14 0.00 -0.02 0.00 0.00 33.50 31.80 3fef n PRO 386 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3fef h LYS 387 N 0.57 0.68 -0.49 -0.52 1.63 -1.96 -0.30 116.57 116.18 3fef h LYS 387 Ca -0.50 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.17 3fef h LYS 387 Cb 1.35 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.81 3fef h LYS 387 CO 0.52 0.45 -0.06 0.78 -3.45 0.00 0.00 179.45 177.69 3fef h GLY 388 N 0.70 0.92 1.65 5.01 0.00 -1.95 -2.60 103.07 106.80 3fef h GLY 388 Ca 0.36 -0.68 -0.14 0.00 0.00 0.00 0.00 47.33 46.88 3fef h GLY 388 CO -0.25 0.62 -0.51 -2.08 0.00 0.00 0.00 176.54 174.33 3fef h VAL 389 N 0.78 1.34 0.00 4.60 2.07 -1.73 -2.64 116.25 120.67 3fef h VAL 389 Ca 0.14 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.91 3fef h VAL 389 Cb 0.55 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3fef h VAL 389 CO 0.03 0.53 0.00 1.21 0.02 0.00 0.00 177.57 179.36 3fef n GLU 390 N -3.96 0.31 0.00 1.57 2.13 -0.19 -0.33 120.64 120.17 3fef n GLU 390 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3fef n GLU 390 Cb 0.56 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 31.00 3fef n GLU 390 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3fef n LEU 392 N 0.66 0.00 -0.30 4.31 4.77 -1.00 -0.60 117.00 124.85 3fef n LEU 392 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 3fef n LEU 392 Cb 0.13 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.29 3fef n LEU 392 CO 0.00 0.00 1.10 0.00 -1.33 0.00 0.00 177.39 177.16 3fef h ALA 393 N 0.00 1.04 -0.86 -1.18 0.00 -0.97 -1.46 119.26 115.82 3fef h ALA 393 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3fef h ALA 393 Cb 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 3fef h ALA 393 CO 0.00 0.59 0.44 0.00 0.00 0.00 0.00 179.25 180.28 3fef h ALA 394 N 1.21 1.11 0.07 0.00 0.00 -1.10 0.61 119.26 121.15 3fef h ALA 394 Ca 0.28 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3fef h ALA 394 Cb 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3fef h ALA 394 CO -0.04 0.65 -0.03 -0.09 0.00 0.00 0.00 179.25 179.74 3fef h ARG 395 N 1.22 -0.09 -0.88 0.00 2.43 -1.69 0.30 114.38 115.67 3fef h ARG 395 Ca 0.30 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.48 3fef h ARG 395 Cb 0.08 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 3fef h ARG 395 CO -0.04 0.13 0.58 0.45 -1.51 0.00 0.00 179.97 179.58 3fef h HIS 396 N -0.30 1.11 -0.25 2.20 3.86 -1.12 -2.47 115.15 118.18 3fef h HIS 396 Ca -0.01 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.24 3fef h HIS 396 Cb 0.26 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 3fef h HIS 396 CO -0.00 0.70 0.11 0.82 0.86 0.00 0.00 177.93 180.42 3fef h ILE 397 N 1.20 0.97 -1.00 2.45 2.04 -0.71 0.34 117.51 122.80 3fef h ILE 397 Ca 0.32 -0.08 0.16 0.00 1.00 0.00 0.00 64.86 66.26 3fef h ILE 397 Cb -0.13 0.71 -0.16 0.00 -0.74 0.00 0.00 36.82 36.50 3fef h ILE 397 CO -0.07 0.04 -0.38 -1.20 0.00 0.00 0.00 178.15 176.54 3fef n SER 398 N -5.00 -0.63 -0.18 1.72 7.64 0.08 -0.26 113.62 117.00 3fef n SER 398 Ca -0.02 1.74 -0.10 0.00 1.01 0.00 0.00 58.87 61.50 3fef n SER 398 Cb 0.07 -0.41 0.01 0.00 -1.01 0.00 0.00 64.21 62.87 3fef n SER 398 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 3fef h ASN 399 N 0.00 0.97 -0.47 6.43 2.35 -0.96 -2.23 115.58 121.66 3fef h ASN 399 Ca 0.36 -0.35 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3fef h ASN 399 Cb 0.61 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 3fef h ASN 399 CO -1.00 1.08 0.13 1.56 -1.65 0.00 0.00 177.43 177.56 3fef h GLN 400 N 0.83 0.73 -0.49 0.81 4.20 0.14 -0.44 115.11 120.90 3fef h GLN 400 Ca 0.13 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3fef h GLN 400 Cb 0.64 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 3fef h GLN 400 CO 0.04 0.71 0.28 0.93 -0.67 0.00 0.00 178.83 180.12 3fef h GLU 401 N 0.62 0.67 -0.68 1.46 4.39 -0.57 -1.60 114.58 118.86 3fef h GLU 401 Ca 0.15 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 3fef h GLU 401 Cb 0.30 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 3fef h GLU 401 CO -0.00 0.51 0.36 0.00 -1.16 0.00 0.00 179.01 178.72 3fef h ALA 402 N 1.12 1.35 -0.33 3.43 0.00 -1.20 -0.69 119.26 122.95 3fef h ALA 402 Ca 0.17 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3fef h ALA 402 Cb 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3fef h ALA 402 CO -0.03 0.52 -0.10 0.28 0.00 0.00 0.00 179.25 179.92 3fef h VAL 403 N 0.95 1.28 -0.03 0.00 2.07 -0.77 0.51 116.25 120.26 3fef h VAL 403 Ca 0.24 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.59 3fef h VAL 403 Cb 0.04 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3fef h VAL 403 CO -0.04 0.38 0.02 0.00 0.02 0.00 0.00 177.57 177.95 3fef h ALA 404 N 0.79 0.03 -0.10 1.67 0.00 -1.04 0.76 119.26 121.38 3fef h ALA 404 Ca 0.08 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3fef h ALA 404 Cb 0.61 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3fef h ALA 404 CO 0.04 -0.46 0.05 -0.44 0.00 0.00 0.00 179.25 178.43 3fef h ASP 405 N 0.03 0.07 -0.90 0.00 3.32 -1.03 -2.33 116.42 115.59 3fef h ASP 405 Ca 0.01 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.14 3fef h ASP 405 Cb 0.00 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 3fef h ASP 405 CO -0.00 0.05 0.55 0.00 -1.72 0.00 0.00 179.24 178.13 3fef h ALA 406 N 1.05 1.26 -0.16 3.45 0.00 0.24 -1.70 119.26 123.39 3fef h ALA 406 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3fef h ALA 406 Cb 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3fef h ALA 406 CO -0.03 0.26 -0.34 0.78 0.00 0.00 0.00 179.25 179.93 3fef h GLY 407 N 0.97 0.36 2.00 0.00 0.00 -0.68 0.29 103.07 106.01 3fef h GLY 407 Ca 0.41 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.35 3fef h GLY 407 CO -0.20 0.29 -0.32 1.41 0.00 0.00 0.00 176.54 177.71 3fef h LEU 408 N 0.29 0.00 -1.11 3.11 3.38 -0.77 -3.31 115.31 116.90 3fef h LEU 408 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3fef h LEU 408 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3fef h LEU 408 CO 0.06 0.32 -0.03 0.35 0.09 0.00 0.00 178.44 179.23 3fef n THR 409 N -3.18 0.00 -3.49 0.22 -2.24 -0.83 -5.01 114.28 99.75 3fef n THR 409 Ca 0.03 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 3fef n THR 409 Cb 0.66 1.12 0.06 0.00 -2.10 0.00 0.00 70.33 70.06 3fef n THR 409 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3fef n LYS 410 N 0.19 -3.18 -3.75 -0.78 5.02 0.86 -4.96 118.16 111.56 3fef n LYS 410 Ca 0.03 0.70 -0.36 0.00 -2.02 0.00 0.00 58.31 56.67 3fef n LYS 410 Cb 0.15 -5.25 -0.10 0.00 -0.02 0.00 0.00 35.03 29.81 3fef n LYS 410 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3fef s ASP 411 N -3.77 5.20 0.31 4.39 -1.08 -0.27 -4.94 116.67 116.51 3fef s ASP 411 Ca 0.30 -2.61 0.08 0.00 -0.52 0.00 0.00 52.55 49.80 3fef s ASP 411 Cb -0.07 -1.84 0.50 0.00 -1.46 0.00 0.00 42.92 40.05 3fef s ASP 411 CO 0.79 -0.42 1.72 0.71 0.52 0.00 0.00 175.17 178.49 3fef h THR 412 N 5.62 1.32 -0.46 1.71 1.35 -1.93 -2.62 112.91 117.89 3fef h THR 412 Ca -0.05 -1.54 0.08 0.00 -0.55 0.00 0.00 66.41 64.35 3fef h THR 412 Cb 0.98 1.74 -0.07 0.00 -1.73 0.00 0.00 68.15 69.06 3fef h THR 412 CO 0.71 0.45 0.04 1.23 -0.25 0.00 0.00 175.52 177.70 3fef h GLY 413 N 1.26 0.51 1.09 5.82 0.00 -1.98 0.47 103.07 110.25 3fef h GLY 413 Ca 0.01 0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 3fef h GLY 413 CO 0.06 -0.10 0.12 -2.00 0.00 0.00 0.00 176.54 174.63 3fef h LEU 414 N 0.16 1.06 -1.27 3.11 5.85 -1.87 -2.18 115.31 120.18 3fef h LEU 414 Ca 0.23 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 3fef h LEU 414 Cb 0.33 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3fef h LEU 414 CO -0.35 1.04 0.02 0.00 -0.34 0.00 0.00 178.44 178.81 3fef h ALA 415 N 1.08 1.41 -0.24 1.25 0.00 -1.13 -2.23 119.26 119.40 3fef h ALA 415 Ca 0.21 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3fef h ALA 415 Cb 0.42 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3fef h ALA 415 CO 0.01 0.42 -0.43 0.35 0.00 0.00 0.00 179.25 179.60 3fef h PHE 416 N 0.50 0.71 -0.28 0.00 3.57 -0.57 -0.74 116.94 120.12 3fef h PHE 416 Ca 0.11 -0.21 0.05 0.00 3.53 0.00 0.00 57.97 61.45 3fef h PHE 416 Cb 0.30 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.84 3fef h PHE 416 CO 0.01 0.92 -0.01 1.96 -2.23 0.00 0.00 178.31 178.96 3fef h GLN 417 N 0.48 0.07 -0.42 1.11 1.08 -0.83 0.14 115.11 116.73 3fef h GLN 417 Ca 0.04 -0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.28 3fef h GLN 417 Cb 0.94 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.32 3fef h GLN 417 CO 0.08 0.04 0.18 0.00 -0.95 0.00 0.00 178.83 178.19 3fef h ALA 418 N 1.25 0.52 -0.31 3.87 0.00 -1.20 -0.48 119.26 122.90 3fef h ALA 418 Ca 0.13 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.15 3fef h ALA 418 Cb 0.18 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 3fef h ALA 418 CO -0.24 -0.20 -0.13 0.35 0.00 0.00 0.00 179.25 179.04 3fef h PHE 419 N 0.37 -0.31 0.00 0.00 3.04 -0.56 -0.37 116.94 119.11 3fef h PHE 419 Ca 0.19 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.13 3fef h PHE 419 Cb 0.14 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.83 3fef h PHE 419 CO -0.13 -0.20 -0.21 -0.07 -2.02 0.00 0.00 178.31 175.69 3fef h LEU 420 N -0.08 0.00 -0.28 0.59 3.38 -0.42 -2.54 115.31 115.97 3fef h LEU 420 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3fef h LEU 420 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3fef h LEU 420 CO -0.36 0.21 -0.08 -3.20 0.09 0.00 0.00 178.44 175.10 3fef n ASN 421 N -3.91 0.51 -4.72 -0.43 5.15 -0.21 -4.90 115.26 106.74 3fef n ASN 421 Ca -0.02 -0.73 -0.42 0.00 -0.60 0.00 0.00 54.58 52.81 3fef n ASN 421 Cb 0.30 -0.06 -0.03 0.00 -0.53 0.00 0.00 39.78 39.45 3fef n ASN 421 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3fef s ASP 422 N -2.35 7.19 0.54 1.20 -1.08 -0.83 -4.93 116.67 116.41 3fef s ASP 422 Ca 0.33 1.98 0.27 0.00 -0.52 0.00 0.00 52.55 54.61 3fef s ASP 422 Cb 0.20 -2.59 1.47 0.00 -1.46 0.00 0.00 42.92 40.55 3fef s ASP 422 CO 0.44 -0.35 1.80 -0.65 0.52 0.00 0.00 175.17 176.93 3fef h PRO 423 N 6.23 0.00 0.00 4.34 0.11 -1.89 -0.82 132.00 139.96 3fef h PRO 423 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3fef h PRO 423 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3fef h PRO 423 CO 0.77 0.00 -1.09 1.28 -0.21 0.00 0.00 178.00 178.76 3fef n LEU 424 N -2.63 0.61 -4.44 2.35 4.77 -1.26 -4.67 117.00 111.73 3fef n LEU 424 Ca -0.02 -0.09 -0.44 0.00 -0.03 0.00 0.00 56.01 55.43 3fef n LEU 424 Cb 0.28 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.29 3fef n LEU 424 CO 0.12 0.08 1.22 -0.69 -1.33 0.00 0.00 177.39 176.79 3fef s VAL 425 N -3.19 5.19 -0.73 4.08 1.01 -0.31 -4.85 120.40 121.60 3fef s VAL 425 Ca 0.04 -2.67 0.02 0.00 0.00 0.00 0.00 61.98 59.37 3fef s VAL 425 Cb 0.15 -4.83 0.35 0.00 0.00 0.00 0.00 36.38 32.04 3fef s VAL 425 CO 0.82 -1.52 1.37 0.00 0.00 0.00 0.00 175.10 175.77 3fef n GLN 426 N 5.17 3.92 -4.29 2.72 6.02 -1.26 -4.86 117.38 124.80 3fef n GLN 426 Ca 0.33 -4.61 -0.15 0.00 -0.01 0.00 0.00 57.00 52.55 3fef n GLN 426 Cb 0.43 -2.32 -0.10 0.00 1.02 0.00 0.00 30.24 29.27 3fef n GLN 426 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3fef s ILE 427 N -4.65 0.60 0.77 5.09 -4.36 -1.26 -5.12 121.20 112.26 3fef s ILE 427 Ca 0.46 -1.99 -0.15 0.00 -0.26 0.00 0.00 60.65 58.71 3fef s ILE 427 Cb 0.29 -2.45 0.03 0.00 1.25 0.00 0.00 42.46 41.58 3fef s ILE 427 CO -0.17 -0.17 0.98 0.47 0.24 0.00 0.00 174.94 176.28 3fef n ASP 428 N -0.38 0.38 -0.31 4.36 8.00 -1.26 -4.77 116.55 122.57 3fef n ASP 428 Ca -0.02 0.61 -0.03 0.00 0.71 0.00 0.00 54.79 56.06 3fef n ASP 428 Cb 0.65 -1.42 0.13 0.00 -0.02 0.00 0.00 41.12 40.46 3fef n ASP 428 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3fef h ARG 429 N -0.58 1.19 -0.00 -1.24 2.43 -1.99 -1.85 114.38 112.34 3fef h ARG 429 Ca -0.47 -0.13 -0.17 0.00 -0.81 0.00 0.00 59.98 58.41 3fef h ARG 429 Cb 1.32 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 3fef h ARG 429 CO 0.45 0.86 -0.79 0.66 -1.51 0.00 0.00 179.97 179.64 3fef h SER 430 N 1.21 0.08 -0.26 -3.80 4.64 -2.00 -1.63 113.55 111.79 3fef h SER 430 Ca 0.31 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 3fef h SER 430 Cb -0.00 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 3fef h SER 430 CO -0.05 0.84 0.12 0.44 -0.87 0.00 0.00 176.83 177.31 3fef h ASP 431 N 0.04 0.34 -0.88 4.97 3.32 -1.88 -2.41 116.42 119.91 3fef h ASP 431 Ca -0.02 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 3fef h ASP 431 Cb 1.39 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.81 3fef h ASP 431 CO 0.11 0.37 0.53 0.00 -1.72 0.00 0.00 179.24 178.53 3fef h ALA 432 N 0.98 1.27 -0.56 3.45 0.00 -1.14 0.08 119.26 123.34 3fef h ALA 432 Ca 0.09 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3fef h ALA 432 Cb 0.13 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3fef h ALA 432 CO -0.01 0.62 0.06 1.49 0.00 0.00 0.00 179.25 181.41 3fef h GLU 433 N 1.22 0.95 -0.52 0.00 4.81 -1.25 0.67 114.58 120.45 3fef h GLU 433 Ca 0.32 -0.27 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 3fef h GLU 433 Cb -0.05 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 3fef h GLU 433 CO -0.06 0.93 0.15 0.37 -0.73 0.00 0.00 179.01 179.67 3fef h GLN 434 N 0.84 0.82 -0.01 1.92 5.75 -1.14 -0.96 115.11 122.33 3fef h GLN 434 Ca 0.17 -0.18 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 3fef h GLN 434 Cb 0.46 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.90 3fef h GLN 434 CO 0.02 0.76 0.00 1.25 -2.65 0.00 0.00 178.83 178.21 3fef h LEU 435 N 0.72 0.02 -0.17 -2.39 5.85 -0.60 -0.79 115.31 117.94 3fef h LEU 435 Ca 0.17 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.76 3fef h LEU 435 Cb 0.29 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3fef h LEU 435 CO -0.00 0.17 -0.05 0.15 -0.34 0.00 0.00 178.44 178.37 3fef h PHE 436 N -0.14 -0.10 -0.83 1.25 3.57 0.41 -2.31 116.94 118.79 3fef h PHE 436 Ca 0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 3fef h PHE 436 Cb 0.16 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 3fef h PHE 436 CO -0.02 -0.08 0.40 -0.91 -2.23 0.00 0.00 178.31 175.47 3fef h ASN 437 N -0.01 1.08 0.00 0.41 2.35 -1.11 -1.28 115.58 117.02 3fef h ASN 437 Ca 0.08 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3fef h ASN 437 Cb 0.13 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.23 3fef h ASN 437 CO -0.18 0.91 0.00 0.47 -1.65 0.00 0.00 177.43 176.98 3fef n ASP 438 N -4.33 0.42 0.00 5.81 8.00 -0.31 -5.10 116.55 121.04 3fef n ASP 438 Ca 0.08 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.26 3fef n ASP 438 Cb 0.14 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 3fef n ASP 438 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99