#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlc s GLN 2 N 0.00 1.65 -0.06 2.12 1.11 -1.26 -5.11 119.66 118.10 1rlc s GLN 2 Ca 0.00 -1.54 -0.19 0.00 0.01 0.00 0.00 55.36 53.64 1rlc s GLN 2 Cb 0.00 -1.88 -0.05 0.00 -1.01 0.00 0.00 33.01 30.07 1rlc s GLN 2 CO 0.00 0.39 0.52 0.08 0.01 0.00 0.00 175.29 176.29 1rlc s VAL 3 N -1.87 5.07 -0.15 1.09 1.01 -1.26 -5.04 120.40 119.25 1rlc s VAL 3 Ca 0.24 1.06 -0.29 0.00 0.00 0.00 0.00 61.98 62.98 1rlc s VAL 3 Cb -0.07 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1rlc s VAL 3 CO 0.12 0.38 1.26 0.86 0.00 0.00 0.00 175.10 177.72 1rlc s TRP 4 N 0.17 2.87 0.13 5.22 -0.00 -1.26 -4.96 118.94 121.11 1rlc s TRP 4 Ca 0.28 1.01 -0.34 0.00 -0.00 0.00 0.00 56.10 57.06 1rlc s TRP 4 Cb -0.16 -3.50 -0.13 0.00 -0.00 0.00 0.00 33.47 29.67 1rlc s TRP 4 CO 0.13 -1.70 1.63 -0.35 -0.00 0.00 0.00 176.95 176.66 1rlc n PRO 5 N 6.47 2.21 0.21 5.86 -0.04 -1.26 -4.89 135.00 143.56 1rlc n PRO 5 Ca 0.14 0.80 0.08 0.00 -0.04 0.00 0.00 63.50 64.48 1rlc n PRO 5 Cb 0.45 -2.59 0.42 0.00 -0.04 0.00 0.00 33.50 31.75 1rlc n PRO 5 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1rlc h PRO 6 N 6.45 0.00 -6.20 0.54 0.13 -2.02 -3.44 132.00 127.46 1rlc h PRO 6 Ca -0.45 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 1rlc h PRO 6 Cb 1.25 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.31 1rlc h PRO 6 CO 0.90 0.29 -0.58 0.42 -0.23 0.00 0.00 178.00 178.80 1rlc s ILE 7 N -3.70 4.05 -1.76 -3.56 1.01 -1.26 -4.78 121.20 111.20 1rlc s ILE 7 Ca -0.00 -1.60 0.00 0.00 0.00 0.00 0.00 60.65 59.05 1rlc s ILE 7 Cb 0.11 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.41 1rlc s ILE 7 CO 0.66 -0.35 0.00 0.59 0.00 0.00 0.00 174.94 175.84 1rlc n ASN 8 N -1.03 -5.66 -2.48 3.58 4.13 -1.26 -4.89 115.26 107.65 1rlc n ASN 8 Ca -0.07 0.06 -0.18 0.00 1.68 0.00 0.00 54.58 56.07 1rlc n ASN 8 Cb 0.58 -4.75 0.02 0.00 -1.54 0.00 0.00 39.78 34.09 1rlc n ASN 8 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1rlc n LYS 9 N -2.91 2.62 -2.33 3.52 3.00 -1.26 -5.07 118.16 115.73 1rlc n LYS 9 Ca -0.23 -3.96 -0.42 0.00 -0.00 0.00 0.00 58.31 53.70 1rlc n LYS 9 Cb 0.68 -1.90 -0.03 0.00 0.00 0.00 0.00 35.03 33.78 1rlc n LYS 9 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1rlc s LYS 10 N -3.49 4.41 0.35 1.64 1.02 -1.26 -4.99 119.74 117.43 1rlc s LYS 10 Ca 0.40 1.90 0.07 0.00 0.02 0.00 0.00 55.97 58.36 1rlc s LYS 10 Cb 0.41 -3.29 -0.01 0.00 -0.52 0.00 0.00 37.83 34.42 1rlc s LYS 10 CO -0.06 -0.28 0.44 0.15 -0.92 0.00 0.00 175.35 174.69 1rlc s LYS 11 N 0.78 2.95 -0.34 1.68 -0.14 -1.26 -5.03 119.74 118.38 1rlc s LYS 11 Ca 0.59 -1.14 0.13 0.00 -1.36 0.00 0.00 55.97 54.19 1rlc s LYS 11 Cb -0.33 -2.71 0.46 0.00 -1.68 0.00 0.00 37.83 33.57 1rlc s LYS 11 CO 0.31 -0.00 1.07 0.66 -0.76 0.00 0.00 175.35 176.63 1rlc n TYR 12 N -1.62 2.17 -4.32 3.18 4.02 -1.26 -5.07 117.16 114.26 1rlc n TYR 12 Ca 0.01 -2.67 0.00 0.00 -0.01 0.00 0.00 57.90 55.23 1rlc n TYR 12 Cb 0.59 -0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.66 1rlc n TYR 12 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1rlc n GLU 13 N -0.41 0.00 -1.29 -0.72 -0.58 -1.26 -4.58 120.64 111.80 1rlc n GLU 13 Ca 0.24 0.00 -0.51 0.00 -0.42 0.00 0.00 57.16 56.48 1rlc n GLU 13 Cb 0.79 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.59 1rlc n GLU 13 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1rlc n THR 14 N 0.00 0.00 -0.84 2.62 -1.04 -1.26 -1.31 114.28 112.45 1rlc n THR 14 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1rlc n THR 14 Cb 0.00 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 1rlc n THR 14 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1rlc n LEU 15 N 1.93 0.80 -0.09 -4.42 4.77 -1.26 -4.47 117.00 114.25 1rlc n LEU 15 Ca 0.19 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.25 1rlc n LEU 15 Cb 0.03 -1.73 0.41 0.00 -2.33 0.00 0.00 43.42 39.80 1rlc n LEU 15 CO 0.58 -0.64 0.77 -1.54 -1.33 0.00 0.00 177.39 175.23 1rlc n SER 16 N -0.47 0.28 -0.48 -1.43 3.41 -0.43 -2.25 113.62 112.24 1rlc n SER 16 Ca 0.00 -1.58 0.06 0.00 -0.26 0.00 0.00 58.87 57.09 1rlc n SER 16 Cb 0.24 -0.02 0.05 0.00 -0.26 0.00 0.00 64.21 64.21 1rlc n SER 16 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1rlc n TYR 17 N -0.55 0.00 -2.90 7.33 4.02 -1.26 -4.74 117.16 119.05 1rlc n TYR 17 Ca 0.12 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.78 1rlc n TYR 17 Cb 0.09 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.43 1rlc n TYR 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1rlc s LEU 18 N -1.18 3.58 0.74 7.72 1.43 -0.96 -5.08 118.68 124.93 1rlc s LEU 18 Ca 0.14 0.29 -0.17 0.00 -1.03 0.00 0.00 54.13 53.36 1rlc s LEU 18 Cb 0.11 -3.17 -0.13 0.00 0.03 0.00 0.00 46.19 43.03 1rlc s LEU 18 CO 0.18 -0.77 -0.28 -2.65 0.23 0.00 0.00 176.35 173.06 1rlc n PRO 19 N -2.14 0.04 -2.04 1.29 -0.02 -1.26 -4.89 135.00 125.97 1rlc n PRO 19 Ca 0.02 0.02 -0.42 0.00 -2.02 0.00 0.00 63.50 61.10 1rlc n PRO 19 Cb 0.58 -1.15 -0.03 0.00 -0.02 0.00 0.00 33.50 32.89 1rlc n PRO 19 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rlc s ASP 20 N -1.10 6.69 0.24 2.55 1.01 -1.26 -4.90 116.67 119.90 1rlc s ASP 20 Ca 0.52 2.55 -0.30 0.00 0.71 0.00 0.00 52.55 56.03 1rlc s ASP 20 Cb -0.34 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 40.89 1rlc s ASP 20 CO 0.72 -0.72 1.27 -0.76 0.21 0.00 0.00 175.17 175.89 1rlc s LEU 21 N 0.50 4.44 0.74 1.23 1.43 -1.26 -5.02 118.68 120.74 1rlc s LEU 21 Ca 0.64 2.45 -0.11 0.00 -1.03 0.00 0.00 54.13 56.08 1rlc s LEU 21 Cb -0.41 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.22 1rlc s LEU 21 CO 0.36 -0.47 1.07 -0.94 0.23 0.00 0.00 176.35 176.60 1rlc s SER 22 N -0.06 4.97 0.52 2.29 1.04 -1.26 -4.77 113.70 116.43 1rlc s SER 22 Ca 0.53 1.58 0.29 0.00 0.48 0.00 0.00 55.95 58.83 1rlc s SER 22 Cb -0.37 -2.39 1.39 0.00 0.10 0.00 0.00 66.02 64.76 1rlc s SER 22 CO 0.42 -1.70 2.03 1.56 0.98 0.00 0.00 173.24 176.53 1rlc h GLN 23 N -0.90 0.00 -0.19 4.02 7.50 -1.99 0.26 115.11 123.82 1rlc h GLN 23 Ca -0.45 0.00 -0.17 0.00 0.50 0.00 0.00 58.65 58.53 1rlc h GLN 23 Cb 1.23 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.75 1rlc h GLN 23 CO 0.56 0.12 -0.58 0.93 -1.50 0.00 0.00 178.83 178.37 1rlc h GLU 24 N 0.00 0.60 -0.26 1.46 5.08 -1.98 -0.33 114.58 119.15 1rlc h GLU 24 Ca -0.00 -0.40 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 1rlc h GLU 24 Cb 0.43 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1rlc h GLU 24 CO 0.02 1.01 0.01 1.96 -1.00 0.00 0.00 179.01 181.01 1rlc h GLN 25 N 0.46 0.45 0.05 2.33 4.20 -0.95 -1.29 115.11 120.36 1rlc h GLN 25 Ca 0.00 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.60 1rlc h GLN 25 Cb 1.14 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.82 1rlc h GLN 25 CO 0.11 0.61 -0.42 1.25 -0.67 0.00 0.00 178.83 179.71 1rlc h LEU 26 N 0.24 -1.25 -0.50 1.46 5.85 -0.82 -1.98 115.31 118.31 1rlc h LEU 26 Ca 0.08 0.15 0.10 0.00 0.84 0.00 0.00 57.88 59.04 1rlc h LEU 26 Cb 0.39 0.48 -0.10 0.00 0.37 0.00 0.00 40.66 41.80 1rlc h LEU 26 CO 0.01 -0.47 -0.28 -0.07 -0.34 0.00 0.00 178.44 177.29 1rlc h LEU 27 N -0.60 -0.96 -1.74 2.25 3.38 -1.03 0.19 115.31 116.80 1rlc h LEU 27 Ca 0.04 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1rlc h LEU 27 Cb 0.66 0.49 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1rlc h LEU 27 CO -0.29 -0.28 -0.14 0.28 0.09 0.00 0.00 178.44 178.10 1rlc h SER 28 N -0.16 0.00 -0.18 -0.43 0.02 -0.54 0.30 113.55 112.57 1rlc h SER 28 Ca 0.22 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.06 1rlc h SER 28 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1rlc h SER 28 CO -0.60 0.14 -0.33 -0.33 -1.14 0.00 0.00 176.83 174.58 1rlc h GLU 29 N 0.00 0.54 -0.02 3.45 4.39 -0.49 0.60 114.58 123.05 1rlc h GLU 29 Ca -0.00 -0.34 -0.08 0.00 0.34 0.00 0.00 59.36 59.27 1rlc h GLU 29 Cb 0.26 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1rlc h GLU 29 CO 0.02 0.95 -0.38 0.28 -1.16 0.00 0.00 179.01 178.72 1rlc h VAL 30 N 0.20 1.28 -0.07 3.13 2.07 0.87 -1.35 116.25 122.37 1rlc h VAL 30 Ca 0.01 -1.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 1rlc h VAL 30 Cb 0.92 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1rlc h VAL 30 CO 0.07 0.38 -0.03 -0.33 0.02 0.00 0.00 177.57 177.69 1rlc h GLU 31 N 0.03 0.15 -0.66 1.57 5.08 -0.22 -1.89 114.58 118.64 1rlc h GLU 31 Ca 0.00 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.44 1rlc h GLU 31 Cb 0.68 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.81 1rlc h GLU 31 CO 0.05 0.50 0.04 -0.92 -1.00 0.00 0.00 179.01 177.67 1rlc h TYR 32 N -0.21 0.02 0.07 4.33 3.20 -0.30 0.17 116.97 124.26 1rlc h TYR 32 Ca 0.02 0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.96 1rlc h TYR 32 Cb 0.45 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1rlc h TYR 32 CO 0.06 -0.16 -0.42 1.25 -1.64 0.00 0.00 178.16 177.25 1rlc h LEU 33 N 0.15 -1.26 -0.85 2.82 5.85 -1.14 -0.76 115.31 120.12 1rlc h LEU 33 Ca 0.35 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 59.21 1rlc h LEU 33 Cb 0.59 0.48 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 1rlc h LEU 33 CO -0.55 -0.48 0.50 -0.07 -0.34 0.00 0.00 178.44 177.50 1rlc h LEU 34 N -0.63 1.04 -2.52 2.25 3.38 -0.29 -2.24 115.31 116.30 1rlc h LEU 34 Ca 0.03 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1rlc h LEU 34 Cb 0.67 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1rlc h LEU 34 CO -0.27 0.81 -0.01 0.50 0.09 0.00 0.00 178.44 179.57 1rlc h LYS 35 N 1.17 0.00 -0.00 1.13 3.64 0.68 0.15 116.57 123.34 1rlc h LYS 35 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1rlc h LYS 35 Cb -0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1rlc h LYS 35 CO -0.05 0.01 -0.60 0.09 -2.27 0.00 0.00 179.45 176.62 1rlc n ASN 36 N -3.73 0.94 0.00 4.20 4.13 -0.68 -4.98 115.26 115.14 1rlc n ASN 36 Ca -0.03 -0.75 0.00 0.00 1.68 0.00 0.00 54.58 55.48 1rlc n ASN 36 Cb 0.09 0.48 0.00 0.00 -1.54 0.00 0.00 39.78 38.81 1rlc n ASN 36 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rlc n GLY 37 N 1.46 0.85 3.76 7.41 0.00 0.51 -5.08 105.19 114.11 1rlc n GLY 37 Ca 0.07 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 1rlc n GLY 37 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1rlc s TRP 38 N -2.00 3.61 -0.04 1.61 0.51 -1.05 -4.87 118.94 116.70 1rlc s TRP 38 Ca 0.00 0.97 -0.30 0.00 -2.12 0.00 0.00 56.10 54.65 1rlc s TRP 38 Cb 0.00 -2.48 -0.06 0.00 -0.81 0.00 0.00 33.47 30.13 1rlc s TRP 38 CO 0.00 0.35 1.69 0.08 -0.51 0.00 0.00 176.95 178.56 1rlc s VAL 39 N -0.06 3.52 0.67 4.03 1.01 -0.20 -4.37 120.40 125.00 1rlc s VAL 39 Ca 0.26 0.63 -0.12 0.00 0.00 0.00 0.00 61.98 62.75 1rlc s VAL 39 Cb -0.16 -3.41 -0.00 0.00 0.00 0.00 0.00 36.38 32.81 1rlc s VAL 39 CO 0.12 -0.06 1.06 -2.84 0.00 0.00 0.00 175.10 173.39 1rlc s PRO 40 N 4.08 3.01 -0.03 2.72 0.02 -1.26 -1.12 135.00 142.43 1rlc s PRO 40 Ca 0.75 1.01 -0.29 0.00 0.02 0.00 0.00 61.00 62.49 1rlc s PRO 40 Cb -0.34 -2.00 0.07 0.00 0.02 0.00 0.00 34.50 32.24 1rlc s PRO 40 CO 0.31 -1.04 0.64 0.00 -0.33 0.00 0.00 177.00 176.57 1rlc s LEU 42 N -1.30 3.25 0.04 0.00 1.02 -1.25 -1.62 118.68 118.82 1rlc s LEU 42 Ca -0.11 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 53.87 1rlc s LEU 42 Cb -0.01 -1.94 -0.02 0.00 0.02 0.00 0.00 46.19 44.24 1rlc s LEU 42 CO 0.08 0.23 -0.09 -1.61 0.02 0.00 0.00 176.35 174.98 1rlc s GLU 43 N -1.86 0.59 0.21 1.70 2.02 -0.88 -0.02 118.70 120.46 1rlc s GLU 43 Ca 0.21 -0.72 -0.09 0.00 0.02 0.00 0.00 54.97 54.38 1rlc s GLU 43 Cb -0.11 -0.44 -0.01 0.00 0.10 0.00 0.00 34.13 33.67 1rlc s GLU 43 CO 0.12 0.09 0.34 -0.59 0.02 0.00 0.00 175.26 175.25 1rlc s PHE 44 N -1.18 0.55 -0.28 1.61 -0.71 0.37 -0.81 117.98 117.53 1rlc s PHE 44 Ca -0.07 -0.88 -0.20 0.00 -1.04 0.00 0.00 56.93 54.74 1rlc s PHE 44 Cb -0.09 -0.05 0.08 0.00 -1.21 0.00 0.00 43.02 41.75 1rlc s PHE 44 CO 0.01 -0.83 0.73 -2.00 -1.34 0.00 0.00 175.22 171.79 1rlc s GLU 45 N -4.03 0.74 -0.05 1.99 2.56 0.18 -1.60 118.70 118.48 1rlc s GLU 45 Ca 0.25 1.07 0.14 0.00 0.00 0.00 0.00 54.97 56.43 1rlc s GLU 45 Cb 0.02 0.26 -0.22 0.00 2.00 0.00 0.00 34.13 36.19 1rlc s GLU 45 CO 0.07 -0.12 0.26 0.25 -0.56 0.00 0.00 175.26 175.16 1rlc n THR 46 N 3.48 0.22 0.00 -1.70 -2.24 -1.26 -0.45 114.28 112.34 1rlc n THR 46 Ca -0.17 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1rlc n THR 46 Cb 0.57 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1rlc n THR 46 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1rlc n GLU 47 N -2.14 0.00 -3.19 -0.78 0.28 -1.26 -4.90 120.64 108.65 1rlc n GLU 47 Ca -0.07 0.00 -0.46 0.00 -0.16 0.00 0.00 57.16 56.47 1rlc n GLU 47 Cb 0.52 -0.31 -0.02 0.00 1.43 0.00 0.00 31.44 33.06 1rlc n GLU 47 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1rlc s HIS 48 N -2.00 3.57 -1.61 -1.84 3.76 -1.26 -4.85 115.29 111.06 1rlc s HIS 48 Ca 0.00 -1.82 0.18 0.00 -0.15 0.00 0.00 55.06 53.27 1rlc s HIS 48 Cb 0.00 -3.98 0.94 0.00 1.11 0.00 0.00 32.58 30.65 1rlc s HIS 48 CO 0.00 -1.16 1.51 0.41 -0.85 0.00 0.00 174.74 174.65 1rlc n GLY 49 N 4.43 -0.77 3.21 -2.22 0.00 -1.26 -4.83 105.19 103.75 1rlc n GLY 49 Ca 0.18 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 1rlc n GLY 49 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rlc s PHE 50 N -2.39 -0.12 0.37 1.61 0.08 -1.26 -5.08 117.98 111.19 1rlc s PHE 50 Ca 0.20 0.14 -0.25 0.00 0.12 0.00 0.00 56.93 57.13 1rlc s PHE 50 Cb 0.12 0.06 -0.12 0.00 -0.57 0.00 0.00 43.02 42.51 1rlc s PHE 50 CO 0.25 -0.38 0.94 0.28 -0.10 0.00 0.00 175.22 176.21 1rlc n VAL 51 N 1.22 2.18 -4.11 -0.44 0.31 -1.26 -4.80 118.33 111.42 1rlc n VAL 51 Ca -0.21 -0.50 -0.15 0.00 -0.01 0.00 0.00 64.34 63.47 1rlc n VAL 51 Cb 0.56 -1.01 -0.05 0.00 -0.91 0.00 0.00 33.84 32.43 1rlc n VAL 51 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1rlc s TYR 52 N -1.22 1.11 -0.34 3.52 1.13 -0.81 -5.00 117.35 115.74 1rlc s TYR 52 Ca 0.61 -1.31 0.00 0.00 -1.41 0.00 0.00 57.07 54.97 1rlc s TYR 52 Cb -0.62 -0.18 0.14 0.00 -1.10 0.00 0.00 41.96 40.20 1rlc s TYR 52 CO 0.58 -1.06 0.24 1.03 -2.51 0.00 0.00 175.55 173.84 1rlc s ARG 53 N -3.25 0.49 -0.19 -3.49 0.52 -1.26 0.11 118.95 111.88 1rlc s ARG 53 Ca 0.32 -0.98 -0.06 0.00 -0.52 0.00 0.00 55.73 54.48 1rlc s ARG 53 Cb 0.00 -1.08 -0.21 0.00 0.52 0.00 0.00 34.95 34.18 1rlc s ARG 53 CO 0.20 -1.16 0.09 -1.91 0.02 0.00 0.00 175.30 172.54 1rlc n GLU 54 N 4.40 0.69 -0.00 3.54 2.13 -1.26 -4.75 120.64 125.39 1rlc n GLU 54 Ca 0.08 0.27 0.10 0.00 0.66 0.00 0.00 57.16 58.26 1rlc n GLU 54 Cb 0.41 -1.63 -0.12 0.00 0.27 0.00 0.00 31.44 30.36 1rlc n GLU 54 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1rlc n ASN 55 N -3.60 0.92 -3.57 4.31 4.13 -1.26 -4.96 115.26 111.23 1rlc n ASN 55 Ca -0.39 -0.92 -0.08 0.00 1.68 0.00 0.00 54.58 54.87 1rlc n ASN 55 Cb 0.97 1.06 -0.04 0.00 -1.54 0.00 0.00 39.78 40.24 1rlc n ASN 55 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1rlc s ASN 56 N -3.05 -0.29 -0.09 6.41 3.84 -1.26 -5.06 114.94 115.44 1rlc s ASN 56 Ca 0.07 0.19 0.13 0.00 0.21 0.00 0.00 52.86 53.46 1rlc s ASN 56 Cb 0.15 0.26 0.26 0.00 -0.55 0.00 0.00 41.25 41.38 1rlc s ASN 56 CO 0.85 -0.36 1.13 0.29 -2.79 0.00 0.00 177.10 176.22 1rlc n LYS 57 N 0.32 0.82 -1.76 0.43 5.02 -1.26 -4.80 118.16 116.93 1rlc n LYS 57 Ca -0.07 -2.23 -0.30 0.00 -2.02 0.00 0.00 58.31 53.69 1rlc n LYS 57 Cb 0.59 -1.04 0.08 0.00 -0.02 0.00 0.00 35.03 34.65 1rlc n LYS 57 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1rlc s SER 58 N -2.33 4.65 -0.31 4.39 1.04 -1.26 -4.83 113.70 115.05 1rlc s SER 58 Ca 0.25 1.04 -0.38 0.00 0.48 0.00 0.00 55.95 57.34 1rlc s SER 58 Cb 0.24 -1.70 -0.14 0.00 0.10 0.00 0.00 66.02 64.53 1rlc s SER 58 CO -0.03 -1.84 1.97 -2.65 0.98 0.00 0.00 173.24 171.67 1rlc n PRO 59 N -3.31 1.13 -0.34 4.02 -0.02 -1.26 -2.10 135.00 133.12 1rlc n PRO 59 Ca 0.07 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1rlc n PRO 59 Cb 0.58 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1rlc n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rlc n GLY 60 N 5.46 0.76 3.70 -1.23 0.00 -1.26 -5.01 105.19 107.60 1rlc n GLY 60 Ca 0.34 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 1rlc n GLY 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1rlc s TYR 61 N -2.29 3.35 -0.02 1.61 6.14 -0.89 -5.07 117.35 120.18 1rlc s TYR 61 Ca 0.00 0.23 -0.06 0.00 0.64 0.00 0.00 57.07 57.89 1rlc s TYR 61 Cb 0.00 -2.09 0.00 0.00 0.42 0.00 0.00 41.96 40.30 1rlc s TYR 61 CO 0.00 0.28 0.12 0.71 0.64 0.00 0.00 175.55 177.31 1rlc s TYR 62 N 0.17 -0.01 0.35 4.97 2.02 -1.26 -4.74 117.35 118.84 1rlc s TYR 62 Ca 0.07 0.03 0.03 0.00 -0.37 0.00 0.00 57.07 56.82 1rlc s TYR 62 Cb -0.12 -0.02 -0.02 0.00 -0.40 0.00 0.00 41.96 41.40 1rlc s TYR 62 CO -0.00 -0.19 0.52 -0.51 -1.57 0.00 0.00 175.55 173.79 1rlc s ASP 63 N -0.81 6.11 0.00 2.29 1.01 0.12 -4.51 116.67 120.88 1rlc s ASP 63 Ca -0.09 0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.36 1rlc s ASP 63 Cb -0.05 -1.70 0.00 0.00 1.01 0.00 0.00 42.92 42.18 1rlc s ASP 63 CO 0.01 -0.38 0.00 0.61 0.21 0.00 0.00 175.17 175.62 1rlc n GLY 64 N -1.75 2.16 0.06 0.21 0.00 -1.26 -1.92 105.19 102.69 1rlc n GLY 64 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 1rlc n GLY 64 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1rlc h ARG 65 N 3.02 0.06 -6.86 1.61 3.08 -1.93 -3.43 114.38 109.93 1rlc h ARG 65 Ca 0.00 -0.01 -0.51 0.00 0.07 0.00 0.00 59.98 59.53 1rlc h ARG 65 Cb 0.00 -0.01 0.03 0.00 0.08 0.00 0.00 29.97 30.07 1rlc h ARG 65 CO 0.00 0.18 0.51 0.71 -1.07 0.00 0.00 179.97 180.31 1rlc s TYR 66 N -5.61 3.35 0.47 3.04 2.02 -1.26 -5.06 117.35 114.29 1rlc s TYR 66 Ca -0.14 1.61 0.03 0.00 -0.37 0.00 0.00 57.07 58.20 1rlc s TYR 66 Cb 0.05 -3.39 -0.04 0.00 -0.40 0.00 0.00 41.96 38.19 1rlc s TYR 66 CO 0.67 -0.99 0.01 -1.58 -1.57 0.00 0.00 175.55 172.09 1rlc s TRP 67 N -1.23 2.09 0.06 2.71 0.52 -1.26 -5.11 118.94 116.73 1rlc s TRP 67 Ca 0.48 -0.87 -0.28 0.00 0.02 0.00 0.00 56.10 55.46 1rlc s TRP 67 Cb -0.33 -1.65 -0.05 0.00 -1.15 0.00 0.00 33.47 30.29 1rlc s TRP 67 CO 0.43 0.29 0.87 0.99 0.02 0.00 0.00 176.95 179.55 1rlc s THR 68 N -2.84 4.67 0.10 2.01 2.01 -0.63 -4.86 115.64 116.10 1rlc s THR 68 Ca 0.17 1.86 -0.31 0.00 0.31 0.00 0.00 61.69 63.73 1rlc s THR 68 Cb 0.05 -4.23 -0.07 0.00 0.01 0.00 0.00 72.50 68.26 1rlc s THR 68 CO 0.09 0.31 1.28 -0.32 -0.69 0.00 0.00 174.62 175.29 1rlc s MET 69 N 0.15 4.39 -0.30 4.92 1.75 -1.26 -0.48 119.30 128.47 1rlc s MET 69 Ca 0.44 1.92 -0.12 0.00 -1.25 0.00 0.00 55.69 56.68 1rlc s MET 69 Cb -0.22 -3.29 -0.04 0.00 2.84 0.00 0.00 34.83 34.13 1rlc s MET 69 CO 0.26 -0.31 0.21 -0.46 -0.65 0.00 0.00 175.02 174.06 1rlc s TRP 70 N 0.92 3.22 0.00 4.11 -0.11 0.98 -4.88 118.94 123.18 1rlc s TRP 70 Ca 0.60 -0.01 0.00 0.00 1.22 0.00 0.00 56.10 57.92 1rlc s TRP 70 Cb -0.33 -2.41 0.00 0.00 -1.50 0.00 0.00 33.47 29.23 1rlc s TRP 70 CO 0.31 -0.23 0.00 1.63 -4.62 0.00 0.00 176.95 174.03 1rlc n LYS 71 N 5.07 0.00 -4.42 5.86 5.02 -1.26 -3.97 118.16 124.47 1rlc n LYS 71 Ca -0.14 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.94 1rlc n LYS 71 Cb 0.51 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.43 1rlc n LYS 71 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rlc s LEU 72 N 0.00 1.87 0.19 -0.35 1.43 -1.26 -5.04 118.68 115.51 1rlc s LEU 72 Ca 0.00 -1.55 -0.30 0.00 -1.03 0.00 0.00 54.13 51.24 1rlc s LEU 72 Cb 0.00 -0.02 -0.09 0.00 0.03 0.00 0.00 46.19 46.11 1rlc s LEU 72 CO 0.00 -0.84 1.34 -2.84 0.23 0.00 0.00 176.35 174.24 1rlc s PRO 73 N -3.81 4.36 -1.24 1.29 0.02 -1.26 -4.45 135.00 129.91 1rlc s PRO 73 Ca 0.32 2.09 -0.14 0.00 0.02 0.00 0.00 61.00 63.29 1rlc s PRO 73 Cb 0.05 -3.20 0.15 0.00 0.02 0.00 0.00 34.50 31.52 1rlc s PRO 73 CO 0.16 -0.31 1.56 -1.33 -0.33 0.00 0.00 177.00 176.75 1rlc n MET 74 N 2.88 3.35 -1.81 5.54 2.81 0.16 -4.95 117.12 125.10 1rlc n MET 74 Ca 0.07 -3.68 -0.42 0.00 -1.81 0.00 0.00 57.70 51.87 1rlc n MET 74 Cb 0.42 -3.12 -0.02 0.00 -0.71 0.00 0.00 33.22 29.79 1rlc n MET 74 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1rlc s PHE 75 N 1.98 2.86 -1.36 2.03 0.08 -1.26 -2.74 117.98 119.57 1rlc s PHE 75 Ca 0.45 0.68 -0.05 0.00 0.12 0.00 0.00 56.93 58.12 1rlc s PHE 75 Cb 0.00 -4.04 0.03 0.00 -0.57 0.00 0.00 43.02 38.44 1rlc s PHE 75 CO 0.02 -3.65 0.91 0.41 -0.10 0.00 0.00 175.22 172.81 1rlc n GLY 76 N 2.83 -0.40 3.76 4.36 0.00 -1.26 -4.96 105.19 109.52 1rlc n GLY 76 Ca 0.11 0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 1rlc n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rlc n THR 78 N 1.24 0.36 -4.74 0.00 -2.24 -1.26 -4.98 114.28 102.67 1rlc n THR 78 Ca -0.01 -0.23 -0.26 0.00 -2.27 0.00 0.00 64.05 61.28 1rlc n THR 78 Cb 0.45 -0.85 -0.17 0.00 -2.10 0.00 0.00 70.33 67.67 1rlc n THR 78 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1rlc s ASP 79 N -3.65 2.10 0.64 3.42 -4.77 -1.26 -4.98 116.67 108.18 1rlc s ASP 79 Ca -0.03 -0.36 0.15 0.00 -3.30 0.00 0.00 52.55 49.01 1rlc s ASP 79 Cb 0.02 -0.97 0.69 0.00 -1.09 0.00 0.00 42.92 41.56 1rlc s ASP 79 CO 0.22 0.06 1.35 0.00 0.70 0.00 0.00 175.17 177.50 1rlc h ALA 80 N 6.92 2.07 -0.43 2.11 0.00 -1.93 0.39 119.26 128.37 1rlc h ALA 80 Ca -0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1rlc h ALA 80 Cb 1.20 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1rlc h ALA 80 CO 0.47 -0.98 0.19 1.15 0.00 0.00 0.00 179.25 180.09 1rlc h THR 81 N 0.00 1.16 -0.09 0.00 2.02 -1.96 -1.83 112.91 112.21 1rlc h THR 81 Ca 0.12 -0.46 0.02 0.00 0.77 0.00 0.00 66.41 66.86 1rlc h THR 81 Cb 1.82 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.82 1rlc h THR 81 CO -0.00 0.18 -0.06 1.56 0.37 0.00 0.00 175.52 177.58 1rlc h GLN 82 N 0.61 -0.06 0.12 6.66 4.20 -0.64 0.65 115.11 126.65 1rlc h GLN 82 Ca 0.15 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.88 1rlc h GLN 82 Cb 0.09 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1rlc h GLN 82 CO -0.02 -0.04 -0.19 0.28 -0.67 0.00 0.00 178.83 178.19 1rlc h VAL 83 N -0.06 0.57 -0.56 -0.54 2.07 -1.58 -2.56 116.25 113.59 1rlc h VAL 83 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1rlc h VAL 83 Cb 0.14 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1rlc h VAL 83 CO -0.13 0.00 0.37 0.25 0.02 0.00 0.00 177.57 178.08 1rlc h LEU 84 N -0.37 0.53 -0.69 2.57 5.85 -0.99 -0.25 115.31 121.96 1rlc h LEU 84 Ca 0.02 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1rlc h LEU 84 Cb 0.38 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1rlc h LEU 84 CO -0.10 0.36 0.43 0.00 -0.34 0.00 0.00 178.44 178.79 1rlc h ALA 85 N 1.68 0.91 -0.78 1.25 0.00 -0.55 -1.95 119.26 119.82 1rlc h ALA 85 Ca 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1rlc h ALA 85 Cb 0.16 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1rlc h ALA 85 CO -0.06 0.20 0.44 0.93 0.00 0.00 0.00 179.25 180.75 1rlc h GLU 86 N 0.84 1.08 -0.34 0.00 4.39 -0.66 0.17 114.58 120.06 1rlc h GLU 86 Ca 0.28 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.81 1rlc h GLU 86 Cb 0.03 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 1rlc h GLU 86 CO -0.11 0.79 -0.03 0.28 -1.16 0.00 0.00 179.01 178.77 1rlc h VAL 87 N 1.08 1.21 -0.13 3.13 2.07 -0.85 -0.55 116.25 122.20 1rlc h VAL 87 Ca 0.28 -0.85 -0.15 0.00 0.82 0.00 0.00 66.70 66.80 1rlc h VAL 87 Cb 0.01 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1rlc h VAL 87 CO -0.05 0.29 -0.55 -0.08 0.02 0.00 0.00 177.57 177.21 1rlc h GLU 88 N 0.51 0.40 0.03 1.57 4.57 -0.97 -1.26 114.58 119.43 1rlc h GLU 88 Ca 0.11 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1rlc h GLU 88 Cb 0.38 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 1rlc h GLU 88 CO 0.02 0.84 -0.02 0.93 -1.18 0.00 0.00 179.01 179.59 1rlc h GLU 89 N 0.31 -0.05 -0.98 1.92 5.08 0.59 -2.95 114.58 118.51 1rlc h GLU 89 Ca 0.01 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.66 1rlc h GLU 89 Cb 1.05 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 30.17 1rlc h GLU 89 CO 0.09 -0.03 0.51 0.00 -1.00 0.00 0.00 179.01 178.58 1rlc h ALA 90 N -1.80 1.78 -0.54 3.43 0.00 -1.11 -0.08 119.26 120.94 1rlc h ALA 90 Ca -0.00 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1rlc h ALA 90 Cb 0.04 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1rlc h ALA 90 CO 0.00 -0.48 0.29 0.87 0.00 0.00 0.00 179.25 179.93 1rlc h LYS 91 N 0.36 0.76 0.00 0.00 1.57 -1.26 0.83 116.57 118.83 1rlc h LYS 91 Ca 0.68 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 59.26 1rlc h LYS 91 Cb 1.46 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 1rlc h LYS 91 CO -0.58 0.60 -0.50 1.57 -0.57 0.00 0.00 179.45 179.96 1rlc h LYS 92 N 0.73 0.00 -0.06 3.15 5.09 -0.89 -2.58 116.57 122.00 1rlc h LYS 92 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 60.65 60.72 1rlc h LYS 92 Cb 0.06 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.39 1rlc h LYS 92 CO -0.03 0.50 -0.82 0.00 -2.09 0.00 0.00 179.45 177.01 1rlc h ALA 93 N 1.50 0.46 -2.32 0.07 0.00 -0.42 -3.42 119.26 115.12 1rlc h ALA 93 Ca -0.00 -0.64 -0.51 0.00 0.00 0.00 0.00 54.91 53.76 1rlc h ALA 93 Cb 1.09 -0.03 -0.36 0.00 0.00 0.00 0.00 17.79 18.48 1rlc h ALA 93 CO 0.06 0.76 -0.81 0.71 0.00 0.00 0.00 179.25 179.98 1rlc s TYR 94 N -3.52 0.40 -1.58 0.00 2.02 0.28 -4.98 117.35 109.97 1rlc s TYR 94 Ca -0.07 -1.45 0.28 0.00 -0.37 0.00 0.00 57.07 55.46 1rlc s TYR 94 Cb 0.09 -0.72 1.07 0.00 -0.40 0.00 0.00 41.96 42.00 1rlc s TYR 94 CO 0.86 -0.88 1.76 -2.30 -1.57 0.00 0.00 175.55 173.42 1rlc n PRO 95 N 3.92 0.62 0.00 -1.71 -0.02 -0.99 -2.18 135.00 134.63 1rlc n PRO 95 Ca 0.14 -0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.48 1rlc n PRO 95 Cb 0.41 -1.49 0.13 0.00 -0.02 0.00 0.00 33.50 32.53 1rlc n PRO 95 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1rlc n GLN 96 N -0.96 1.26 -1.50 -0.52 3.00 -1.26 -4.44 117.38 112.95 1rlc n GLN 96 Ca 0.13 -0.97 -0.31 0.00 -0.01 0.00 0.00 57.00 55.83 1rlc n GLN 96 Cb 0.30 -1.48 0.06 0.00 0.00 0.00 0.00 30.24 29.12 1rlc n GLN 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1rlc s ALA 97 N -2.41 2.56 -0.14 -1.58 0.00 -0.93 -4.54 121.76 114.73 1rlc s ALA 97 Ca 0.22 0.15 -0.03 0.00 0.00 0.00 0.00 51.96 52.30 1rlc s ALA 97 Cb 0.19 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.07 1rlc s ALA 97 CO 0.52 -1.36 -0.03 -1.58 0.00 0.00 0.00 175.76 173.30 1rlc s TRP 98 N -2.97 3.04 -0.01 0.00 0.51 0.41 -2.81 118.94 117.10 1rlc s TRP 98 Ca 0.59 -0.22 0.07 0.00 -2.12 0.00 0.00 56.10 54.42 1rlc s TRP 98 Cb -0.15 -1.93 -0.02 0.00 -0.81 0.00 0.00 33.47 30.56 1rlc s TRP 98 CO 0.54 0.04 -0.23 0.42 -0.51 0.00 0.00 176.95 177.21 1rlc s ILE 99 N 0.17 1.83 0.05 2.03 1.01 -0.85 -0.65 121.20 124.78 1rlc s ILE 99 Ca -0.01 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 1rlc s ILE 99 Cb -0.14 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 1rlc s ILE 99 CO 0.03 0.48 0.01 0.00 0.00 0.00 0.00 174.94 175.46 1rlc s ARG 100 N -0.63 0.58 -0.08 2.79 1.70 0.01 -1.23 118.95 122.09 1rlc s ARG 100 Ca 0.09 -1.03 0.03 0.00 -0.47 0.00 0.00 55.73 54.35 1rlc s ARG 100 Cb -0.09 0.21 -0.02 0.00 -0.57 0.00 0.00 34.95 34.48 1rlc s ARG 100 CO -0.01 -0.12 -0.17 0.42 -1.08 0.00 0.00 175.30 174.34 1rlc s ILE 101 N -3.33 2.75 0.23 4.99 1.01 -0.55 -2.08 121.20 124.23 1rlc s ILE 101 Ca 0.01 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 59.91 1rlc s ILE 101 Cb 0.03 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 1rlc s ILE 101 CO -0.08 0.56 -0.07 0.27 0.00 0.00 0.00 174.94 175.63 1rlc s ILE 102 N -0.22 1.45 -0.12 2.92 -4.36 -0.64 -2.88 121.20 117.36 1rlc s ILE 102 Ca -0.00 -2.11 -0.05 0.00 -0.26 0.00 0.00 60.65 58.22 1rlc s ILE 102 Cb -0.13 -2.25 0.05 0.00 1.25 0.00 0.00 42.46 41.38 1rlc s ILE 102 CO 0.03 -0.43 0.25 -0.83 0.24 0.00 0.00 174.94 174.20 1rlc s GLY 103 N -3.34 -0.13 -0.03 6.27 0.00 -1.20 -0.78 107.32 108.11 1rlc s GLY 103 Ca 0.26 0.98 -0.08 0.00 0.00 0.00 0.00 44.72 45.87 1rlc s GLY 103 CO 0.08 1.57 0.26 -1.36 0.00 0.00 0.00 173.10 173.65 1rlc s PHE 104 N 1.76 3.62 -0.83 1.90 0.40 -0.27 -1.03 117.98 123.52 1rlc s PHE 104 Ca -0.05 0.65 -0.02 0.00 -0.60 0.00 0.00 56.93 56.92 1rlc s PHE 104 Cb -0.11 -2.04 0.21 0.00 0.51 0.00 0.00 43.02 41.58 1rlc s PHE 104 CO -0.09 0.66 0.70 0.34 0.70 0.00 0.00 175.22 177.53 1rlc s ASP 105 N -1.36 5.80 0.33 1.36 2.15 -0.85 -1.04 116.67 123.08 1rlc s ASP 105 Ca 0.23 -3.54 0.12 0.00 0.43 0.00 0.00 52.55 49.78 1rlc s ASP 105 Cb -0.14 -1.89 0.96 0.00 -0.30 0.00 0.00 42.92 41.55 1rlc s ASP 105 CO 0.12 -0.22 1.72 -0.55 -0.17 0.00 0.00 175.17 176.06 1rlc h ASN 106 N 6.21 0.62 -0.26 -0.34 -1.07 -1.90 -0.89 115.58 117.95 1rlc h ASN 106 Ca 0.12 0.14 -0.03 0.00 0.07 0.00 0.00 56.30 56.60 1rlc h ASN 106 Cb 0.84 0.05 -0.01 0.00 -2.07 0.00 0.00 38.32 37.13 1rlc h ASN 106 CO 0.82 0.05 0.03 -0.37 0.07 0.00 0.00 177.43 178.03 1rlc h VAL 107 N 0.51 1.24 -0.31 6.14 -1.51 -1.93 -2.14 116.25 118.24 1rlc h VAL 107 Ca 0.66 -0.81 0.00 0.00 -1.23 0.00 0.00 66.70 65.32 1rlc h VAL 107 Cb 1.37 1.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 1rlc h VAL 107 CO -0.49 0.26 0.00 -1.14 -1.23 0.00 0.00 177.57 174.97 1rlc n ARG 108 N -4.66 1.85 -1.93 5.19 0.63 -0.86 -4.90 116.66 111.97 1rlc n ARG 108 Ca -0.03 -1.30 -0.07 0.00 -0.92 0.00 0.00 57.85 55.53 1rlc n ARG 108 Cb 0.21 -1.33 -0.01 0.00 0.45 0.00 0.00 32.46 31.78 1rlc n ARG 108 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1rlc n GLN 109 N 0.54 -1.98 -4.02 -0.14 -0.06 -0.40 -4.95 117.38 106.37 1rlc n GLN 109 Ca 0.14 0.35 -0.24 0.00 -2.00 0.00 0.00 57.00 55.25 1rlc n GLN 109 Cb 0.33 -4.72 -0.04 0.00 -4.06 0.00 0.00 30.24 21.76 1rlc n GLN 109 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1rlc s VAL 110 N -2.01 4.92 0.25 1.69 1.01 -1.20 -4.98 120.40 120.08 1rlc s VAL 110 Ca 0.00 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 1rlc s VAL 110 Cb 0.00 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.69 1rlc s VAL 110 CO 0.00 -0.23 0.71 -1.58 0.00 0.00 0.00 175.10 174.00 1rlc s GLN 111 N -3.58 4.13 0.00 2.72 0.74 -1.26 -2.00 119.66 120.41 1rlc s GLN 111 Ca 0.33 0.76 0.00 0.00 0.05 0.00 0.00 55.36 56.50 1rlc s GLN 111 Cb -0.09 -2.73 0.00 0.00 1.10 0.00 0.00 33.01 31.29 1rlc s GLN 111 CO 0.27 0.32 0.34 0.00 -0.55 0.00 0.00 175.29 175.67 1rlc s ILE 113 N -0.03 0.04 -0.24 0.00 -1.09 -1.23 -4.97 121.20 113.68 1rlc s ILE 113 Ca 0.00 -0.36 -0.27 0.00 -2.23 0.00 0.00 60.65 57.80 1rlc s ILE 113 Cb 0.00 -0.76 0.13 0.00 -1.58 0.00 0.00 42.46 40.25 1rlc s ILE 113 CO 0.00 -0.20 1.04 -0.55 -1.23 0.00 0.00 174.94 174.00 1rlc s SER 114 N -1.39 -0.41 -0.27 3.58 0.15 -1.26 -3.25 113.70 110.86 1rlc s SER 114 Ca -0.12 0.67 -0.27 0.00 0.70 0.00 0.00 55.95 56.93 1rlc s SER 114 Cb -0.03 0.64 0.17 0.00 -1.71 0.00 0.00 66.02 65.09 1rlc s SER 114 CO 0.05 -0.21 1.28 0.72 1.20 0.00 0.00 173.24 176.28 1rlc s PHE 115 N -0.25 -0.16 0.49 3.44 -0.71 -1.14 -4.71 117.98 114.93 1rlc s PHE 115 Ca 0.02 0.35 -0.18 0.00 -1.04 0.00 0.00 56.93 56.07 1rlc s PHE 115 Cb -0.03 0.46 -0.09 0.00 -1.21 0.00 0.00 43.02 42.15 1rlc s PHE 115 CO -0.04 -0.11 0.98 -1.50 -1.34 0.00 0.00 175.22 173.21 1rlc s ILE 116 N -0.46 4.40 -0.01 -4.49 1.10 -1.26 -1.48 121.20 119.00 1rlc s ILE 116 Ca 0.06 1.29 0.01 0.00 -0.51 0.00 0.00 60.65 61.50 1rlc s ILE 116 Cb -0.03 -3.64 -0.01 0.00 0.15 0.00 0.00 42.46 38.93 1rlc s ILE 116 CO -0.09 -0.52 0.01 0.00 -2.11 0.00 0.00 174.94 172.23 1rlc n ALA 117 N -1.23 1.99 -3.30 1.50 0.00 -0.37 -4.85 120.51 114.26 1rlc n ALA 117 Ca 0.07 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 1rlc n ALA 117 Cb 0.54 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 20.08 1rlc n ALA 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1rlc s TYR 118 N -2.03 -0.34 0.09 0.00 5.04 -1.15 -4.97 117.35 113.98 1rlc s TYR 118 Ca -0.00 0.50 0.04 0.00 -2.44 0.00 0.00 57.07 55.17 1rlc s TYR 118 Cb 0.00 0.22 -0.03 0.00 0.35 0.00 0.00 41.96 42.50 1rlc s TYR 118 CO 0.04 -0.51 -0.10 0.15 -1.34 0.00 0.00 175.55 173.79 1rlc s LYS 119 N -1.62 0.81 0.94 4.97 3.01 -1.26 -2.01 119.74 124.58 1rlc s LYS 119 Ca -0.11 -1.11 -0.12 0.00 -1.01 0.00 0.00 55.97 53.63 1rlc s LYS 119 Cb -0.03 -0.53 0.15 0.00 -1.01 0.00 0.00 37.83 36.42 1rlc s LYS 119 CO 0.04 0.08 1.09 -1.25 0.51 0.00 0.00 175.35 175.82 1rlc s PRO 120 N -2.61 0.90 -0.18 -1.68 0.04 -1.12 -4.93 135.00 125.41 1rlc s PRO 120 Ca 0.03 0.76 -0.39 0.00 0.04 0.00 0.00 61.00 61.44 1rlc s PRO 120 Cb -0.04 -1.77 -0.16 0.00 0.04 0.00 0.00 34.50 32.57 1rlc s PRO 120 CO 0.00 -2.47 1.65 -1.91 0.04 0.00 0.00 177.00 174.31 1rlc n GLU 121 N -4.03 1.18 -2.59 4.56 0.00 -1.26 -2.22 120.64 116.28 1rlc n GLU 121 Ca 0.06 0.43 -0.03 0.00 0.00 0.00 0.00 57.16 57.62 1rlc n GLU 121 Cb 0.56 -2.11 0.01 0.00 0.00 0.00 0.00 31.44 29.90 1rlc n GLU 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1rlc n GLY 122 N 3.79 0.72 0.00 8.31 0.00 -1.26 -5.20 105.19 111.54 1rlc n GLY 122 Ca 0.24 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1rlc n GLY 122 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60