#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ids s PRO 2 N 0.00 4.35 0.36 2.12 0.02 -1.26 -5.01 135.00 135.58 3ids s PRO 2 Ca 0.00 1.79 -0.26 0.00 0.02 0.00 0.00 61.00 62.56 3ids s PRO 2 Cb 0.00 -2.90 -0.09 0.00 0.02 0.00 0.00 34.50 31.52 3ids s PRO 2 CO 0.00 -0.04 1.03 0.96 -0.33 0.00 0.00 177.00 178.62 3ids s ILE 3 N -1.33 3.81 -0.27 2.83 -0.00 -0.92 -4.69 121.20 120.63 3ids s ILE 3 Ca 0.51 1.49 -0.14 0.00 -0.00 0.00 0.00 60.65 62.51 3ids s ILE 3 Cb -0.30 -3.82 -0.04 0.00 -0.00 0.00 0.00 42.46 38.30 3ids s ILE 3 CO 0.39 0.11 0.34 -0.54 -0.00 0.00 0.00 174.94 175.24 3ids s LYS 4 N -2.19 4.02 -0.03 0.37 -0.14 -1.26 -0.08 119.74 120.43 3ids s LYS 4 Ca 0.53 -0.01 0.06 0.00 -1.36 0.00 0.00 55.97 55.20 3ids s LYS 4 Cb -0.23 -3.65 -0.01 0.00 -1.68 0.00 0.00 37.83 32.26 3ids s LYS 4 CO 0.29 -0.24 -0.22 0.08 -0.76 0.00 0.00 175.35 174.50 3ids s VAL 5 N 1.97 1.74 0.01 3.17 1.01 0.70 -1.72 120.40 127.27 3ids s VAL 5 Ca 0.14 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.27 3ids s VAL 5 Cb -0.16 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 3ids s VAL 5 CO 0.10 0.49 -0.23 -0.83 0.00 0.00 0.00 175.10 174.63 3ids s GLY 6 N -0.35 1.19 -0.42 4.51 0.00 -0.22 -0.78 107.32 111.25 3ids s GLY 6 Ca 0.04 -1.07 -0.06 0.00 0.00 0.00 0.00 44.72 43.63 3ids s GLY 6 CO 0.01 -0.93 0.25 -0.42 0.00 0.00 0.00 173.10 172.01 3ids s ILE 7 N -0.65 3.80 -0.31 0.90 1.01 -0.83 -0.42 121.20 124.70 3ids s ILE 7 Ca 0.09 -1.76 -0.29 0.00 0.00 0.00 0.00 60.65 58.69 3ids s ILE 7 Cb -0.09 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3ids s ILE 7 CO 0.00 -0.64 1.33 0.21 0.00 0.00 0.00 174.94 175.85 3ids s ASN 8 N 2.14 6.61 0.00 3.58 3.04 -0.12 -1.41 114.94 128.78 3ids s ASN 8 Ca 0.05 1.17 0.00 0.00 0.04 0.00 0.00 52.86 54.13 3ids s ASN 8 Cb -0.24 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 36.93 3ids s ASN 8 CO -0.01 -1.14 0.00 0.61 -3.04 0.00 0.00 177.10 173.52 3ids n GLY 9 N 4.43 -0.88 2.37 1.21 0.00 0.13 -0.69 105.19 111.76 3ids n GLY 9 Ca 0.15 -1.01 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 3ids n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ids n PHE 10 N 1.67 2.70 0.00 1.61 7.35 -1.19 -4.37 117.46 125.24 3ids n PHE 10 Ca 0.00 -2.65 0.00 0.00 -0.76 0.00 0.00 57.45 54.04 3ids n PHE 10 Cb 0.00 -0.22 0.00 0.00 0.35 0.00 0.00 39.48 39.61 3ids n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3ids n GLY 11 N -0.53 -1.42 0.29 7.13 0.00 -1.26 -4.59 105.19 104.80 3ids n GLY 11 Ca 0.34 -1.47 -0.06 0.00 0.00 0.00 0.00 46.02 44.83 3ids n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ids h ARG 12 N 0.00 0.97 0.45 1.61 2.43 -1.95 -1.21 114.38 116.68 3ids h ARG 12 Ca 0.00 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 3ids h ARG 12 Cb 0.00 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 3ids h ARG 12 CO 0.00 0.73 -0.29 0.82 -1.51 0.00 0.00 179.97 179.72 3ids h ILE 13 N 0.95 0.41 -0.80 1.20 2.04 -1.92 -1.91 117.51 117.47 3ids h ILE 13 Ca 0.24 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.13 3ids h ILE 13 Cb 0.05 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.49 3ids h ILE 13 CO -0.04 0.00 0.52 1.23 0.00 0.00 0.00 178.15 179.86 3ids h GLY 14 N -0.71 1.15 0.51 5.37 0.00 -1.74 -2.65 103.07 105.00 3ids h GLY 14 Ca -0.05 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 46.93 3ids h GLY 14 CO 0.04 0.35 -0.10 3.21 0.00 0.00 0.00 176.54 180.05 3ids h ARG 15 N 1.02 -0.07 -0.05 4.80 3.08 -1.08 -2.27 114.38 119.81 3ids h ARG 15 Ca 0.31 0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.24 3ids h ARG 15 Cb -0.02 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3ids h ARG 15 CO -0.10 -0.05 -0.56 0.52 -1.07 0.00 0.00 179.97 178.71 3ids h MET 16 N -0.08 0.15 -0.48 0.04 2.86 -1.14 -0.81 114.93 115.47 3ids h MET 16 Ca 0.11 -0.09 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3ids h MET 16 Cb 0.23 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.86 3ids h MET 16 CO -0.24 0.67 0.22 0.28 1.06 0.00 0.00 176.91 178.90 3ids h VAL 17 N 0.11 0.93 -0.44 -2.22 2.07 -1.34 -0.57 116.25 114.78 3ids h VAL 17 Ca -0.00 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 3ids h VAL 17 Cb 1.02 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 3ids h VAL 17 CO 0.08 0.08 0.26 0.15 0.02 0.00 0.00 177.57 178.16 3ids h PHE 18 N 0.44 0.59 -0.73 1.57 3.04 -0.70 -1.11 116.94 120.04 3ids h PHE 18 Ca 0.22 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.11 3ids h PHE 18 Cb 0.15 -0.19 -0.03 0.00 2.56 0.00 0.00 35.95 38.44 3ids h PHE 18 CO -0.12 0.43 0.26 1.96 -2.02 0.00 0.00 178.31 178.83 3ids h GLN 19 N 0.59 1.10 -0.51 1.11 1.08 -0.85 -1.42 115.11 116.19 3ids h GLN 19 Ca 0.16 -0.21 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 3ids h GLN 19 Cb 0.02 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.25 3ids h GLN 19 CO -0.03 0.91 0.22 0.00 -0.95 0.00 0.00 178.83 178.98 3ids h ALA 20 N 1.22 0.66 -0.32 3.87 0.00 -0.94 0.13 119.26 123.88 3ids h ALA 20 Ca 0.24 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3ids h ALA 20 Cb 0.24 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3ids h ALA 20 CO -0.02 0.26 0.08 1.25 0.00 0.00 0.00 179.25 180.83 3ids h LEU 21 N 0.68 0.06 -0.53 0.00 6.46 -0.85 -1.61 115.31 119.52 3ids h LEU 21 Ca 0.17 0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.96 3ids h LEU 21 Cb 0.17 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.12 3ids h LEU 21 CO -0.02 0.07 0.26 0.00 -0.62 0.00 0.00 178.44 178.13 3ids h GLU 23 N 0.71 1.04 0.00 0.00 4.81 -0.37 0.24 114.58 121.00 3ids h GLU 23 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3ids h GLU 23 Cb 0.11 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3ids h GLU 23 CO -0.02 0.69 0.00 -0.25 -0.73 0.00 0.00 179.01 178.70 3ids n ASP 24 N -4.57 0.00 -2.56 1.04 8.00 -0.64 -4.92 116.55 112.90 3ids n ASP 24 Ca 0.18 -0.39 -0.14 0.00 0.71 0.00 0.00 54.79 55.15 3ids n ASP 24 Cb 0.29 -0.16 0.06 0.00 -0.02 0.00 0.00 41.12 41.28 3ids n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ids n GLY 25 N 0.73 -0.05 0.00 0.44 0.00 0.83 -4.96 105.19 102.18 3ids n GLY 25 Ca 0.15 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.17 3ids n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ids n LEU 26 N -3.26 0.23 -4.67 0.99 4.77 -1.09 -4.78 117.00 109.20 3ids n LEU 26 Ca -0.09 -0.16 -0.42 0.00 -0.03 0.00 0.00 56.01 55.31 3ids n LEU 26 Cb 0.57 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 3ids n LEU 26 CO 0.41 0.06 1.45 -0.22 -1.33 0.00 0.00 177.39 177.76 3ids s LEU 27 N -3.64 4.37 0.00 2.23 2.96 -1.26 -0.36 118.68 122.99 3ids s LEU 27 Ca -0.02 2.45 0.00 0.00 -0.22 0.00 0.00 54.13 56.34 3ids s LEU 27 Cb 0.10 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.26 3ids s LEU 27 CO 0.64 -0.97 0.00 0.61 -1.32 0.00 0.00 176.35 175.31 3ids n GLY 28 N 4.26 2.59 0.08 7.98 0.00 0.26 -4.76 105.19 115.59 3ids n GLY 28 Ca 0.18 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 3ids n GLY 28 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ids h THR 29 N 0.00 0.53 0.03 2.61 1.35 -1.87 -3.44 112.91 112.12 3ids h THR 29 Ca 0.00 -1.55 -0.38 0.00 -0.55 0.00 0.00 66.41 63.92 3ids h THR 29 Cb 0.00 1.15 -0.05 0.00 -1.73 0.00 0.00 68.15 67.52 3ids h THR 29 CO 0.00 0.18 -2.25 -0.62 -0.25 0.00 0.00 175.52 172.58 3ids n GLU 30 N -4.58 0.66 -5.04 4.72 -0.58 -0.48 -4.29 120.64 111.04 3ids n GLU 30 Ca -0.14 0.24 -0.28 0.00 -0.42 0.00 0.00 57.16 56.56 3ids n GLU 30 Cb 0.38 -1.59 -0.16 0.00 -0.57 0.00 0.00 31.44 29.50 3ids n GLU 30 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3ids s ILE 31 N -2.51 1.70 -0.36 -3.67 1.01 0.51 -2.16 121.20 115.72 3ids s ILE 31 Ca -0.32 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.36 3ids s ILE 31 Cb 0.09 -1.43 0.04 0.00 0.01 0.00 0.00 42.46 41.17 3ids s ILE 31 CO 0.63 0.48 0.16 -0.62 0.00 0.00 0.00 174.94 175.59 3ids s ASP 32 N -0.26 5.50 -0.76 3.58 3.68 0.88 -0.58 116.67 128.72 3ids s ASP 32 Ca 0.02 -1.17 -0.26 0.00 2.13 0.00 0.00 52.55 53.27 3ids s ASP 32 Cb -0.11 -1.94 0.04 0.00 -1.45 0.00 0.00 42.92 39.47 3ids s ASP 32 CO 0.01 -0.39 1.24 -0.69 0.13 0.00 0.00 175.17 175.48 3ids s VAL 33 N 1.45 3.86 -0.07 1.11 1.01 -1.26 -0.22 120.40 126.28 3ids s VAL 33 Ca 0.00 0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.85 3ids s VAL 33 Cb -0.20 -4.89 -0.22 0.00 0.00 0.00 0.00 36.38 31.07 3ids s VAL 33 CO 0.04 -1.79 1.05 0.58 0.00 0.00 0.00 175.10 174.97 3ids h VAL 34 N 6.09 1.48 -3.92 2.92 2.07 -1.26 -3.41 116.25 120.21 3ids h VAL 34 Ca -0.23 -1.57 -0.10 0.00 0.82 0.00 0.00 66.70 65.63 3ids h VAL 34 Cb 1.05 2.52 -0.14 0.00 -1.52 0.00 0.00 31.29 33.21 3ids h VAL 34 CO 1.28 0.40 -0.40 0.00 0.02 0.00 0.00 177.57 178.86 3ids s ALA 35 N -3.48 -0.00 0.16 1.67 0.00 -1.24 -2.07 121.76 116.80 3ids s ALA 35 Ca -0.17 -0.82 0.09 0.00 0.00 0.00 0.00 51.96 51.07 3ids s ALA 35 Cb -0.00 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 3ids s ALA 35 CO 0.66 -0.54 -0.16 0.14 0.00 0.00 0.00 175.76 175.86 3ids s VAL 36 N -3.92 2.88 -0.08 0.00 -7.23 0.42 -1.96 120.40 110.52 3ids s VAL 36 Ca 0.11 -1.69 0.03 0.00 -1.81 0.00 0.00 61.98 58.62 3ids s VAL 36 Cb 0.05 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.61 3ids s VAL 36 CO -0.06 -0.04 -0.18 0.54 -0.31 0.00 0.00 175.10 175.05 3ids s VAL 37 N -1.51 1.54 0.29 1.32 0.11 -0.50 -1.08 120.40 120.58 3ids s VAL 37 Ca 0.22 -0.72 -0.09 0.00 -2.93 0.00 0.00 61.98 58.46 3ids s VAL 37 Cb -0.09 -1.36 0.00 0.00 -1.53 0.00 0.00 36.38 33.40 3ids s VAL 37 CO 0.12 0.44 0.48 -0.62 -3.33 0.00 0.00 175.10 172.20 3ids s ASP 38 N 0.48 0.30 0.50 3.54 -1.08 -0.97 -0.70 116.67 118.75 3ids s ASP 38 Ca -0.16 -1.18 0.29 0.00 -0.52 0.00 0.00 52.55 50.99 3ids s ASP 38 Cb -0.16 0.63 1.12 0.00 -1.46 0.00 0.00 42.92 43.04 3ids s ASP 38 CO 0.06 -1.23 1.90 0.00 0.52 0.00 0.00 175.17 176.42 3ids h MET 39 N 2.20 0.00 -5.91 4.34 -0.00 -1.94 0.17 114.93 113.79 3ids h MET 39 Ca -0.28 0.00 -0.66 0.00 -0.00 0.00 0.00 59.70 58.76 3ids h MET 39 Cb 1.25 0.00 -0.10 0.00 -0.00 0.00 0.00 31.60 32.74 3ids h MET 39 CO 0.38 0.08 -0.56 1.21 -0.00 0.00 0.00 176.91 178.02 3ids s ASN 40 N -5.92 5.75 -0.02 -0.10 2.47 -1.26 -4.73 114.94 111.14 3ids s ASN 40 Ca 0.01 0.23 0.13 0.00 0.42 0.00 0.00 52.86 53.66 3ids s ASN 40 Cb 0.09 -1.70 -0.21 0.00 -1.45 0.00 0.00 41.25 37.98 3ids s ASN 40 CO 0.59 0.33 0.28 0.41 -3.72 0.00 0.00 177.10 174.99 3ids n THR 41 N 1.58 0.04 -1.67 -5.21 -1.04 -1.26 -4.82 114.28 101.90 3ids n THR 41 Ca -0.16 -0.32 -0.49 0.00 -2.04 0.00 0.00 64.05 61.04 3ids n THR 41 Cb 0.53 0.15 -0.05 0.00 -1.82 0.00 0.00 70.33 69.14 3ids n THR 41 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3ids n ASP 42 N -1.99 3.02 -0.08 8.00 -0.08 -1.26 -4.60 116.55 119.55 3ids n ASP 42 Ca -0.03 1.04 -0.10 0.00 -1.51 0.00 0.00 54.79 54.18 3ids n ASP 42 Cb 0.38 -1.34 -0.15 0.00 2.34 0.00 0.00 41.12 42.34 3ids n ASP 42 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ids n ALA 43 N 5.04 1.49 -0.17 -1.67 0.00 -1.22 -3.79 120.51 120.19 3ids n ALA 43 Ca 0.21 -1.18 -0.08 0.00 0.00 0.00 0.00 53.44 52.39 3ids n ALA 43 Cb 0.26 -0.35 0.01 0.00 0.00 0.00 0.00 19.45 19.37 3ids n ALA 43 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3ids h GLU 44 N 0.00 0.70 -0.75 0.00 9.09 -1.90 -0.54 114.58 121.18 3ids h GLU 44 Ca -0.48 -0.08 -0.00 0.00 0.05 0.00 0.00 59.36 58.84 3ids h GLU 44 Cb 2.18 -0.14 -0.04 0.00 -1.65 0.00 0.00 28.75 29.11 3ids h GLU 44 CO 0.04 0.55 0.47 -0.92 0.05 0.00 0.00 179.01 179.20 3ids h TYR 45 N 0.66 0.97 -0.43 2.06 3.20 -1.98 -1.99 116.97 119.46 3ids h TYR 45 Ca 0.17 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.10 3ids h TYR 45 Cb 0.06 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 37.96 3ids h TYR 45 CO -0.02 0.64 0.17 0.74 -1.64 0.00 0.00 178.16 178.05 3ids h PHE 46 N 1.02 0.30 -0.86 -3.82 0.04 -1.48 0.16 116.94 112.30 3ids h PHE 46 Ca 0.27 0.02 0.01 0.00 2.80 0.00 0.00 57.97 61.07 3ids h PHE 46 Cb -0.06 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 37.97 3ids h PHE 46 CO -0.01 0.12 0.57 0.00 -0.60 0.00 0.00 178.31 178.39 3ids h ALA 47 N 1.26 1.38 -0.23 2.45 0.00 -0.91 0.20 119.26 123.41 3ids h ALA 47 Ca 0.19 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3ids h ALA 47 Cb 0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3ids h ALA 47 CO -0.18 0.57 0.09 -0.92 0.00 0.00 0.00 179.25 178.81 3ids h TYR 48 N 1.17 0.35 -0.85 0.00 3.20 -0.79 -0.39 116.97 119.67 3ids h TYR 48 Ca 0.32 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.17 3ids h TYR 48 Cb -0.13 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 37.99 3ids h TYR 48 CO 0.00 0.38 0.56 1.96 -1.64 0.00 0.00 178.16 179.43 3ids h GLN 49 N 0.22 1.10 -0.03 1.82 4.20 -0.31 -2.57 115.11 119.54 3ids h GLN 49 Ca 0.08 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 3ids h GLN 49 Cb 0.18 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3ids h GLN 49 CO -0.01 0.73 -0.72 1.98 -0.67 0.00 0.00 178.83 180.14 3ids h MET 50 N 1.13 0.18 0.09 1.46 4.05 -0.47 -3.32 114.93 118.06 3ids h MET 50 Ca 0.31 -0.16 -0.28 0.00 -0.28 0.00 0.00 59.70 59.30 3ids h MET 50 Cb -0.11 0.03 0.02 0.00 -0.80 0.00 0.00 31.60 30.75 3ids h MET 50 CO -0.07 0.82 -1.18 -0.09 0.23 0.00 0.00 176.91 176.63 3ids h ARG 51 N 0.12 0.55 -5.29 0.39 2.43 -0.73 -3.39 114.38 108.47 3ids h ARG 51 Ca -0.02 -0.72 -0.67 0.00 -0.81 0.00 0.00 59.98 57.76 3ids h ARG 51 Cb 1.27 0.23 -0.33 0.00 -0.42 0.00 0.00 29.97 30.73 3ids h ARG 51 CO 0.11 1.31 -0.88 0.71 -1.51 0.00 0.00 179.97 179.71 3ids s TYR 52 N -3.03 2.50 -0.07 2.20 2.02 -1.00 -2.12 117.35 117.85 3ids s TYR 52 Ca -0.08 -1.03 -0.00 0.00 -0.37 0.00 0.00 57.07 55.59 3ids s TYR 52 Cb 0.06 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.97 3ids s TYR 52 CO 0.92 -0.42 -0.04 0.34 -1.57 0.00 0.00 175.55 174.78 3ids s ASP 53 N 0.37 1.40 0.26 2.29 -1.08 -1.00 -4.76 116.67 114.16 3ids s ASP 53 Ca -0.18 -0.14 -0.03 0.00 -0.52 0.00 0.00 52.55 51.67 3ids s ASP 53 Cb -0.18 -0.52 0.39 0.00 -1.46 0.00 0.00 42.92 41.15 3ids s ASP 53 CO 0.08 -0.11 1.89 0.74 0.52 0.00 0.00 175.17 178.29 3ids h THR 54 N 6.21 1.11 0.02 1.71 2.02 -1.98 -2.11 112.91 119.89 3ids h THR 54 Ca -0.29 -0.41 -0.32 0.00 0.77 0.00 0.00 66.41 66.15 3ids h THR 54 Cb 1.14 -0.20 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 3ids h THR 54 CO 0.38 0.22 -1.78 0.52 0.37 0.00 0.00 175.52 175.23 3ids n VAL 55 N -4.49 1.57 1.36 3.16 0.31 -1.26 -4.56 118.33 114.42 3ids n VAL 55 Ca 0.15 -0.26 0.13 0.00 -0.01 0.00 0.00 64.34 64.36 3ids n VAL 55 Cb 0.16 -1.91 0.41 0.00 -0.91 0.00 0.00 33.84 31.59 3ids n VAL 55 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3ids n HIS 56 N -4.15 0.00 -3.42 3.52 8.25 -1.24 -4.98 115.22 113.19 3ids n HIS 56 Ca -0.39 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.07 3ids n HIS 56 Cb 0.81 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.91 3ids n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ids n GLY 57 N 1.24 -1.28 3.73 -1.41 0.00 -0.79 -4.88 105.19 101.80 3ids n GLY 57 Ca 0.17 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.43 3ids n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ids s LYS 58 N 0.00 4.42 0.17 1.61 1.02 -1.26 -2.39 119.74 123.32 3ids s LYS 58 Ca 0.00 0.88 -0.32 0.00 0.02 0.00 0.00 55.97 56.55 3ids s LYS 58 Cb 0.00 -3.40 -0.12 0.00 -0.52 0.00 0.00 37.83 33.79 3ids s LYS 58 CO 0.00 0.19 1.77 0.34 -0.92 0.00 0.00 175.35 176.73 3ids n PHE 59 N 3.28 2.69 1.98 3.18 7.35 -0.90 -4.88 117.46 130.16 3ids n PHE 59 Ca -0.03 -0.04 0.11 0.00 -0.76 0.00 0.00 57.45 56.74 3ids n PHE 59 Cb 0.51 -2.70 0.67 0.00 0.35 0.00 0.00 39.48 38.32 3ids n PHE 59 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 3ids n LYS 60 N 4.66 0.99 -4.70 -4.13 5.02 -1.26 -4.77 118.16 113.96 3ids n LYS 60 Ca 0.17 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.15 3ids n LYS 60 Cb 0.36 -1.36 -0.13 0.00 -0.02 0.00 0.00 35.03 33.88 3ids n LYS 60 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3ids s TYR 61 N -2.00 2.58 -0.05 2.13 1.51 -1.26 -5.10 117.35 115.16 3ids s TYR 61 Ca 0.34 -0.24 -0.27 0.00 -1.01 0.00 0.00 57.07 55.89 3ids s TYR 61 Cb 0.16 -1.49 -0.03 0.00 -0.11 0.00 0.00 41.96 40.49 3ids s TYR 61 CO 0.26 0.24 0.84 -2.00 -1.11 0.00 0.00 175.55 173.79 3ids s GLU 62 N -1.34 4.47 -0.22 -0.62 2.56 -1.26 -4.99 118.70 117.30 3ids s GLU 62 Ca 0.14 1.14 -0.02 0.00 0.00 0.00 0.00 54.97 56.23 3ids s GLU 62 Cb -0.11 -3.47 0.01 0.00 2.00 0.00 0.00 34.13 32.56 3ids s GLU 62 CO 0.05 -0.04 -0.08 0.08 -0.56 0.00 0.00 175.26 174.71 3ids s VAL 63 N 1.07 2.95 0.45 3.70 1.01 -1.26 -3.52 120.40 124.80 3ids s VAL 63 Ca 0.44 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.73 3ids s VAL 63 Cb -0.19 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 3ids s VAL 63 CO 0.22 0.37 0.24 0.42 0.00 0.00 0.00 175.10 176.35 3ids s THR 64 N 1.39 2.11 0.14 3.92 -4.23 -0.70 -4.98 115.64 113.29 3ids s THR 64 Ca 0.04 -1.63 0.06 0.00 -1.18 0.00 0.00 61.69 58.98 3ids s THR 64 Cb -0.15 -2.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 3ids s THR 64 CO -0.06 0.00 -0.14 0.42 -0.54 0.00 0.00 174.62 174.31 3ids s THR 65 N -2.65 1.39 0.24 3.99 -4.23 -1.26 -1.32 115.64 111.81 3ids s THR 65 Ca 0.37 -1.83 -0.09 0.00 -1.18 0.00 0.00 61.69 58.96 3ids s THR 65 Cb 0.01 -1.65 0.03 0.00 1.34 0.00 0.00 72.50 72.23 3ids s THR 65 CO 0.21 -0.47 0.47 1.07 -0.54 0.00 0.00 174.62 175.36 3ids n THR 66 N 0.31 0.00 -4.24 3.99 5.66 -0.74 -4.96 114.28 114.30 3ids n THR 66 Ca -0.14 -0.62 -0.31 0.00 -3.05 0.00 0.00 64.05 59.93 3ids n THR 66 Cb 0.58 0.60 -0.09 0.00 -1.55 0.00 0.00 70.33 69.87 3ids n THR 66 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3ids s LYS 67 N -2.07 2.56 0.07 1.09 1.02 -1.26 -2.01 119.74 119.13 3ids s LYS 67 Ca 0.10 -0.78 -0.15 0.00 0.02 0.00 0.00 55.97 55.16 3ids s LYS 67 Cb -0.03 -2.54 -0.19 0.00 -0.52 0.00 0.00 37.83 34.55 3ids s LYS 67 CO 0.07 0.57 1.23 0.66 -0.92 0.00 0.00 175.35 176.97 3ids h SER 68 N 3.89 0.81 -3.75 2.83 4.64 -1.93 -3.45 113.55 116.60 3ids h SER 68 Ca -0.48 -0.67 -0.23 0.00 -0.47 0.00 0.00 61.79 59.94 3ids h SER 68 Cb 1.17 -0.24 -0.28 0.00 -0.31 0.00 0.00 62.40 62.74 3ids h SER 68 CO 0.57 1.36 -0.72 -0.94 -0.87 0.00 0.00 176.83 176.24 3ids s SER 69 N -7.01 0.00 0.05 4.97 1.04 -1.26 -5.03 113.70 106.47 3ids s SER 69 Ca -0.11 -0.00 0.02 0.00 0.48 0.00 0.00 55.95 56.34 3ids s SER 69 Cb 0.07 0.01 0.11 0.00 0.10 0.00 0.00 66.02 66.30 3ids s SER 69 CO 0.88 -0.01 0.85 -2.65 0.98 0.00 0.00 173.24 173.30 3ids n PRO 70 N 3.05 0.01 0.07 4.02 -0.02 -1.26 -1.46 135.00 139.41 3ids n PRO 70 Ca -0.12 0.32 -0.04 0.00 -2.02 0.00 0.00 63.50 61.64 3ids n PRO 70 Cb 0.60 -1.78 0.17 0.00 -0.02 0.00 0.00 33.50 32.47 3ids n PRO 70 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3ids h SER 71 N 0.00 0.33 -3.87 2.55 4.64 -1.99 -3.46 113.55 111.75 3ids h SER 71 Ca 0.00 -0.15 -0.51 0.00 -0.47 0.00 0.00 61.79 60.66 3ids h SER 71 Cb 0.48 -0.09 0.04 0.00 -0.31 0.00 0.00 62.40 62.52 3ids h SER 71 CO 0.00 0.75 0.53 -0.69 -0.87 0.00 0.00 176.83 176.55 3ids s VAL 72 N -4.06 3.17 0.00 0.95 1.01 -0.54 -4.99 120.40 115.94 3ids s VAL 72 Ca -0.05 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.05 3ids s VAL 72 Cb 0.13 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.82 3ids s VAL 72 CO 0.79 0.22 0.95 0.00 0.00 0.00 0.00 175.10 177.06 3ids n ALA 73 N 0.74 -0.29 -2.46 5.51 0.00 -1.26 -4.84 120.51 117.91 3ids n ALA 73 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.19 3ids n ALA 73 Cb 0.44 0.17 -0.05 0.00 0.00 0.00 0.00 19.45 20.01 3ids n ALA 73 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ids s LYS 74 N -2.79 2.25 0.34 0.00 3.01 -1.26 -5.09 119.74 116.20 3ids s LYS 74 Ca 0.00 -1.97 -0.29 0.00 -1.01 0.00 0.00 55.97 52.70 3ids s LYS 74 Cb 0.00 -1.98 -0.11 0.00 -1.01 0.00 0.00 37.83 34.73 3ids s LYS 74 CO 0.00 -0.33 1.53 -0.25 0.51 0.00 0.00 175.35 176.81 3ids n ASP 75 N -1.44 3.79 0.00 2.83 9.92 -1.26 -4.89 116.55 125.50 3ids n ASP 75 Ca -0.04 1.19 0.00 0.00 -0.53 0.00 0.00 54.79 55.41 3ids n ASP 75 Cb 0.65 -1.60 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 3ids n ASP 75 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 3ids n ASP 76 N 1.22 0.88 -3.95 -2.24 5.75 -0.85 -3.39 116.55 113.97 3ids n ASP 76 Ca 0.05 -1.42 -0.21 0.00 -0.01 0.00 0.00 54.79 53.20 3ids n ASP 76 Cb 0.38 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.31 3ids n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3ids s THR 77 N -0.42 0.73 0.17 2.12 2.01 -0.85 -0.49 115.64 118.90 3ids s THR 77 Ca 0.00 -0.26 -0.08 0.00 0.31 0.00 0.00 61.69 61.67 3ids s THR 77 Cb 0.00 -0.70 -0.06 0.00 0.01 0.00 0.00 72.50 71.75 3ids s THR 77 CO 0.00 0.26 0.45 -0.76 -0.69 0.00 0.00 174.62 173.88 3ids s LEU 78 N 0.68 4.24 -0.24 4.42 1.43 0.42 -1.79 118.68 127.84 3ids s LEU 78 Ca -0.11 0.75 -0.00 0.00 -1.03 0.00 0.00 54.13 53.74 3ids s LEU 78 Cb -0.13 -3.40 0.07 0.00 0.03 0.00 0.00 46.19 42.75 3ids s LEU 78 CO 0.01 0.02 0.01 -0.69 0.23 0.00 0.00 176.35 175.93 3ids s VAL 79 N -1.68 1.14 -0.20 -1.59 1.01 -0.43 -0.34 120.40 118.31 3ids s VAL 79 Ca 0.42 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 3ids s VAL 79 Cb -0.12 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.69 3ids s VAL 79 CO 0.22 -0.26 -0.13 -0.69 0.00 0.00 0.00 175.10 174.25 3ids s VAL 80 N 1.55 2.63 -1.32 2.92 1.01 -0.20 -1.71 120.40 125.28 3ids s VAL 80 Ca -0.01 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 3ids s VAL 80 Cb -0.18 -2.18 0.02 0.00 0.00 0.00 0.00 36.38 34.04 3ids s VAL 80 CO -0.10 0.45 0.21 0.59 0.00 0.00 0.00 175.10 176.25 3ids n ASN 81 N 4.69 -4.62 0.00 3.32 4.13 -1.23 -0.65 115.26 120.90 3ids n ASN 81 Ca -0.19 -0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.02 3ids n ASN 81 Cb 0.50 -3.85 0.00 0.00 -1.54 0.00 0.00 39.78 34.89 3ids n ASN 81 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ids n GLY 82 N -1.05 1.56 3.68 7.41 0.00 -1.26 -5.03 105.19 110.50 3ids n GLY 82 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 3ids n GLY 82 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ids s HIS 83 N -2.97 3.42 0.03 1.61 5.04 0.18 -5.06 115.29 117.54 3ids s HIS 83 Ca 0.00 0.88 -0.18 0.00 -1.54 0.00 0.00 55.06 54.22 3ids s HIS 83 Cb 0.00 -2.69 -0.06 0.00 0.04 0.00 0.00 32.58 29.87 3ids s HIS 83 CO 0.00 -0.05 0.51 1.03 -2.34 0.00 0.00 174.74 173.90 3ids s ARG 84 N 1.42 4.13 -0.10 2.88 0.52 -1.26 -1.03 118.95 125.51 3ids s ARG 84 Ca 0.27 0.62 -0.02 0.00 -0.52 0.00 0.00 55.73 56.08 3ids s ARG 84 Cb -0.16 -3.26 0.03 0.00 0.52 0.00 0.00 34.95 32.09 3ids s ARG 84 CO 0.11 0.59 0.00 0.42 0.02 0.00 0.00 175.30 176.44 3ids s ILE 85 N -0.88 0.46 0.24 1.52 1.01 0.54 -4.78 121.20 119.30 3ids s ILE 85 Ca 0.27 -0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 3ids s ILE 85 Cb -0.18 -0.67 -0.09 0.00 0.01 0.00 0.00 42.46 41.54 3ids s ILE 85 CO 0.16 0.19 1.06 -0.22 0.00 0.00 0.00 174.94 176.13 3ids s LEU 86 N 1.93 4.55 -0.34 2.97 2.96 -0.88 -0.44 118.68 129.44 3ids s LEU 86 Ca 0.04 2.13 -0.11 0.00 -0.22 0.00 0.00 54.13 55.98 3ids s LEU 86 Cb -0.13 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.95 3ids s LEU 86 CO -0.06 -0.10 0.19 0.00 -1.32 0.00 0.00 176.35 175.06 3ids s VAL 88 N 1.61 4.04 0.25 0.00 -7.23 -0.24 -4.90 120.40 113.93 3ids s VAL 88 Ca 0.04 -1.48 -0.11 0.00 -1.81 0.00 0.00 61.98 58.61 3ids s VAL 88 Cb -0.18 -3.26 -0.08 0.00 0.56 0.00 0.00 36.38 33.43 3ids s VAL 88 CO 0.07 -0.31 0.60 -0.75 -0.31 0.00 0.00 175.10 174.41 3ids s LYS 89 N -3.85 3.87 0.41 4.82 2.20 -1.26 -2.28 119.74 123.64 3ids s LYS 89 Ca 0.35 0.40 -0.25 0.00 -0.36 0.00 0.00 55.97 56.11 3ids s LYS 89 Cb -0.07 -2.60 -0.08 0.00 -1.51 0.00 0.00 37.83 33.57 3ids s LYS 89 CO 0.24 0.28 1.19 0.00 -0.36 0.00 0.00 175.35 176.70 3ids s ALA 90 N -1.84 3.15 0.12 3.13 0.00 0.58 -4.74 121.76 122.15 3ids s ALA 90 Ca 0.49 1.00 0.07 0.00 0.00 0.00 0.00 51.96 53.52 3ids s ALA 90 Cb -0.11 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 3ids s ALA 90 CO 0.20 -0.58 -0.09 -0.65 0.00 0.00 0.00 175.76 174.63 3ids s GLN 91 N -2.33 2.14 0.10 0.00 -1.52 -1.26 -4.99 119.66 111.80 3ids s GLN 91 Ca 0.58 -1.05 -0.25 0.00 -1.95 0.00 0.00 55.36 52.68 3ids s GLN 91 Cb -0.31 -2.29 -0.10 0.00 -0.22 0.00 0.00 33.01 30.08 3ids s GLN 91 CO 0.40 0.50 1.68 0.00 -0.25 0.00 0.00 175.29 177.61 3ids h ARG 92 N 3.47 -0.31 -5.44 2.91 2.47 -2.01 -3.41 114.38 112.06 3ids h ARG 92 Ca -0.49 0.02 -0.65 0.00 -1.26 0.00 0.00 59.98 57.61 3ids h ARG 92 Cb 1.17 0.07 -0.21 0.00 -1.65 0.00 0.00 29.97 29.35 3ids h ARG 92 CO 0.53 -0.21 -0.68 1.21 0.56 0.00 0.00 179.97 181.38 3ids s ASN 93 N -4.92 4.73 0.61 7.04 2.47 -1.26 -5.01 114.94 118.59 3ids s ASN 93 Ca -0.15 -0.12 0.37 0.00 0.42 0.00 0.00 52.86 53.38 3ids s ASN 93 Cb 0.07 -1.67 2.01 0.00 -1.45 0.00 0.00 41.25 40.21 3ids s ASN 93 CO 0.66 0.20 2.13 -0.65 -3.72 0.00 0.00 177.10 175.72 3ids h PRO 94 N 6.43 0.00 0.00 0.43 0.11 -1.84 -1.79 132.00 135.34 3ids h PRO 94 Ca -0.34 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 3ids h PRO 94 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3ids h PRO 94 CO 0.60 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.17 3ids h ALA 95 N 1.81 1.28 0.00 -0.75 0.00 -1.86 -2.82 119.26 116.92 3ids h ALA 95 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3ids h ALA 95 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3ids h ALA 95 CO 0.00 0.28 0.00 -0.44 0.00 0.00 0.00 179.25 179.09 3ids h ASP 96 N 0.00 0.00 -3.94 0.00 3.32 -1.62 -3.30 116.42 110.88 3ids h ASP 96 Ca -0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.54 3ids h ASP 96 Cb 0.52 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.12 3ids h ASP 96 CO 0.03 0.00 0.49 -0.76 -1.72 0.00 0.00 179.24 177.28 3ids s LEU 97 N -5.05 4.20 -0.84 1.55 2.01 -1.06 -4.92 118.68 114.56 3ids s LEU 97 Ca 0.08 2.31 -0.04 0.00 0.01 0.00 0.00 54.13 56.50 3ids s LEU 97 Cb 0.10 -4.02 0.14 0.00 0.01 0.00 0.00 46.19 42.42 3ids s LEU 97 CO 0.59 -0.64 2.46 -0.81 1.01 0.00 0.00 176.35 178.96 3ids n PRO 98 N 0.11 3.48 -0.09 1.29 -0.04 -1.26 -4.53 135.00 133.97 3ids n PRO 98 Ca 0.04 -3.09 -0.12 0.00 -0.04 0.00 0.00 63.50 60.29 3ids n PRO 98 Cb 0.47 -2.35 -0.04 0.00 -0.04 0.00 0.00 33.50 31.53 3ids n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3ids h TRP 99 N 3.65 0.53 -0.66 0.54 -0.00 -1.62 -1.40 115.95 116.98 3ids h TRP 99 Ca 0.53 -0.11 0.07 0.00 -0.00 0.00 0.00 58.89 59.39 3ids h TRP 99 Cb 0.46 -0.13 -0.06 0.00 -0.00 0.00 0.00 29.16 29.42 3ids h TRP 99 CO 1.46 0.68 0.34 0.78 -0.00 0.00 0.00 178.44 181.70 3ids h GLY 100 N 0.23 0.97 1.41 1.49 0.00 -1.41 0.53 103.07 106.29 3ids h GLY 100 Ca 0.07 -0.22 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 3ids h GLY 100 CO 0.02 0.10 -0.51 0.50 0.00 0.00 0.00 176.54 176.65 3ids h LYS 101 N 0.61 0.63 0.00 4.80 1.79 -1.81 -2.47 116.57 120.11 3ids h LYS 101 Ca 0.31 -0.38 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3ids h LYS 101 Cb 0.27 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3ids h LYS 101 CO -0.22 0.99 -0.01 -0.07 -1.08 0.00 0.00 179.45 179.05 3ids h LEU 102 N 0.50 0.00 0.00 2.94 4.07 -0.44 -3.47 115.31 118.91 3ids h LEU 102 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3ids h LEU 102 Cb 1.05 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.79 3ids h LEU 102 CO 0.10 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 178.08 3ids n GLY 103 N 0.48 0.55 3.68 0.83 0.00 0.17 -5.04 105.19 105.85 3ids n GLY 103 Ca 0.02 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 3ids n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 104 N -2.00 4.80 -0.21 1.61 1.01 -0.04 -4.74 120.40 120.83 3ids s VAL 104 Ca 0.00 1.92 -0.10 0.00 0.00 0.00 0.00 61.98 63.80 3ids s VAL 104 Cb 0.00 -4.26 -0.19 0.00 0.00 0.00 0.00 36.38 31.93 3ids s VAL 104 CO 0.00 -0.01 0.05 1.21 0.00 0.00 0.00 175.10 176.35 3ids n GLU 105 N 5.24 0.65 -4.19 2.72 2.13 -0.80 -4.11 120.64 122.29 3ids n GLU 105 Ca 0.08 0.32 -0.34 0.00 0.66 0.00 0.00 57.16 57.88 3ids n GLU 105 Cb 0.48 -1.63 -0.13 0.00 0.27 0.00 0.00 31.44 30.43 3ids n GLU 105 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 3ids s TYR 106 N -2.49 2.98 -0.14 4.31 1.51 -0.70 -0.79 117.35 122.03 3ids s TYR 106 Ca -0.30 -0.60 -0.02 0.00 -1.01 0.00 0.00 57.07 55.14 3ids s TYR 106 Cb 0.09 -2.03 -0.02 0.00 -0.11 0.00 0.00 41.96 39.88 3ids s TYR 106 CO 0.63 -0.29 -0.09 0.54 -1.11 0.00 0.00 175.55 175.23 3ids s VAL 107 N 0.93 3.45 -0.51 0.71 0.11 -0.49 -1.05 120.40 123.56 3ids s VAL 107 Ca -0.00 -0.52 -0.21 0.00 -2.93 0.00 0.00 61.98 58.32 3ids s VAL 107 Cb -0.15 -2.48 0.05 0.00 -1.53 0.00 0.00 36.38 32.27 3ids s VAL 107 CO 0.01 0.51 0.72 -0.63 -3.33 0.00 0.00 175.10 172.38 3ids s ILE 108 N 0.36 4.73 -0.67 7.04 1.01 0.45 -0.73 121.20 133.39 3ids s ILE 108 Ca -0.08 -0.17 -0.23 0.00 0.00 0.00 0.00 60.65 60.17 3ids s ILE 108 Cb -0.15 -4.35 0.06 0.00 0.01 0.00 0.00 42.46 38.03 3ids s ILE 108 CO 0.04 -0.85 1.01 -0.70 0.00 0.00 0.00 174.94 174.45 3ids s GLU 109 N 3.03 3.14 -0.07 2.79 2.56 0.59 -0.94 118.70 129.78 3ids s GLU 109 Ca 0.21 -0.70 0.11 0.00 0.00 0.00 0.00 54.97 54.58 3ids s GLU 109 Cb -0.16 -4.21 0.16 0.00 2.00 0.00 0.00 34.13 31.92 3ids s GLU 109 CO 0.15 -1.85 1.07 -1.13 -0.56 0.00 0.00 175.26 172.94 3ids n SER 110 N 7.97 2.00 0.07 -1.70 3.41 0.13 -1.34 113.62 124.16 3ids n SER 110 Ca -0.02 -2.58 -0.13 0.00 -0.26 0.00 0.00 58.87 55.87 3ids n SER 110 Cb 0.46 -0.26 -0.05 0.00 -0.26 0.00 0.00 64.21 64.11 3ids n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3ids h THR 111 N 0.55 1.41 0.00 6.66 1.35 -1.83 -3.43 112.91 117.62 3ids h THR 111 Ca 0.00 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.37 3ids h THR 111 Cb 0.86 2.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 3ids h THR 111 CO 0.00 0.74 0.00 0.61 -0.25 0.00 0.00 175.52 176.62 3ids n GLY 112 N 0.97 1.39 0.02 5.82 0.00 -1.26 -4.89 105.19 107.25 3ids n GLY 112 Ca -0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3ids n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ids n LEU 113 N 0.00 0.63 -2.42 0.99 4.32 -1.26 -4.16 117.00 115.10 3ids n LEU 113 Ca 0.00 -0.05 -0.26 0.00 -0.02 0.00 0.00 56.01 55.69 3ids n LEU 113 Cb 0.00 -0.14 0.00 0.00 -1.62 0.00 0.00 43.42 41.66 3ids n LEU 113 CO 0.00 0.09 0.18 0.49 -1.22 0.00 0.00 177.39 176.92 3ids n PHE 114 N -1.77 3.22 0.21 -1.77 3.72 -1.26 -4.82 117.46 115.00 3ids n PHE 114 Ca 0.03 -2.96 0.09 0.00 -0.05 0.00 0.00 57.45 54.56 3ids n PHE 114 Cb 0.39 -0.13 0.43 0.00 -0.94 0.00 0.00 39.48 39.23 3ids n PHE 114 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3ids h THR 115 N 2.55 0.64 -3.73 4.37 2.02 -1.92 -3.35 112.91 113.49 3ids h THR 115 Ca 0.29 -1.21 -0.50 0.00 0.77 0.00 0.00 66.41 65.77 3ids h THR 115 Cb 1.03 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 3ids h THR 115 CO 0.82 0.25 0.38 0.00 0.37 0.00 0.00 175.52 177.34 3ids s ALA 116 N -3.65 3.34 0.27 6.16 0.00 -1.26 -2.70 121.76 123.92 3ids s ALA 116 Ca 0.00 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.64 3ids s ALA 116 Cb 0.10 -3.25 0.56 0.00 0.00 0.00 0.00 23.12 20.54 3ids s ALA 116 CO 0.65 0.10 1.75 -0.22 0.00 0.00 0.00 175.76 178.04 3ids h LYS 117 N 4.27 0.58 -0.38 0.00 3.64 -1.67 -1.21 116.57 121.81 3ids h LYS 117 Ca -0.45 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 58.81 3ids h LYS 117 Cb 1.20 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 3ids h LYS 117 CO 0.68 0.39 -0.10 0.00 -2.27 0.00 0.00 179.45 178.15 3ids h ALA 118 N 1.58 0.52 -0.45 5.00 0.00 -1.89 -1.09 119.26 122.93 3ids h ALA 118 Ca 0.48 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3ids h ALA 118 Cb 0.71 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3ids h ALA 118 CO -0.38 0.39 0.06 0.00 0.00 0.00 0.00 179.25 179.31 3ids h ALA 119 N 0.83 0.60 0.00 0.00 0.00 -1.78 -2.85 119.26 116.06 3ids h ALA 119 Ca 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3ids h ALA 119 Cb 0.62 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3ids h ALA 119 CO 0.04 0.34 -0.08 0.00 0.00 0.00 0.00 179.25 179.54 3ids h ALA 120 N 0.94 1.01 0.00 0.00 0.00 -1.20 -2.56 119.26 117.46 3ids h ALA 120 Ca 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ids h ALA 120 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ids h ALA 120 CO 0.01 0.10 0.00 0.93 0.00 0.00 0.00 179.25 180.29 3ids h GLU 121 N 0.00 0.00 -0.97 0.00 5.08 -0.94 -2.63 114.58 115.12 3ids h GLU 121 Ca -0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 3ids h GLU 121 Cb 0.61 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.78 3ids h GLU 121 CO 0.01 0.00 0.61 0.78 -1.00 0.00 0.00 179.01 179.41 3ids h GLY 122 N 1.06 1.53 0.50 -3.84 0.00 -1.53 -1.50 103.07 99.29 3ids h GLY 122 Ca 0.00 -0.36 0.15 0.00 0.00 0.00 0.00 47.33 47.13 3ids h GLY 122 CO 0.00 0.06 0.57 0.45 0.00 0.00 0.00 176.54 177.62 3ids h HIS 123 N 0.81 0.76 -0.33 5.60 3.86 -1.57 -0.18 115.15 124.10 3ids h HIS 123 Ca 0.51 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.66 3ids h HIS 123 Cb 0.73 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 3ids h HIS 123 CO -0.00 0.27 -0.16 -0.07 0.86 0.00 0.00 177.93 178.82 3ids h LEU 124 N 0.63 0.58 -0.76 2.43 4.07 -1.42 -2.04 115.31 118.79 3ids h LEU 124 Ca 0.45 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.24 3ids h LEU 124 Cb 0.80 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.38 3ids h LEU 124 CO -0.20 0.76 0.00 0.03 -1.08 0.00 0.00 178.44 177.95 3ids h ARG 125 N 0.53 0.00 -0.15 1.13 3.08 -1.04 -2.78 114.38 115.15 3ids h ARG 125 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3ids h ARG 125 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 3ids h ARG 125 CO 0.04 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.35 3ids n GLY 126 N 0.45 0.13 0.00 0.04 0.00 -0.60 -4.90 105.19 100.30 3ids n GLY 126 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3ids n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ids n GLY 127 N 1.08 0.51 3.83 -0.02 0.00 -1.05 -1.48 105.19 108.06 3ids n GLY 127 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3ids n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids s ALA 128 N -2.00 2.94 -0.16 4.61 0.00 -0.82 -4.09 121.76 122.25 3ids s ALA 128 Ca 0.00 0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.20 3ids s ALA 128 Cb 0.00 -3.15 -0.14 0.00 0.00 0.00 0.00 23.12 19.83 3ids s ALA 128 CO 0.00 -0.58 -0.06 0.54 0.00 0.00 0.00 175.76 175.66 3ids n ARG 129 N -2.09 1.03 -4.37 0.00 5.12 0.03 -4.12 116.66 112.26 3ids n ARG 129 Ca 0.07 0.05 -0.22 0.00 -1.93 0.00 0.00 57.85 55.82 3ids n ARG 129 Cb 0.54 -1.36 -0.13 0.00 -1.16 0.00 0.00 32.46 30.35 3ids n ARG 129 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3ids s LYS 130 N -2.35 1.09 -0.05 5.56 -0.14 -0.55 -4.83 119.74 118.47 3ids s LYS 130 Ca -0.16 -0.98 0.03 0.00 -1.36 0.00 0.00 55.97 53.50 3ids s LYS 130 Cb 0.05 -1.21 0.00 0.00 -1.68 0.00 0.00 37.83 34.99 3ids s LYS 130 CO 0.48 0.29 -0.15 0.08 -0.76 0.00 0.00 175.35 175.30 3ids s VAL 131 N -1.02 1.26 -0.29 3.17 1.01 0.12 -1.39 120.40 123.26 3ids s VAL 131 Ca 0.04 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.42 3ids s VAL 131 Cb -0.09 -1.11 0.06 0.00 0.00 0.00 0.00 36.38 35.23 3ids s VAL 131 CO 0.03 0.38 -0.02 -0.69 0.00 0.00 0.00 175.10 174.79 3ids s VAL 132 N 0.30 2.74 -0.30 2.92 1.01 0.09 -1.01 120.40 126.15 3ids s VAL 132 Ca -0.08 -1.51 -0.28 0.00 0.00 0.00 0.00 61.98 60.10 3ids s VAL 132 Cb -0.13 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.65 3ids s VAL 132 CO 0.03 -0.12 1.03 -0.63 0.00 0.00 0.00 175.10 175.40 3ids s ILE 133 N 1.19 4.58 -0.74 2.22 1.01 0.68 -0.30 121.20 129.85 3ids s ILE 133 Ca -0.05 1.70 -0.06 0.00 0.00 0.00 0.00 60.65 62.25 3ids s ILE 133 Cb -0.20 -4.36 -0.02 0.00 0.01 0.00 0.00 42.46 37.89 3ids s ILE 133 CO -0.03 -0.40 2.89 -1.54 0.00 0.00 0.00 174.94 175.87 3ids n SER 134 N 6.68 6.92 -3.61 3.58 3.41 -0.45 -1.43 113.62 128.72 3ids n SER 134 Ca 0.11 -2.94 -0.02 0.00 -0.26 0.00 0.00 58.87 55.76 3ids n SER 134 Cb 0.47 -1.35 -0.01 0.00 -0.26 0.00 0.00 64.21 63.06 3ids n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ids s ALA 135 N -0.44 -2.11 0.57 7.33 0.00 -1.22 -4.95 121.76 120.94 3ids s ALA 135 Ca 0.61 1.07 -0.21 0.00 0.00 0.00 0.00 51.96 53.43 3ids s ALA 135 Cb 0.29 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 3ids s ALA 135 CO -0.12 -0.84 1.36 -2.14 0.00 0.00 0.00 175.76 174.03 3ids s PRO 136 N -2.51 3.00 0.20 0.00 0.02 -1.23 -3.99 135.00 130.49 3ids s PRO 136 Ca 0.11 2.24 0.10 0.00 0.02 0.00 0.00 61.00 63.47 3ids s PRO 136 Cb 0.02 -2.18 -0.04 0.00 0.02 0.00 0.00 34.50 32.31 3ids s PRO 136 CO -0.04 -1.30 -0.20 0.00 -0.33 0.00 0.00 177.00 175.14 3ids s ALA 137 N -1.30 2.26 0.31 -1.55 0.00 -1.26 -4.92 121.76 115.30 3ids s ALA 137 Ca 0.74 -1.61 0.01 0.00 0.00 0.00 0.00 51.96 51.10 3ids s ALA 137 Cb -0.41 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.50 3ids s ALA 137 CO 0.47 0.27 0.12 -1.13 0.00 0.00 0.00 175.76 175.50 3ids n SER 138 N 0.06 2.41 -0.04 0.00 3.41 -1.10 -4.73 113.62 113.64 3ids n SER 138 Ca -0.11 -2.20 -0.01 0.00 -0.26 0.00 0.00 58.87 56.30 3ids n SER 138 Cb 0.58 0.09 -0.00 0.00 -0.26 0.00 0.00 64.21 64.61 3ids n SER 138 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ids n GLY 139 N 1.31 0.45 2.03 5.00 0.00 -1.26 -1.90 105.19 110.82 3ids n GLY 139 Ca -0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 3ids n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ids n GLY 140 N -2.35 0.29 3.76 -0.02 0.00 -1.26 -4.72 105.19 100.89 3ids n GLY 140 Ca -0.01 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 3ids n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids s ALA 141 N -2.18 3.46 0.09 4.61 0.00 -1.22 -4.97 121.76 121.57 3ids s ALA 141 Ca 0.00 1.09 -0.31 0.00 0.00 0.00 0.00 51.96 52.75 3ids s ALA 141 Cb -0.00 -3.42 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 3ids s ALA 141 CO 0.00 -0.44 1.39 0.21 0.00 0.00 0.00 175.76 176.93 3ids s LYS 142 N -1.42 4.31 -0.23 0.00 2.47 -1.24 -4.73 119.74 118.91 3ids s LYS 142 Ca 0.48 2.06 -0.08 0.00 -1.56 0.00 0.00 55.97 56.87 3ids s LYS 142 Cb -0.36 -3.31 -0.04 0.00 -1.46 0.00 0.00 37.83 32.66 3ids s LYS 142 CO 0.46 -0.46 0.09 0.99 0.16 0.00 0.00 175.35 176.59 3ids s THR 143 N 1.35 4.68 -0.10 3.43 2.01 -1.26 0.04 115.64 125.79 3ids s THR 143 Ca 0.65 -0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.61 3ids s THR 143 Cb -0.36 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.00 3ids s THR 143 CO 0.30 0.38 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.70 3ids s LEU 144 N 1.11 1.68 -0.20 4.42 1.43 -0.04 -4.81 118.68 122.27 3ids s LEU 144 Ca 0.05 -0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 52.74 3ids s LEU 144 Cb -0.14 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.06 3ids s LEU 144 CO 0.04 0.01 -0.14 -0.69 0.23 0.00 0.00 176.35 175.80 3ids s VAL 145 N 0.97 2.45 0.28 -1.59 1.01 -1.26 -4.31 120.40 117.94 3ids s VAL 145 Ca -0.07 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 3ids s VAL 145 Cb -0.15 -2.11 -0.11 0.00 0.00 0.00 0.00 36.38 34.01 3ids s VAL 145 CO -0.01 0.43 1.58 -0.04 0.00 0.00 0.00 175.10 177.07 3ids s MET 146 N 1.32 4.14 0.00 2.72 1.00 -1.26 -1.43 119.30 125.80 3ids s MET 146 Ca 0.04 2.55 0.00 0.00 0.00 0.00 0.00 55.69 58.27 3ids s MET 146 Cb -0.14 -3.04 0.00 0.00 0.00 0.00 0.00 34.83 31.65 3ids s MET 146 CO -0.09 -0.61 0.00 0.41 0.00 0.00 0.00 175.02 174.72 3ids n GLY 147 N 2.27 2.03 0.75 -0.03 0.00 -1.26 -4.83 105.19 104.12 3ids n GLY 147 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 3ids n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ids n VAL 148 N -2.00 0.94 -1.95 1.61 0.31 -0.51 -4.93 118.33 111.80 3ids n VAL 148 Ca 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 3ids n VAL 148 Cb 0.00 -1.73 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 3ids n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3ids n ASN 149 N -3.61 0.00 0.26 4.52 6.94 -0.93 -4.90 115.26 117.53 3ids n ASN 149 Ca -0.10 -1.75 0.12 0.00 -0.02 0.00 0.00 54.58 52.83 3ids n ASN 149 Cb 0.36 -0.15 0.70 0.00 -2.36 0.00 0.00 39.78 38.33 3ids n ASN 149 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3ids h HIS 150 N 0.00 0.00 0.00 -2.53 2.07 -1.91 -0.50 115.15 112.29 3ids h HIS 150 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3ids h HIS 150 Cb 1.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.28 3ids h HIS 150 CO 0.02 0.13 0.00 0.72 -3.07 0.00 0.00 177.93 175.72 3ids n HIS 151 N -3.76 0.00 1.39 6.12 8.25 -1.26 -1.51 115.22 124.46 3ids n HIS 151 Ca -0.02 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.59 3ids n HIS 151 Cb 0.23 -0.10 0.75 0.00 1.12 0.00 0.00 29.99 31.99 3ids n HIS 151 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3ids n GLU 152 N -1.10 0.40 -1.80 -0.41 1.02 -0.19 -4.86 120.64 113.70 3ids n GLU 152 Ca 0.11 -0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.83 3ids n GLU 152 Cb 0.08 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.98 3ids n GLU 152 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3ids s TYR 153 N -2.60 2.93 -0.30 -0.32 5.04 -0.57 -4.99 117.35 116.54 3ids s TYR 153 Ca 0.27 0.50 0.01 0.00 -2.44 0.00 0.00 57.07 55.42 3ids s TYR 153 Cb 0.20 -4.07 0.09 0.00 0.35 0.00 0.00 41.96 38.53 3ids s TYR 153 CO 0.47 -3.93 0.04 1.21 -1.34 0.00 0.00 175.55 171.99 3ids s ASN 154 N 1.04 4.20 0.47 4.32 3.84 -1.26 -5.03 114.94 122.53 3ids s ASN 154 Ca 0.71 -1.66 0.30 0.00 0.21 0.00 0.00 52.86 52.42 3ids s ASN 154 Cb -0.48 -1.20 1.39 0.00 -0.55 0.00 0.00 41.25 40.41 3ids s ASN 154 CO 0.34 -0.35 1.72 -0.65 -2.79 0.00 0.00 177.10 175.37 3ids h PRO 155 N 7.89 0.15 0.00 0.43 0.11 -1.92 0.24 132.00 138.90 3ids h PRO 155 Ca -0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3ids h PRO 155 Cb 1.03 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3ids h PRO 155 CO 0.47 0.10 -0.85 0.66 -0.21 0.00 0.00 178.00 178.17 3ids h SER 156 N 0.15 0.00 0.00 -2.05 4.64 -1.99 -3.39 113.55 110.92 3ids h SER 156 Ca 0.69 -0.14 -0.31 0.00 -0.47 0.00 0.00 61.79 61.56 3ids h SER 156 Cb 2.26 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.30 3ids h SER 156 CO -0.22 0.07 -2.16 1.21 -0.87 0.00 0.00 176.83 174.85 3ids n GLU 157 N -2.35 0.51 -3.49 4.77 4.07 -0.32 -4.94 120.64 118.88 3ids n GLU 157 Ca 0.02 0.12 -0.42 0.00 -0.06 0.00 0.00 57.16 56.82 3ids n GLU 157 Cb 0.49 -1.40 -0.10 0.00 -0.06 0.00 0.00 31.44 30.37 3ids n GLU 157 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 3ids s HIS 158 N -2.41 3.25 0.00 4.31 3.76 0.69 -4.84 115.29 120.06 3ids s HIS 158 Ca -0.28 -0.83 0.00 0.00 -0.15 0.00 0.00 55.06 53.81 3ids s HIS 158 Cb 0.07 -2.68 0.00 0.00 1.11 0.00 0.00 32.58 31.08 3ids s HIS 158 CO 0.46 -0.66 0.00 0.72 -0.85 0.00 0.00 174.74 174.41 3ids n HIS 159 N 5.11 0.00 -3.91 1.40 8.25 -1.26 -4.61 115.22 120.20 3ids n HIS 159 Ca -0.11 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.05 3ids n HIS 159 Cb 0.46 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.41 3ids n HIS 159 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3ids s VAL 160 N -1.99 1.39 0.34 1.59 1.01 -1.26 0.13 120.40 121.62 3ids s VAL 160 Ca 0.00 -1.15 0.09 0.00 0.00 0.00 0.00 61.98 60.93 3ids s VAL 160 Cb 0.00 -1.70 -0.06 0.00 0.00 0.00 0.00 36.38 34.62 3ids s VAL 160 CO 0.00 -0.13 -0.07 0.68 0.00 0.00 0.00 175.10 175.58 3ids s VAL 161 N 1.46 2.35 -0.02 2.92 -7.23 -0.18 -3.71 120.40 115.99 3ids s VAL 161 Ca -0.05 -2.14 0.07 0.00 -1.81 0.00 0.00 61.98 58.05 3ids s VAL 161 Cb -0.19 -2.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.04 3ids s VAL 161 CO -0.07 -0.20 -0.22 -0.55 -0.31 0.00 0.00 175.10 173.75 3ids s SER 162 N -3.64 3.44 -0.11 4.85 0.15 0.11 -0.23 113.70 118.27 3ids s SER 162 Ca 0.33 -0.39 0.13 0.00 0.70 0.00 0.00 55.95 56.71 3ids s SER 162 Cb 0.02 -0.52 0.56 0.00 -1.71 0.00 0.00 66.02 64.36 3ids s SER 162 CO 0.17 0.31 1.41 -3.20 1.20 0.00 0.00 173.24 173.14 3ids n ASN 163 N 2.23 3.87 0.00 5.45 5.15 -0.52 -0.86 115.26 130.58 3ids n ASN 163 Ca -0.16 -2.42 0.00 0.00 -0.60 0.00 0.00 54.58 51.40 3ids n ASN 163 Cb 0.52 -0.53 0.00 0.00 -0.53 0.00 0.00 39.78 39.23 3ids n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ids n ALA 164 N 0.70 0.00 -2.45 5.20 0.00 -1.26 -4.82 120.51 117.89 3ids n ALA 164 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.41 3ids n ALA 164 Cb 0.76 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.15 3ids n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ids s SER 165 N -4.00 4.82 0.23 0.00 1.04 -1.26 -3.44 113.70 111.09 3ids s SER 165 Ca 0.00 -0.77 -0.07 0.00 0.48 0.00 0.00 55.95 55.60 3ids s SER 165 Cb 0.00 -0.71 0.21 0.00 0.10 0.00 0.00 66.02 65.63 3ids s SER 165 CO 0.00 -0.41 1.87 0.00 0.98 0.00 0.00 173.24 175.68 3ids h THR 167 N 1.27 1.29 -0.80 0.00 2.02 -1.95 -2.38 112.91 112.35 3ids h THR 167 Ca 0.32 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.27 3ids h THR 167 Cb -0.02 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 3ids h THR 167 CO -0.06 0.40 0.51 0.74 0.37 0.00 0.00 175.52 177.49 3ids h THR 168 N 0.45 1.21 0.00 3.16 2.02 -1.79 -1.40 112.91 116.56 3ids h THR 168 Ca 0.08 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 3ids h THR 168 Cb 0.66 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3ids h THR 168 CO 0.04 0.21 -0.09 0.78 0.37 0.00 0.00 175.52 176.83 3ids h ASN 169 N 1.09 0.00 0.03 4.18 2.35 -0.98 -0.11 115.58 122.13 3ids h ASN 169 Ca 0.29 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.98 3ids h ASN 169 Cb -0.10 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.27 3ids h ASN 169 CO -0.06 0.09 -0.25 0.00 -1.65 0.00 0.00 177.43 175.57 3ids h LEU 171 N -0.74 0.53 -0.48 0.00 5.85 -1.16 -3.35 115.31 115.96 3ids h LEU 171 Ca -0.04 -0.61 0.07 0.00 0.84 0.00 0.00 57.88 58.14 3ids h LEU 171 Cb 1.15 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 3ids h LEU 171 CO 0.05 1.05 0.15 0.00 -0.34 0.00 0.00 178.44 179.34 3ids h ALA 172 N 0.50 0.56 -0.69 1.25 0.00 -1.23 -1.89 119.26 117.76 3ids h ALA 172 Ca -0.01 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.03 3ids h ALA 172 Cb 1.00 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 3ids h ALA 172 CO 0.08 -0.25 0.46 -1.35 0.00 0.00 0.00 179.25 178.19 3ids h PRO 173 N 0.31 0.71 0.21 0.00 0.11 -1.75 0.28 132.00 131.88 3ids h PRO 173 Ca 0.23 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 3ids h PRO 173 Cb 0.26 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.21 3ids h PRO 173 CO -0.26 0.47 -0.10 0.82 -0.21 0.00 0.00 178.00 178.73 3ids h ILE 174 N 0.74 0.85 -0.70 4.15 1.08 -1.50 -1.94 117.51 120.18 3ids h ILE 174 Ca 0.29 -0.28 -0.01 0.00 -0.39 0.00 0.00 64.86 64.48 3ids h ILE 174 Cb 0.23 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.96 3ids h ILE 174 CO -0.09 0.06 0.41 0.58 -0.69 0.00 0.00 178.15 178.42 3ids h VAL 175 N -0.42 1.21 -0.51 1.67 2.07 -1.00 -1.33 116.25 117.94 3ids h VAL 175 Ca -0.03 -0.49 0.07 0.00 0.82 0.00 0.00 66.70 67.08 3ids h VAL 175 Cb 0.32 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.29 3ids h VAL 175 CO 0.05 0.22 0.19 -0.74 0.02 0.00 0.00 177.57 177.31 3ids h HIS 176 N 0.96 0.33 -0.56 1.57 -0.00 -0.40 -0.11 115.15 116.93 3ids h HIS 176 Ca 0.25 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.59 3ids h HIS 176 Cb -0.00 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 3ids h HIS 176 CO -0.01 0.11 0.12 0.28 -0.00 0.00 0.00 177.93 178.43 3ids h VAL 177 N 0.37 1.25 -0.84 5.26 2.07 -0.92 0.16 116.25 123.59 3ids h VAL 177 Ca 0.25 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.87 3ids h VAL 177 Cb 0.27 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3ids h VAL 177 CO -0.25 0.34 0.56 -0.07 0.02 0.00 0.00 177.57 178.16 3ids h LEU 178 N 0.81 0.94 0.00 2.57 3.38 -0.60 -0.62 115.31 121.78 3ids h LEU 178 Ca 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3ids h LEU 178 Cb 0.37 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3ids h LEU 178 CO 0.00 0.66 -0.06 0.58 0.09 0.00 0.00 178.44 179.72 3ids h VAL 179 N 1.10 1.63 0.00 1.22 2.07 -0.77 -0.52 116.25 120.98 3ids h VAL 179 Ca 0.32 -1.93 -0.07 0.00 0.82 0.00 0.00 66.70 65.84 3ids h VAL 179 Cb -0.06 2.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 3ids h VAL 179 CO -0.08 0.51 -0.34 0.11 0.02 0.00 0.00 177.57 177.78 3ids h LYS 180 N -0.75 0.00 -0.08 1.57 1.79 -0.85 -2.28 116.57 115.98 3ids h LYS 180 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3ids h LYS 180 Cb 0.86 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.51 3ids h LYS 180 CO 0.01 0.34 0.00 0.39 -1.08 0.00 0.00 179.45 179.11 3ids n GLU 181 N -3.87 1.56 -0.42 3.15 -0.58 -0.25 -4.93 120.64 115.29 3ids n GLU 181 Ca -0.01 -0.82 0.00 0.00 -0.42 0.00 0.00 57.16 55.90 3ids n GLU 181 Cb 0.41 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 3ids n GLU 181 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ids n GLY 182 N 1.10 0.73 0.17 0.62 0.00 -0.86 -4.94 105.19 102.02 3ids n GLY 182 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3ids n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3ids h PHE 183 N 0.00 0.69 -1.52 1.61 0.04 -1.49 -3.44 116.94 112.83 3ids h PHE 183 Ca 0.00 -0.26 0.17 0.00 2.80 0.00 0.00 57.97 60.68 3ids h PHE 183 Cb 0.00 -0.12 -0.07 0.00 2.20 0.00 0.00 35.95 37.96 3ids h PHE 183 CO 0.00 1.00 -0.43 0.41 -0.60 0.00 0.00 178.31 178.69 3ids n GLY 184 N 0.46 -2.35 2.78 -1.45 0.00 -0.30 -0.59 105.19 103.74 3ids n GLY 184 Ca -0.06 -1.31 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 3ids n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 185 N -2.70 0.46 -0.17 1.61 1.01 -1.26 -3.07 120.40 116.29 3ids s VAL 185 Ca 0.00 0.03 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 3ids s VAL 185 Cb 0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 36.38 35.54 3ids s VAL 185 CO 0.00 0.24 0.48 -0.61 0.00 0.00 0.00 175.10 175.22 3ids h GLN 186 N 8.31 0.00 -3.10 2.72 4.15 -1.36 -3.46 115.11 122.38 3ids h GLN 186 Ca -0.21 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.09 3ids h GLN 186 Cb 1.12 0.00 -0.21 0.00 0.21 0.00 0.00 27.48 28.61 3ids h GLN 186 CO 0.28 0.95 -0.32 0.99 -1.93 0.00 0.00 178.83 178.81 3ids s THR 187 N -2.26 0.05 -0.06 2.39 2.01 -1.24 -4.83 115.64 111.70 3ids s THR 187 Ca -0.23 -0.45 -0.21 0.00 0.31 0.00 0.00 61.69 61.11 3ids s THR 187 Cb 0.01 -0.57 0.05 0.00 0.01 0.00 0.00 72.50 72.00 3ids s THR 187 CO 0.62 -0.25 0.49 -0.83 -0.69 0.00 0.00 174.62 173.96 3ids s GLY 188 N -1.15 -0.36 -0.02 4.40 0.00 -0.04 -1.28 107.32 108.86 3ids s GLY 188 Ca -0.12 0.92 0.03 0.00 0.00 0.00 0.00 44.72 45.55 3ids s GLY 188 CO 0.03 0.66 -0.11 1.08 0.00 0.00 0.00 173.10 174.76 3ids s LEU 189 N -0.96 1.88 -0.06 0.66 1.43 0.11 -2.90 118.68 118.85 3ids s LEU 189 Ca -0.10 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 3ids s LEU 189 Cb -0.03 -0.64 -0.02 0.00 0.03 0.00 0.00 46.19 45.53 3ids s LEU 189 CO 0.06 0.11 -0.18 -0.32 0.23 0.00 0.00 176.35 176.24 3ids s MET 190 N 0.01 2.64 -0.10 1.70 -2.45 -0.54 -0.66 119.30 119.91 3ids s MET 190 Ca -0.01 -0.78 0.04 0.00 -1.25 0.00 0.00 55.69 53.69 3ids s MET 190 Cb -0.08 -2.33 0.00 0.00 1.25 0.00 0.00 34.83 33.68 3ids s MET 190 CO 0.00 0.47 -0.24 0.99 1.05 0.00 0.00 175.02 177.29 3ids s THR 191 N -0.34 2.03 -0.18 10.11 2.01 -0.08 -1.24 115.64 127.94 3ids s THR 191 Ca 0.03 -1.00 -0.06 0.00 0.31 0.00 0.00 61.69 60.96 3ids s THR 191 Cb -0.12 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 3ids s THR 191 CO 0.02 0.55 0.04 -0.89 -0.69 0.00 0.00 174.62 173.65 3ids s THR 192 N 0.33 4.54 -0.44 -0.82 2.01 -0.71 -0.00 115.64 120.55 3ids s THR 192 Ca -0.18 -0.12 -0.18 0.00 0.31 0.00 0.00 61.69 61.51 3ids s THR 192 Cb -0.18 -3.04 0.03 0.00 0.01 0.00 0.00 72.50 69.33 3ids s THR 192 CO 0.09 0.46 0.52 -0.63 -0.69 0.00 0.00 174.62 174.37 3ids s ILE 193 N 0.42 5.00 -0.12 1.82 1.01 0.00 -1.20 121.20 128.14 3ids s ILE 193 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.38 3ids s ILE 193 Cb -0.13 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 3ids s ILE 193 CO 0.01 -0.54 -0.19 -2.28 0.00 0.00 0.00 174.94 171.94 3ids s HIS 194 N 2.36 2.68 0.53 3.97 2.46 -0.09 -1.23 115.29 125.96 3ids s HIS 194 Ca 0.15 -0.87 -0.22 0.00 0.47 0.00 0.00 55.06 54.59 3ids s HIS 194 Cb -0.17 -1.78 -0.06 0.00 -0.13 0.00 0.00 32.58 30.44 3ids s HIS 194 CO 0.14 -0.33 1.24 0.43 -2.47 0.00 0.00 174.74 173.76 3ids n SER 195 N 3.55 2.20 -4.70 9.88 7.64 -1.24 -0.53 113.62 130.42 3ids n SER 195 Ca -0.19 0.97 -0.32 0.00 1.01 0.00 0.00 58.87 60.35 3ids n SER 195 Cb 0.53 -1.51 0.14 0.00 -1.01 0.00 0.00 64.21 62.36 3ids n SER 195 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 3ids s TYR 196 N -1.31 1.86 0.36 1.43 -0.85 -0.57 -4.75 117.35 113.52 3ids s TYR 196 Ca 0.70 1.72 0.03 0.00 -0.52 0.00 0.00 57.07 59.00 3ids s TYR 196 Cb -0.44 -3.32 -0.05 0.00 0.38 0.00 0.00 41.96 38.53 3ids s TYR 196 CO 0.51 -2.60 0.09 0.95 -1.52 0.00 0.00 175.55 172.97 3ids s THR 197 N -2.56 0.92 0.34 -3.49 -4.23 -1.26 -4.70 115.64 100.66 3ids s THR 197 Ca 0.67 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.26 3ids s THR 197 Cb -0.23 -2.59 0.32 0.00 1.34 0.00 0.00 72.50 71.34 3ids s THR 197 CO 0.55 0.00 1.85 0.00 -0.54 0.00 0.00 174.62 176.48 3ids h ALA 198 N 1.98 1.79 0.00 3.99 0.00 -1.97 -1.25 119.26 123.79 3ids h ALA 198 Ca -0.39 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3ids h ALA 198 Cb 1.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3ids h ALA 198 CO 0.64 -0.05 0.00 0.25 0.00 0.00 0.00 179.25 180.09 3ids n THR 199 N -4.60 0.96 -2.17 0.00 -2.24 -1.26 -4.75 114.28 100.22 3ids n THR 199 Ca 0.19 0.46 -0.27 0.00 -2.27 0.00 0.00 64.05 62.16 3ids n THR 199 Cb 0.49 -1.42 0.14 0.00 -2.10 0.00 0.00 70.33 67.43 3ids n THR 199 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3ids s GLN 200 N -3.40 1.26 -0.01 -0.78 -0.21 -0.47 -4.98 119.66 111.06 3ids s GLN 200 Ca 0.01 -0.58 0.07 0.00 0.02 0.00 0.00 55.36 54.89 3ids s GLN 200 Cb 0.08 -2.05 -0.02 0.00 1.00 0.00 0.00 33.01 32.01 3ids s GLN 200 CO 0.29 -1.90 -0.24 0.15 -2.12 0.00 0.00 175.29 171.47 3ids s LYS 201 N -5.55 2.13 0.07 2.91 -0.14 -1.26 -5.00 119.74 112.91 3ids s LYS 201 Ca 0.69 -0.92 -0.21 0.00 -1.36 0.00 0.00 55.97 54.17 3ids s LYS 201 Cb -0.06 -2.10 -0.12 0.00 -1.68 0.00 0.00 37.83 33.88 3ids s LYS 201 CO 0.49 0.56 1.53 1.79 -0.76 0.00 0.00 175.35 178.96 3ids h THR 202 N 4.40 1.22 -2.38 2.17 1.35 -1.93 0.10 112.91 117.85 3ids h THR 202 Ca -0.44 -0.73 -0.56 0.00 -0.55 0.00 0.00 66.41 64.13 3ids h THR 202 Cb 1.13 1.41 -0.14 0.00 -1.73 0.00 0.00 68.15 68.82 3ids h THR 202 CO 0.47 0.22 -0.73 0.68 -0.25 0.00 0.00 175.52 175.91 3ids s VAL 203 N -5.15 2.17 -0.40 6.82 -7.23 -1.26 -3.97 120.40 111.39 3ids s VAL 203 Ca -0.14 -2.30 -0.42 0.00 -1.81 0.00 0.00 61.98 57.31 3ids s VAL 203 Cb 0.06 -2.30 -0.16 0.00 0.56 0.00 0.00 36.38 34.53 3ids s VAL 203 CO 0.71 -0.41 1.91 0.47 -0.31 0.00 0.00 175.10 177.47 3ids n ASP 204 N -0.58 1.69 0.00 4.85 8.00 -1.26 -4.36 116.55 124.89 3ids n ASP 204 Ca -0.06 0.86 0.00 0.00 0.71 0.00 0.00 54.79 56.30 3ids n ASP 204 Cb 0.61 -1.05 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 3ids n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ids n GLY 205 N 5.48 5.70 3.34 0.44 0.00 0.12 -4.93 105.19 115.34 3ids n GLY 205 Ca 0.38 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 3ids n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 206 N 1.63 3.26 -0.44 1.61 1.01 -1.26 -4.80 120.40 121.40 3ids s VAL 206 Ca 0.00 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.48 3ids s VAL 206 Cb 0.00 -2.44 0.20 0.00 0.00 0.00 0.00 36.38 34.14 3ids s VAL 206 CO 0.00 0.47 0.53 -0.24 0.00 0.00 0.00 175.10 175.86 3ids n SER 207 N 4.24 -1.39 0.19 3.32 2.88 -1.26 -4.92 113.62 116.68 3ids n SER 207 Ca -0.18 -2.67 0.10 0.00 -1.33 0.00 0.00 58.87 54.79 3ids n SER 207 Cb 0.52 0.27 0.64 0.00 -0.75 0.00 0.00 64.21 64.89 3ids n SER 207 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 3ids h VAL 208 N 4.09 0.95 -0.14 2.46 3.04 -1.96 -0.67 116.25 124.01 3ids h VAL 208 Ca 0.14 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.82 3ids h VAL 208 Cb 0.97 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.17 3ids h VAL 208 CO 0.29 0.01 0.00 0.29 -1.01 0.00 0.00 177.57 177.14 3ids n LYS 209 N -4.51 1.75 -2.79 4.17 5.02 -1.26 -4.59 118.16 115.96 3ids n LYS 209 Ca -0.00 -1.13 -0.02 0.00 -2.02 0.00 0.00 58.31 55.14 3ids n LYS 209 Cb 0.19 -1.42 0.02 0.00 -0.02 0.00 0.00 35.03 33.80 3ids n LYS 209 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3ids s ASP 210 N -1.65 -0.88 0.15 4.39 3.68 -0.27 -5.06 116.67 117.03 3ids s ASP 210 Ca 0.34 -0.87 -0.17 0.00 2.13 0.00 0.00 52.55 53.98 3ids s ASP 210 Cb 0.18 1.14 0.01 0.00 -1.45 0.00 0.00 42.92 42.81 3ids s ASP 210 CO 0.28 -0.05 1.78 -0.50 0.13 0.00 0.00 175.17 176.81 3ids h TRP 211 N 5.07 0.35 -0.58 -5.34 4.06 -1.79 -1.09 115.95 116.62 3ids h TRP 211 Ca 0.02 0.01 -0.06 0.00 2.06 0.00 0.00 58.89 60.93 3ids h TRP 211 Cb 1.16 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 3ids h TRP 211 CO 0.01 0.20 0.14 0.00 -3.56 0.00 0.00 178.44 175.23 3ids h ARG 212 N 0.38 0.91 0.00 0.49 3.08 -1.89 -2.64 114.38 114.71 3ids h ARG 212 Ca 0.13 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3ids h ARG 212 Cb 0.02 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.94 3ids h ARG 212 CO -0.07 0.82 0.00 0.78 -1.07 0.00 0.00 179.97 180.42 3ids h GLY 213 N 1.01 0.00 1.68 0.04 0.00 -1.50 -2.14 103.07 102.16 3ids h GLY 213 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3ids h GLY 213 CO 0.00 0.00 -0.21 0.61 0.00 0.00 0.00 176.54 176.94 3ids n GLY 214 N -1.08 -1.54 3.83 4.60 0.00 -0.99 -4.29 105.19 105.72 3ids n GLY 214 Ca -0.02 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 3ids n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ids s ARG 215 N -3.09 3.13 -0.18 1.61 1.81 -0.81 0.12 118.95 121.55 3ids s ARG 215 Ca 0.10 0.92 -0.36 0.00 -1.72 0.00 0.00 55.73 54.68 3ids s ARG 215 Cb 0.15 -2.02 -0.13 0.00 -0.45 0.00 0.00 34.95 32.50 3ids s ARG 215 CO 0.63 -0.95 1.89 0.00 -0.68 0.00 0.00 175.30 176.19 3ids n ALA 216 N -2.95 0.63 -0.02 2.13 0.00 -1.26 -4.38 120.51 114.65 3ids n ALA 216 Ca 0.07 0.25 -0.16 0.00 0.00 0.00 0.00 53.44 53.61 3ids n ALA 216 Cb 0.54 -2.44 -0.09 0.00 0.00 0.00 0.00 19.45 17.46 3ids n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ids h ALA 217 N 9.23 0.18 -0.15 0.00 0.00 -1.09 -3.19 119.26 124.24 3ids h ALA 217 Ca -0.45 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 53.95 3ids h ALA 217 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3ids h ALA 217 CO 0.96 0.37 0.00 0.00 0.00 0.00 0.00 179.25 180.59 3ids n ALA 218 N -2.55 2.52 -0.59 0.00 0.00 -1.26 -3.63 120.51 115.00 3ids n ALA 218 Ca -0.08 -0.42 0.01 0.00 0.00 0.00 0.00 53.44 52.95 3ids n ALA 218 Cb 0.61 -1.11 0.01 0.00 0.00 0.00 0.00 19.45 18.96 3ids n ALA 218 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3ids n VAL 219 N 0.06 0.63 -4.10 0.00 0.24 -1.24 -4.72 118.33 109.20 3ids n VAL 219 Ca 0.14 -0.66 -0.15 0.00 -2.04 0.00 0.00 64.34 61.63 3ids n VAL 219 Cb 0.24 0.63 -0.11 0.00 -1.47 0.00 0.00 33.84 33.13 3ids n VAL 219 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3ids s ASN 220 N -0.77 1.14 -0.19 -1.34 0.01 -1.20 -5.08 114.94 107.51 3ids s ASN 220 Ca 0.03 -0.59 -0.20 0.00 -0.71 0.00 0.00 52.86 51.38 3ids s ASN 220 Cb 0.02 0.01 -0.03 0.00 0.41 0.00 0.00 41.25 41.66 3ids s ASN 220 CO 0.00 -0.17 0.58 -0.63 -1.51 0.00 0.00 177.10 175.37 3ids s ILE 221 N -1.45 5.07 -0.26 0.60 1.01 -1.26 -4.24 121.20 120.66 3ids s ILE 221 Ca -0.06 1.09 0.01 0.00 0.00 0.00 0.00 60.65 61.69 3ids s ILE 221 Cb -0.09 -3.90 0.07 0.00 0.01 0.00 0.00 42.46 38.55 3ids s ILE 221 CO 0.01 0.16 -0.02 -0.63 0.00 0.00 0.00 174.94 174.46 3ids s ILE 222 N 1.66 1.50 0.55 2.92 1.01 -0.04 -4.93 121.20 123.85 3ids s ILE 222 Ca 0.27 -1.36 -0.21 0.00 0.00 0.00 0.00 60.65 59.35 3ids s ILE 222 Cb -0.16 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 3ids s ILE 222 CO 0.10 -0.25 1.23 -2.84 0.00 0.00 0.00 174.94 173.19 3ids s PRO 223 N 1.38 3.22 -0.06 2.79 0.02 -1.26 -0.42 135.00 140.66 3ids s PRO 223 Ca -0.01 1.92 -0.11 0.00 0.02 0.00 0.00 61.00 62.82 3ids s PRO 223 Cb -0.19 -2.14 0.02 0.00 0.02 0.00 0.00 34.50 32.22 3ids s PRO 223 CO -0.09 -1.03 0.27 0.45 -0.33 0.00 0.00 177.00 176.27 3ids s SER 224 N -1.37 -0.22 0.91 2.53 0.15 -0.09 -4.73 113.70 110.88 3ids s SER 224 Ca 0.72 0.32 -0.11 0.00 0.70 0.00 0.00 55.95 57.59 3ids s SER 224 Cb -0.32 0.45 0.14 0.00 -1.71 0.00 0.00 66.02 64.57 3ids s SER 224 CO 0.37 -0.23 1.11 0.42 1.20 0.00 0.00 173.24 176.11 3ids s THR 225 N -0.47 2.44 0.03 6.45 -4.23 -1.26 -0.12 115.64 118.47 3ids s THR 225 Ca -0.06 0.14 -0.15 0.00 -1.18 0.00 0.00 61.69 60.45 3ids s THR 225 Cb -0.04 -2.34 0.02 0.00 1.34 0.00 0.00 72.50 71.49 3ids s THR 225 CO 0.02 -0.19 0.33 0.28 -0.54 0.00 0.00 174.62 174.52 3ids s THR 226 N -2.72 0.07 -2.47 3.99 -1.32 -1.25 -4.54 115.64 107.40 3ids s THR 226 Ca 0.65 -0.60 0.24 0.00 -1.21 0.00 0.00 61.69 60.77 3ids s THR 226 Cb -0.21 -0.89 0.13 0.00 -1.51 0.00 0.00 72.50 70.02 3ids s THR 226 CO 0.58 -0.33 1.23 0.61 -2.21 0.00 0.00 174.62 174.50 3ids n GLY 227 N 0.68 0.42 0.21 6.08 0.00 -1.26 -4.56 105.19 106.76 3ids n GLY 227 Ca -0.19 -0.64 -0.06 0.00 0.00 0.00 0.00 46.02 45.13 3ids n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids h ALA 228 N 4.26 0.65 -0.38 4.61 0.00 -1.96 0.19 119.26 126.63 3ids h ALA 228 Ca 0.00 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 3ids h ALA 228 Cb 0.83 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3ids h ALA 228 CO 0.00 0.04 -0.38 0.00 0.00 0.00 0.00 179.25 178.91 3ids h ALA 229 N 1.21 0.61 -0.63 0.00 0.00 -1.88 -2.57 119.26 116.00 3ids h ALA 229 Ca 0.20 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3ids h ALA 229 Cb -0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3ids h ALA 229 CO -0.07 0.68 0.36 -0.22 0.00 0.00 0.00 179.25 180.00 3ids h LYS 230 N 0.75 0.86 0.00 0.00 3.64 -1.56 -2.79 116.57 117.46 3ids h LYS 230 Ca 0.06 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3ids h LYS 230 Cb 0.96 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3ids h LYS 230 CO 0.09 0.64 -0.06 0.00 -2.27 0.00 0.00 179.45 177.85 3ids h ALA 231 N 1.18 1.39 -0.05 5.00 0.00 -0.40 -0.54 119.26 125.84 3ids h ALA 231 Ca 0.22 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3ids h ALA 231 Cb 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3ids h ALA 231 CO -0.04 0.07 0.05 0.28 0.00 0.00 0.00 179.25 179.61 3ids h VAL 232 N 0.00 0.65 0.00 0.00 2.07 -1.17 -1.07 116.25 116.73 3ids h VAL 232 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3ids h VAL 232 Cb 0.17 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3ids h VAL 232 CO 0.01 0.00 -0.04 1.23 0.02 0.00 0.00 177.57 178.79 3ids h GLY 233 N 0.00 0.00 1.76 2.17 0.00 -1.21 0.45 103.07 106.24 3ids h GLY 233 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.12 3ids h GLY 233 CO -0.00 0.00 -1.16 -0.33 0.00 0.00 0.00 176.54 175.05 3ids h MET 234 N 0.00 0.01 0.08 4.80 2.86 -1.34 -3.25 114.93 118.10 3ids h MET 234 Ca -0.00 -0.01 -0.34 0.00 -2.06 0.00 0.00 59.70 57.29 3ids h MET 234 Cb 0.28 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 3ids h MET 234 CO 0.01 0.89 -1.87 0.28 1.06 0.00 0.00 176.91 177.28 3ids h VAL 235 N 0.00 0.73 -2.80 -2.22 2.07 -1.28 -3.41 116.25 109.34 3ids h VAL 235 Ca -0.07 -2.49 -0.61 0.00 0.82 0.00 0.00 66.70 64.35 3ids h VAL 235 Cb 1.83 2.50 -0.40 0.00 -1.52 0.00 0.00 31.29 33.69 3ids h VAL 235 CO 0.12 0.76 -0.74 -0.63 0.02 0.00 0.00 177.57 177.09 3ids s ILE 236 N -2.58 1.76 0.57 4.57 1.01 0.15 -4.75 121.20 121.94 3ids s ILE 236 Ca -0.15 -3.47 0.26 0.00 0.00 0.00 0.00 60.65 57.29 3ids s ILE 236 Cb 0.07 -2.18 0.36 0.00 0.01 0.00 0.00 42.46 40.72 3ids s ILE 236 CO 0.80 -1.08 2.09 -0.65 0.00 0.00 0.00 174.94 176.10 3ids h PRO 237 N 5.64 0.00 -0.02 2.79 0.11 -1.77 0.11 132.00 138.86 3ids h PRO 237 Ca 0.17 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.29 3ids h PRO 237 Cb 0.83 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 3ids h PRO 237 CO 0.56 0.00 0.04 0.66 -0.21 0.00 0.00 178.00 179.05 3ids h SER 238 N 0.00 0.00 0.03 -2.05 4.64 -1.93 -1.66 113.55 112.58 3ids h SER 238 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3ids h SER 238 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3ids h SER 238 CO -0.00 0.00 -0.05 0.35 -0.87 0.00 0.00 176.83 176.26 3ids n THR 239 N -3.46 0.00 -1.65 2.95 -2.24 0.40 -4.92 114.28 105.36 3ids n THR 239 Ca -0.02 -0.24 -0.50 0.00 -2.27 0.00 0.00 64.05 61.02 3ids n THR 239 Cb 0.12 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 3ids n THR 239 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3ids n GLN 240 N 0.06 1.72 -0.91 -0.78 -0.06 -0.63 -0.85 117.38 115.93 3ids n GLN 240 Ca 0.17 0.62 0.00 0.00 -2.00 0.00 0.00 57.00 55.80 3ids n GLN 240 Cb 0.36 -2.35 0.00 0.00 -4.06 0.00 0.00 30.24 24.19 3ids n GLN 240 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3ids n GLY 241 N 3.41 0.62 0.00 1.69 0.00 -1.26 -4.85 105.19 104.81 3ids n GLY 241 Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 3ids n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ids n LYS 242 N -1.98 0.61 -4.23 1.61 5.02 -0.03 -4.96 118.16 114.20 3ids n LYS 242 Ca 0.00 -0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 3ids n LYS 242 Cb 0.04 -1.41 -0.16 0.00 -0.02 0.00 0.00 35.03 33.48 3ids n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ids s LEU 243 N -2.92 1.49 0.00 -0.35 1.02 -1.25 -0.86 118.68 115.80 3ids s LEU 243 Ca 0.07 -0.14 0.02 0.00 0.02 0.00 0.00 54.13 54.10 3ids s LEU 243 Cb 0.15 -0.47 -0.01 0.00 0.02 0.00 0.00 46.19 45.88 3ids s LEU 243 CO 0.79 -0.02 0.29 1.07 0.02 0.00 0.00 176.35 178.51 3ids n THR 244 N 3.80 0.00 -3.66 5.49 5.66 -1.14 -3.72 114.28 120.71 3ids n THR 244 Ca -0.23 -1.56 0.00 0.00 -3.05 0.00 0.00 64.05 59.21 3ids n THR 244 Cb 0.52 0.86 0.00 0.00 -1.55 0.00 0.00 70.33 70.16 3ids n THR 244 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3ids n GLY 245 N -0.45 0.63 3.56 1.09 0.00 -1.26 -1.47 105.19 107.29 3ids n GLY 245 Ca 0.03 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 3ids n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3ids s MET 246 N -1.27 1.60 0.18 1.61 0.23 -0.38 -3.82 119.30 117.46 3ids s MET 246 Ca 0.00 -1.35 0.06 0.00 -1.03 0.00 0.00 55.69 53.38 3ids s MET 246 Cb 0.00 0.46 -0.05 0.00 -1.53 0.00 0.00 34.83 33.72 3ids s MET 246 CO 0.00 -0.67 -0.13 -1.54 -2.03 0.00 0.00 175.02 170.66 3ids s SER 247 N -3.06 2.26 -0.24 -1.18 1.04 0.82 -1.73 113.70 111.61 3ids s SER 247 Ca 0.24 -1.01 0.03 0.00 0.48 0.00 0.00 55.95 55.69 3ids s SER 247 Cb -0.00 -0.09 0.05 0.00 0.10 0.00 0.00 66.02 66.08 3ids s SER 247 CO 0.11 -0.23 -0.12 -0.36 0.98 0.00 0.00 173.24 173.62 3ids s PHE 248 N -3.08 3.12 -0.14 5.02 0.08 -0.34 -0.92 117.98 121.72 3ids s PHE 248 Ca 0.20 -2.17 -0.27 0.00 0.12 0.00 0.00 56.93 54.81 3ids s PHE 248 Cb 0.00 -1.90 -0.01 0.00 -0.57 0.00 0.00 43.02 40.54 3ids s PHE 248 CO 0.04 -0.86 0.89 1.03 -0.10 0.00 0.00 175.22 176.23 3ids s ARG 249 N 1.15 4.35 0.23 0.44 0.52 0.43 -0.92 118.95 125.16 3ids s ARG 249 Ca -0.06 1.15 0.07 0.00 -0.52 0.00 0.00 55.73 56.37 3ids s ARG 249 Cb -0.19 -3.56 -0.05 0.00 0.52 0.00 0.00 34.95 31.68 3ids s ARG 249 CO -0.06 -0.31 -0.12 0.14 0.02 0.00 0.00 175.30 174.97 3ids s VAL 250 N 2.05 1.70 -0.93 3.52 -7.23 0.32 -0.86 120.40 118.97 3ids s VAL 250 Ca 0.42 -2.19 -0.06 0.00 -1.81 0.00 0.00 61.98 58.34 3ids s VAL 250 Cb -0.17 -2.18 -0.07 0.00 0.56 0.00 0.00 36.38 34.51 3ids s VAL 250 CO 0.14 -0.50 2.33 -2.65 -0.31 0.00 0.00 175.10 174.11 3ids n PRO 251 N -0.45 2.29 -4.50 4.82 -0.02 -1.26 -2.71 135.00 133.18 3ids n PRO 251 Ca -0.07 -1.49 -0.24 0.00 -2.02 0.00 0.00 63.50 59.68 3ids n PRO 251 Cb 0.61 -2.43 -0.13 0.00 -0.02 0.00 0.00 33.50 31.53 3ids n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3ids s THR 252 N 2.95 1.60 -0.43 3.45 -4.23 -1.26 -5.01 115.64 112.71 3ids s THR 252 Ca 0.46 -1.27 0.23 0.00 -1.18 0.00 0.00 61.69 59.92 3ids s THR 252 Cb 0.13 -1.42 0.26 0.00 1.34 0.00 0.00 72.50 72.81 3ids s THR 252 CO -0.03 0.10 1.50 1.55 -0.54 0.00 0.00 174.62 177.20 3ids h PRO 253 N 4.64 0.00 -2.53 3.99 0.13 -1.87 -1.51 132.00 134.85 3ids h PRO 253 Ca -0.43 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.66 3ids h PRO 253 Cb 1.17 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.15 3ids h PRO 253 CO 0.43 0.00 0.20 0.34 -0.23 0.00 0.00 178.00 178.74 3ids s ASP 254 N -5.84 -0.61 0.00 1.44 2.15 -1.26 -4.71 116.67 107.84 3ids s ASP 254 Ca 0.06 0.33 0.00 0.00 0.43 0.00 0.00 52.55 53.37 3ids s ASP 254 Cb 0.07 0.57 0.00 0.00 -0.30 0.00 0.00 42.92 43.26 3ids s ASP 254 CO 0.69 -0.80 0.00 0.52 -0.17 0.00 0.00 175.17 175.41 3ids n VAL 255 N 0.22 -0.82 -4.32 1.11 0.31 -1.26 -4.89 118.33 108.69 3ids n VAL 255 Ca -0.18 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 63.99 3ids n VAL 255 Cb 0.61 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.62 3ids n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3ids s SER 256 N -0.48 1.20 -0.04 4.52 0.01 0.34 -3.66 113.70 115.59 3ids s SER 256 Ca 0.00 -1.38 -0.02 0.00 1.31 0.00 0.00 55.95 55.86 3ids s SER 256 Cb 0.00 0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.41 3ids s SER 256 CO 0.00 -0.73 0.09 0.54 0.41 0.00 0.00 173.24 173.55 3ids s VAL 257 N -3.75 -0.03 -0.08 3.43 0.11 -0.37 -1.05 120.40 118.66 3ids s VAL 257 Ca 0.38 0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 59.38 3ids s VAL 257 Cb 0.08 -0.15 -0.05 0.00 -1.53 0.00 0.00 36.38 34.73 3ids s VAL 257 CO 0.13 0.05 0.39 -0.69 -3.33 0.00 0.00 175.10 171.65 3ids s VAL 258 N 0.66 5.16 -0.40 2.04 1.01 0.22 -0.82 120.40 128.28 3ids s VAL 258 Ca -0.05 0.77 0.03 0.00 0.00 0.00 0.00 61.98 62.74 3ids s VAL 258 Cb -0.07 -3.71 0.11 0.00 0.00 0.00 0.00 36.38 32.71 3ids s VAL 258 CO -0.03 0.46 0.12 -0.62 0.00 0.00 0.00 175.10 175.03 3ids s ASP 259 N -0.20 4.69 -0.24 3.32 -1.08 0.99 -1.17 116.67 122.99 3ids s ASP 259 Ca 0.22 -2.39 -0.09 0.00 -0.52 0.00 0.00 52.55 49.77 3ids s ASP 259 Cb -0.15 -1.65 -0.04 0.00 -1.46 0.00 0.00 42.92 39.62 3ids s ASP 259 CO 0.10 -0.35 0.13 -0.22 0.52 0.00 0.00 175.17 175.35 3ids s LEU 260 N 0.59 3.90 -0.13 -1.34 2.96 -0.14 -0.90 118.68 123.62 3ids s LEU 260 Ca 0.13 0.01 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 3ids s LEU 260 Cb -0.21 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 3ids s LEU 260 CO -0.06 0.03 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.00 3ids s THR 261 N 1.23 3.15 0.13 3.68 2.01 0.17 0.38 115.64 126.40 3ids s THR 261 Ca 0.06 -0.63 -0.14 0.00 0.31 0.00 0.00 61.69 61.29 3ids s THR 261 Cb -0.14 -2.33 0.02 0.00 0.01 0.00 0.00 72.50 70.06 3ids s THR 261 CO 0.05 0.52 0.37 0.72 -0.69 0.00 0.00 174.62 175.60 3ids s PHE 262 N 0.32 -0.08 -0.18 4.92 -0.71 -0.09 0.05 117.98 122.20 3ids s PHE 262 Ca -0.10 -0.26 -0.05 0.00 -1.04 0.00 0.00 56.93 55.47 3ids s PHE 262 Cb -0.16 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.82 3ids s PHE 262 CO 0.05 -0.71 0.01 0.95 -1.34 0.00 0.00 175.22 174.19 3ids s THR 263 N -3.84 4.20 0.77 -4.49 -4.23 -0.41 -0.50 115.64 107.14 3ids s THR 263 Ca 0.05 -0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 60.22 3ids s THR 263 Cb 0.02 -2.89 0.05 0.00 1.34 0.00 0.00 72.50 71.03 3ids s THR 263 CO -0.09 0.45 1.08 0.00 -0.54 0.00 0.00 174.62 175.52 3ids s ALA 264 N 0.67 2.31 -1.03 3.99 0.00 0.10 -1.13 121.76 126.67 3ids s ALA 264 Ca 0.00 0.08 0.26 0.00 0.00 0.00 0.00 51.96 52.31 3ids s ALA 264 Cb -0.14 -3.20 0.72 0.00 0.00 0.00 0.00 23.12 20.50 3ids s ALA 264 CO 0.02 -1.64 1.56 0.00 0.00 0.00 0.00 175.76 175.70 3ids n ALA 265 N -3.42 3.20 -2.12 0.00 0.00 0.24 -4.52 120.51 113.90 3ids n ALA 265 Ca 0.08 -0.28 -0.08 0.00 0.00 0.00 0.00 53.44 53.15 3ids n ALA 265 Cb 0.54 -1.22 -0.10 0.00 0.00 0.00 0.00 19.45 18.67 3ids n ALA 265 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3ids s ARG 266 N -2.98 0.71 0.25 0.00 1.70 -1.08 -4.99 118.95 112.56 3ids s ARG 266 Ca 0.12 -1.28 -0.30 0.00 -0.47 0.00 0.00 55.73 53.80 3ids s ARG 266 Cb 0.18 0.10 -0.11 0.00 -0.57 0.00 0.00 34.95 34.55 3ids s ARG 266 CO 0.65 -0.10 1.56 -0.51 -1.08 0.00 0.00 175.30 175.82 3ids s ASP 267 N -2.97 6.49 0.00 -2.89 1.01 -1.26 -4.82 116.67 112.23 3ids s ASP 267 Ca 0.10 2.81 0.00 0.00 0.71 0.00 0.00 52.55 56.17 3ids s ASP 267 Cb 0.07 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.38 3ids s ASP 267 CO -0.07 -0.85 0.00 1.07 0.21 0.00 0.00 175.17 175.53 3ids n THR 268 N 2.73 0.00 -3.63 -1.27 5.66 -0.56 -5.05 114.28 112.16 3ids n THR 268 Ca 0.10 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.97 3ids n THR 268 Cb 0.38 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.10 3ids n THR 268 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3ids s SER 269 N 1.62 -0.32 0.44 1.09 1.04 -1.26 -4.26 113.70 112.05 3ids s SER 269 Ca 0.00 -0.02 0.11 0.00 0.48 0.00 0.00 55.95 56.53 3ids s SER 269 Cb 0.00 0.45 0.98 0.00 0.10 0.00 0.00 66.02 67.55 3ids s SER 269 CO 0.00 -0.72 2.03 -0.29 0.98 0.00 0.00 173.24 175.24 3ids h ILE 270 N 2.81 1.10 -0.73 -1.02 6.09 -1.95 -2.14 117.51 121.67 3ids h ILE 270 Ca -0.32 -0.39 -0.05 0.00 -1.37 0.00 0.00 64.86 62.74 3ids h ILE 270 Cb 1.22 0.99 -0.03 0.00 0.47 0.00 0.00 36.82 39.47 3ids h ILE 270 CO 0.43 0.13 0.28 1.56 -3.07 0.00 0.00 178.15 177.48 3ids h GLN 271 N 0.21 1.10 -0.35 2.19 7.50 -1.96 -0.02 115.11 123.77 3ids h GLN 271 Ca 0.05 -0.21 -0.09 0.00 0.50 0.00 0.00 58.65 58.90 3ids h GLN 271 Cb 0.15 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.50 3ids h GLN 271 CO 0.00 0.92 -0.14 1.49 -1.50 0.00 0.00 178.83 179.60 3ids h GLU 272 N 1.06 0.72 -0.30 1.46 4.81 -1.80 -1.76 114.58 118.77 3ids h GLU 272 Ca 0.24 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 3ids h GLU 272 Cb 0.24 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3ids h GLU 272 CO -0.02 0.90 0.15 0.82 -0.73 0.00 0.00 179.01 180.13 3ids h ILE 273 N 0.50 1.15 -0.59 2.32 2.04 -1.28 -1.92 117.51 119.73 3ids h ILE 273 Ca 0.08 -0.43 0.06 0.00 1.00 0.00 0.00 64.86 65.58 3ids h ILE 273 Cb 0.66 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 3ids h ILE 273 CO 0.05 0.15 0.29 -0.78 0.00 0.00 0.00 178.15 177.86 3ids h ASP 274 N 0.35 0.41 -0.67 1.72 3.58 -0.92 -1.36 116.42 119.53 3ids h ASP 274 Ca 0.10 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.51 3ids h ASP 274 Cb 0.11 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 3ids h ASP 274 CO -0.01 0.26 0.11 0.00 -2.88 0.00 0.00 179.24 176.72 3ids h ALA 275 N 1.34 0.89 -0.26 -0.78 0.00 -1.14 -2.31 119.26 117.00 3ids h ALA 275 Ca 0.27 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3ids h ALA 275 Cb 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3ids h ALA 275 CO -0.20 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.73 3ids h ALA 276 N 1.05 0.35 -0.44 0.00 0.00 -1.02 -0.40 119.26 118.79 3ids h ALA 276 Ca 0.20 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3ids h ALA 276 Cb 0.44 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3ids h ALA 276 CO 0.01 0.04 0.19 -0.07 0.00 0.00 0.00 179.25 179.43 3ids h LEU 277 N 0.24 0.26 -0.26 0.00 3.38 -1.20 0.16 115.31 117.89 3ids h LEU 277 Ca 0.08 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3ids h LEU 277 Cb 0.35 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3ids h LEU 277 CO 0.01 0.19 0.11 0.11 0.09 0.00 0.00 178.44 178.95 3ids h LYS 278 N 0.39 0.39 -0.43 1.13 1.57 -1.32 -1.37 116.57 116.93 3ids h LYS 278 Ca 0.20 -0.07 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3ids h LYS 278 Cb 0.14 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 3ids h LYS 278 CO -0.17 0.41 0.27 -0.09 -0.57 0.00 0.00 179.45 179.30 3ids h ARG 279 N 0.28 0.53 -0.54 3.15 2.43 -0.71 -2.57 114.38 116.94 3ids h ARG 279 Ca 0.09 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3ids h ARG 279 Cb 0.16 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 3ids h ARG 279 CO -0.01 0.35 0.33 0.00 -1.51 0.00 0.00 179.97 179.13 3ids h ALA 280 N 1.18 0.69 0.00 2.80 0.00 -0.53 -2.36 119.26 121.04 3ids h ALA 280 Ca 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3ids h ALA 280 Cb -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3ids h ALA 280 CO -0.06 0.18 -0.04 0.66 0.00 0.00 0.00 179.25 179.98 3ids h SER 281 N 0.73 0.00 1.20 0.00 4.64 -1.03 0.17 113.55 119.25 3ids h SER 281 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3ids h SER 281 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3ids h SER 281 CO -0.04 0.04 -0.38 0.11 -0.87 0.00 0.00 176.83 175.69 3ids h LYS 282 N 0.00 0.00 0.00 4.77 1.57 -1.04 -3.22 116.57 118.65 3ids h LYS 282 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ids h LYS 282 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3ids h LYS 282 CO 0.01 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.14 3ids n THR 283 N -2.31 0.00 0.32 -0.16 -2.24 -0.67 -4.77 114.28 104.45 3ids n THR 283 Ca 0.04 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.98 3ids n THR 283 Cb 0.45 0.00 0.65 0.00 -2.10 0.00 0.00 70.33 69.34 3ids n THR 283 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3ids h TYR 284 N 0.00 0.00 -0.68 4.78 -0.00 -1.79 -2.26 116.97 117.02 3ids h TYR 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3ids h TYR 284 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 3ids h TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 178.16 176.83 3ids n MET 285 N -2.79 2.96 -1.62 0.10 2.81 0.50 -5.00 117.12 114.07 3ids n MET 285 Ca 0.01 -2.66 -0.48 0.00 -1.81 0.00 0.00 57.70 52.75 3ids n MET 285 Cb 0.26 -1.61 -0.04 0.00 -0.71 0.00 0.00 33.22 31.11 3ids n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 3ids n LYS 286 N 1.42 1.58 0.00 0.03 4.81 -0.85 -1.11 118.16 124.04 3ids n LYS 286 Ca 0.24 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 3ids n LYS 286 Cb 0.66 -2.21 0.00 0.00 0.02 0.00 0.00 35.03 33.50 3ids n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ids n GLY 287 N 2.57 2.85 0.44 3.14 0.00 -1.26 -4.76 105.19 108.16 3ids n GLY 287 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 3ids n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ids n ILE 288 N -2.00 1.18 -3.97 -0.61 2.08 -0.26 -4.37 119.36 111.40 3ids n ILE 288 Ca 0.00 -0.02 -0.35 0.00 0.56 0.00 0.00 62.75 62.94 3ids n ILE 288 Cb 0.00 -1.90 -0.11 0.00 -0.75 0.00 0.00 39.64 36.88 3ids n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3ids s LEU 289 N -7.26 3.62 0.00 1.39 2.96 -0.44 -0.74 118.68 118.21 3ids s LEU 289 Ca -0.22 -0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 3ids s LEU 289 Cb 0.06 -1.93 0.02 0.00 0.50 0.00 0.00 46.19 44.84 3ids s LEU 289 CO 0.30 0.10 0.13 0.61 -1.32 0.00 0.00 176.35 176.16 3ids n GLY 290 N 4.04 3.33 3.18 7.98 0.00 0.67 -4.46 105.19 119.93 3ids n GLY 290 Ca -0.16 -2.34 -0.09 0.00 0.00 0.00 0.00 46.02 43.42 3ids n GLY 290 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ids s TYR 291 N -2.68 0.13 0.10 1.61 1.13 -1.26 -0.50 117.35 115.88 3ids s TYR 291 Ca 0.10 -0.47 0.09 0.00 -1.41 0.00 0.00 57.07 55.38 3ids s TYR 291 Cb -0.01 -0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.75 3ids s TYR 291 CO 0.06 -0.48 -0.22 -0.08 -2.51 0.00 0.00 175.55 172.32 3ids s THR 292 N -3.23 1.83 -0.16 -3.49 -1.32 0.22 -4.87 115.64 104.62 3ids s THR 292 Ca 0.00 -1.57 0.16 0.00 -1.21 0.00 0.00 61.69 59.08 3ids s THR 292 Cb 0.02 -1.65 0.34 0.00 -1.51 0.00 0.00 72.50 69.70 3ids s THR 292 CO -0.08 -0.01 1.17 -0.90 -2.21 0.00 0.00 174.62 172.60 3ids n ASP 293 N 1.10 2.12 -4.98 8.08 3.85 -1.26 -1.21 116.55 124.25 3ids n ASP 293 Ca -0.19 -3.38 -0.18 0.00 -0.71 0.00 0.00 54.79 50.33 3ids n ASP 293 Cb 0.53 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.84 3ids n ASP 293 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3ids s GLU 294 N -3.00 2.73 -1.35 0.11 2.02 -1.26 -4.75 118.70 113.19 3ids s GLU 294 Ca 0.34 -1.34 -0.10 0.00 0.02 0.00 0.00 54.97 53.90 3ids s GLU 294 Cb 0.31 -2.66 0.11 0.00 0.10 0.00 0.00 34.13 32.00 3ids s GLU 294 CO -0.01 -0.29 2.12 0.39 0.02 0.00 0.00 175.26 177.50 3ids n GLU 295 N -1.80 3.64 -3.44 1.61 -0.58 -1.26 -4.82 120.64 113.99 3ids n GLU 295 Ca 0.07 -3.22 -0.30 0.00 -0.42 0.00 0.00 57.16 53.29 3ids n GLU 295 Cb 0.60 -2.94 -0.04 0.00 -0.57 0.00 0.00 31.44 28.49 3ids n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3ids s LEU 296 N 0.00 4.13 0.46 -4.62 1.43 -1.26 -5.10 118.68 113.72 3ids s LEU 296 Ca 0.46 0.70 0.03 0.00 -1.03 0.00 0.00 54.13 54.29 3ids s LEU 296 Cb 0.13 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.82 3ids s LEU 296 CO -0.04 -0.12 0.02 0.68 0.23 0.00 0.00 176.35 177.13 3ids s VAL 297 N -1.94 1.32 0.25 -1.59 -7.23 -1.26 -5.04 120.40 104.91 3ids s VAL 297 Ca 0.44 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.57 3ids s VAL 297 Cb -0.11 -2.46 0.22 0.00 0.56 0.00 0.00 36.38 34.59 3ids s VAL 297 CO 0.27 0.00 1.81 0.77 -0.31 0.00 0.00 175.10 177.64 3ids h SER 298 N 1.58 0.69 -0.85 4.85 4.64 -1.97 -1.08 113.55 121.41 3ids h SER 298 Ca -0.43 0.05 0.21 0.00 -0.47 0.00 0.00 61.79 61.15 3ids h SER 298 Cb 1.28 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 63.24 3ids h SER 298 CO 0.73 0.39 0.58 0.00 -0.87 0.00 0.00 176.83 177.66 3ids h ALA 299 N 1.46 2.43 0.00 5.18 0.00 -1.97 -1.54 119.26 124.82 3ids h ALA 299 Ca 0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3ids h ALA 299 Cb 0.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ids h ALA 299 CO -0.25 -0.68 0.00 -0.25 0.00 0.00 0.00 179.25 178.07 3ids n ASP 300 N -4.42 0.54 -0.97 0.00 8.00 -0.41 -1.79 116.55 117.50 3ids n ASP 300 Ca 0.18 0.63 0.12 0.00 0.71 0.00 0.00 54.79 56.42 3ids n ASP 300 Cb 0.76 -0.74 0.21 0.00 -0.02 0.00 0.00 41.12 41.32 3ids n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ids n PHE 301 N -2.09 0.23 -1.96 1.24 3.01 -0.58 -4.91 117.46 112.40 3ids n PHE 301 Ca 0.03 -0.11 -0.42 0.00 1.01 0.00 0.00 57.45 57.96 3ids n PHE 301 Cb 0.23 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.68 3ids n PHE 301 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3ids s ILE 302 N -1.77 2.63 -0.96 4.37 1.01 -0.74 -1.80 121.20 123.94 3ids s ILE 302 Ca 0.34 0.48 0.00 0.00 0.00 0.00 0.00 60.65 61.47 3ids s ILE 302 Cb 0.21 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.37 3ids s ILE 302 CO 0.31 0.05 0.00 0.59 0.00 0.00 0.00 174.94 175.89 3ids n ASN 303 N 3.35 -4.27 -4.69 3.58 3.02 -1.26 -5.00 115.26 109.99 3ids n ASN 303 Ca 0.11 0.22 -0.42 0.00 -0.03 0.00 0.00 54.58 54.46 3ids n ASN 303 Cb 0.39 -2.57 -0.03 0.00 -0.61 0.00 0.00 39.78 36.97 3ids n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ids s ASP 304 N -2.79 7.28 0.15 6.41 -1.08 -0.74 -4.94 116.67 120.96 3ids s ASP 304 Ca 0.00 1.56 0.27 0.00 -0.52 0.00 0.00 52.55 53.86 3ids s ASP 304 Cb 0.00 -2.56 0.93 0.00 -1.46 0.00 0.00 42.92 39.84 3ids s ASP 304 CO 0.00 -0.38 1.81 0.59 0.52 0.00 0.00 175.17 177.71 3ids n ASN 305 N 4.65 0.57 -4.77 -0.34 4.13 -1.26 -3.53 115.26 114.72 3ids n ASN 305 Ca 0.08 0.56 -0.32 0.00 1.68 0.00 0.00 54.58 56.57 3ids n ASN 305 Cb 0.49 -0.71 0.06 0.00 -1.54 0.00 0.00 39.78 38.09 3ids n ASN 305 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 3ids s ARG 306 N -3.08 2.63 0.20 3.52 3.00 -1.26 -4.55 118.95 119.41 3ids s ARG 306 Ca 0.11 1.31 0.09 0.00 0.00 0.00 0.00 55.73 57.25 3ids s ARG 306 Cb 0.14 -1.93 0.09 0.00 0.00 0.00 0.00 34.95 33.25 3ids s ARG 306 CO 0.57 -1.37 1.46 0.77 0.00 0.00 0.00 175.30 176.72 3ids h SER 307 N -0.35 0.00 -2.87 0.23 0.02 -1.14 -3.38 113.55 106.05 3ids h SER 307 Ca -0.46 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.41 3ids h SER 307 Cb 1.24 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 63.52 3ids h SER 307 CO 0.53 0.79 -0.28 -0.55 -1.14 0.00 0.00 176.83 176.19 3ids s SER 308 N -6.78 -0.50 -0.32 3.07 0.15 -0.89 -3.61 113.70 104.82 3ids s SER 308 Ca -0.00 1.03 0.03 0.00 0.70 0.00 0.00 55.95 57.71 3ids s SER 308 Cb 0.11 1.13 0.09 0.00 -1.71 0.00 0.00 66.02 65.64 3ids s SER 308 CO 0.79 -0.21 0.01 -0.63 1.20 0.00 0.00 173.24 174.40 3ids s ILE 309 N 1.95 2.31 0.15 6.45 1.09 0.34 -0.24 121.20 133.26 3ids s ILE 309 Ca -0.07 -2.12 -0.31 0.00 -1.10 0.00 0.00 60.65 57.06 3ids s ILE 309 Cb -0.10 -2.61 -0.08 0.00 -1.06 0.00 0.00 42.46 38.62 3ids s ILE 309 CO -0.14 -0.44 1.36 -0.47 -0.10 0.00 0.00 174.94 175.16 3ids s TYR 310 N 0.97 3.24 -0.69 3.97 5.04 0.35 -0.77 117.35 129.46 3ids s TYR 310 Ca 0.05 1.05 -0.15 0.00 -2.44 0.00 0.00 57.07 55.58 3ids s TYR 310 Cb -0.19 -3.66 0.17 0.00 0.35 0.00 0.00 41.96 38.63 3ids s TYR 310 CO -0.07 -2.21 0.66 0.34 -1.34 0.00 0.00 175.55 172.93 3ids s ASP 311 N 0.81 6.48 0.09 4.32 -1.08 0.01 -0.61 116.67 126.70 3ids s ASP 311 Ca 0.62 -2.22 -0.19 0.00 -0.52 0.00 0.00 52.55 50.24 3ids s ASP 311 Cb -0.37 -2.22 -0.08 0.00 -1.46 0.00 0.00 42.92 38.79 3ids s ASP 311 CO 0.33 -0.74 1.59 -1.28 0.52 0.00 0.00 175.17 175.59 3ids h SER 312 N 8.36 0.33 -0.19 -0.34 0.87 -1.45 -1.62 113.55 119.51 3ids h SER 312 Ca -0.09 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 3ids h SER 312 Cb 1.07 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 3ids h SER 312 CO 0.91 0.47 0.13 0.11 -0.53 0.00 0.00 176.83 177.91 3ids h LYS 313 N 0.18 0.26 -0.53 2.24 1.79 -1.86 0.64 116.57 119.30 3ids h LYS 313 Ca 0.07 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.48 3ids h LYS 313 Cb 0.26 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 3ids h LYS 313 CO -0.00 0.18 0.16 0.00 -1.08 0.00 0.00 179.45 178.71 3ids h ALA 314 N 1.06 1.30 0.13 3.86 0.00 -1.91 -1.83 119.26 121.88 3ids h ALA 314 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ids h ALA 314 Cb -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3ids h ALA 314 CO -0.01 0.50 -0.06 1.15 0.00 0.00 0.00 179.25 180.83 3ids h THR 315 N 0.76 1.03 -0.55 0.00 2.02 -1.05 -3.12 112.91 112.02 3ids h THR 315 Ca 0.18 -1.07 -0.03 0.00 0.77 0.00 0.00 66.41 66.26 3ids h THR 315 Cb 0.23 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 3ids h THR 315 CO -0.01 0.24 0.22 -0.07 0.37 0.00 0.00 175.52 176.27 3ids h LEU 316 N -0.72 0.72 -0.41 2.58 3.38 -0.82 -2.93 115.31 117.11 3ids h LEU 316 Ca -0.02 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3ids h LEU 316 Cb 0.52 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 3ids h LEU 316 CO 0.03 0.65 -0.02 1.56 0.09 0.00 0.00 178.44 180.74 3ids h GLN 317 N 0.78 0.00 -0.04 1.13 4.20 -1.43 -3.35 115.11 116.40 3ids h GLN 317 Ca 0.19 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 3ids h GLN 317 Cb 0.15 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3ids h GLN 317 CO -0.02 0.02 -0.16 0.09 -0.67 0.00 0.00 178.83 178.10 3ids n ASN 318 N -3.11 2.29 -4.82 1.46 3.02 -1.11 -5.00 115.26 108.00 3ids n ASN 318 Ca 0.03 -3.37 -0.22 0.00 -0.03 0.00 0.00 54.58 50.99 3ids n ASN 318 Cb 0.48 -0.48 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 3ids n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3ids s ASN 319 N -2.89 5.31 0.03 6.41 0.01 -1.21 -4.87 114.94 117.73 3ids s ASN 319 Ca 0.35 -0.42 -0.30 0.00 -0.71 0.00 0.00 52.86 51.78 3ids s ASN 319 Cb 0.32 -1.13 -0.05 0.00 0.41 0.00 0.00 41.25 40.80 3ids s ASN 319 CO 0.00 -0.20 1.18 -0.76 -1.51 0.00 0.00 177.10 175.81 3ids s LEU 320 N -3.90 4.35 -0.01 0.60 1.43 -1.26 -4.96 118.68 114.93 3ids s LEU 320 Ca 0.37 1.94 -0.38 0.00 -1.03 0.00 0.00 54.13 55.03 3ids s LEU 320 Cb -0.06 -3.57 -0.16 0.00 0.03 0.00 0.00 46.19 42.42 3ids s LEU 320 CO 0.25 -0.47 1.46 -2.65 0.23 0.00 0.00 176.35 175.17 3ids n PRO 321 N 4.17 1.19 -1.00 1.29 -0.02 -1.26 -2.38 135.00 136.99 3ids n PRO 321 Ca 0.09 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3ids n PRO 321 Cb 0.47 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3ids n PRO 321 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3ids n LYS 322 N 3.34 -0.95 -2.13 -0.52 5.02 -1.26 -4.96 118.16 116.69 3ids n LYS 322 Ca 0.20 0.24 -0.39 0.00 -2.02 0.00 0.00 58.31 56.34 3ids n LYS 322 Cb 0.18 -3.96 -0.01 0.00 -0.02 0.00 0.00 35.03 31.22 3ids n LYS 322 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3ids s GLU 323 N -0.96 4.08 -0.01 1.97 2.56 -1.00 -4.95 118.70 120.39 3ids s GLU 323 Ca 0.00 2.09 0.10 0.00 0.00 0.00 0.00 54.97 57.16 3ids s GLU 323 Cb 0.00 -2.81 -0.15 0.00 2.00 0.00 0.00 34.13 33.17 3ids s GLU 323 CO 0.00 -0.38 0.30 0.54 -0.56 0.00 0.00 175.26 175.16 3ids n ARG 324 N 0.28 1.42 0.00 4.30 1.74 -1.26 -4.45 116.66 118.68 3ids n ARG 324 Ca 0.03 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 3ids n ARG 324 Cb 0.44 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 3ids n ARG 324 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3ids n ARG 325 N -1.66 0.89 -3.72 5.56 5.12 -1.26 -1.50 116.66 120.10 3ids n ARG 325 Ca -0.01 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.53 3ids n ARG 325 Cb 0.24 -0.68 -0.12 0.00 -1.16 0.00 0.00 32.46 30.74 3ids n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 3ids s PHE 326 N -1.35 3.22 0.06 -1.55 5.36 -1.26 0.00 117.98 122.46 3ids s PHE 326 Ca 0.00 -1.20 0.02 0.00 -0.96 0.00 0.00 56.93 54.79 3ids s PHE 326 Cb 0.00 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.35 3ids s PHE 326 CO 0.00 -0.67 -0.07 -0.06 -1.46 0.00 0.00 175.22 172.96 3ids s PHE 327 N 1.46 0.71 -0.10 10.12 0.08 0.34 -4.78 117.98 125.82 3ids s PHE 327 Ca 0.00 -0.63 0.01 0.00 0.12 0.00 0.00 56.93 56.43 3ids s PHE 327 Cb -0.19 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 41.82 3ids s PHE 327 CO 0.04 -0.11 -0.13 0.21 -0.10 0.00 0.00 175.22 175.12 3ids s LYS 328 N -2.26 3.09 -0.10 0.44 2.20 -1.26 -0.91 119.74 120.95 3ids s LYS 328 Ca -0.04 -0.68 0.03 0.00 -0.36 0.00 0.00 55.97 54.92 3ids s LYS 328 Cb -0.05 -2.55 0.01 0.00 -1.51 0.00 0.00 37.83 33.72 3ids s LYS 328 CO -0.01 0.36 -0.20 0.42 -0.36 0.00 0.00 175.35 175.55 3ids s ILE 329 N -0.03 1.80 -0.20 5.43 1.01 0.16 -4.85 121.20 124.53 3ids s ILE 329 Ca -0.03 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.69 3ids s ILE 329 Cb -0.14 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 3ids s ILE 329 CO 0.04 0.50 0.05 -0.69 0.00 0.00 0.00 174.94 174.84 3ids s VAL 330 N 0.52 4.48 -0.08 2.92 1.01 -1.26 -0.96 120.40 127.03 3ids s VAL 330 Ca -0.16 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 3ids s VAL 330 Cb -0.17 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.20 3ids s VAL 330 CO 0.06 0.43 0.19 -0.55 0.00 0.00 0.00 175.10 175.23 3ids s SER 331 N 0.74 -0.19 0.33 3.32 0.15 -0.31 -0.81 113.70 116.92 3ids s SER 331 Ca 0.02 0.39 0.03 0.00 0.70 0.00 0.00 55.95 57.10 3ids s SER 331 Cb -0.14 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 64.51 3ids s SER 331 CO 0.02 -0.10 0.50 0.26 1.20 0.00 0.00 173.24 175.12 3ids s TRP 332 N 0.52 3.34 -0.26 3.44 0.52 0.05 0.70 118.94 127.24 3ids s TRP 332 Ca -0.03 0.08 -0.21 0.00 0.02 0.00 0.00 56.10 55.96 3ids s TRP 332 Cb -0.05 -1.90 0.07 0.00 -1.15 0.00 0.00 33.47 30.44 3ids s TRP 332 CO -0.03 0.10 0.68 1.52 0.02 0.00 0.00 176.95 179.24 3ids s TYR 333 N -2.23 -0.86 -0.61 -1.98 1.13 -0.22 -0.51 117.35 112.09 3ids s TYR 333 Ca 0.41 1.93 -0.28 0.00 -1.41 0.00 0.00 57.07 57.72 3ids s TYR 333 Cb -0.09 0.38 0.03 0.00 -1.10 0.00 0.00 41.96 41.17 3ids s TYR 333 CO 0.33 -0.42 1.27 0.34 -2.51 0.00 0.00 175.55 174.56 3ids s ASP 334 N 0.81 6.31 0.52 -0.18 -1.08 -1.26 -0.50 116.67 121.29 3ids s ASP 334 Ca -0.04 0.05 0.26 0.00 -0.52 0.00 0.00 52.55 52.30 3ids s ASP 334 Cb -0.05 -2.55 1.43 0.00 -1.46 0.00 0.00 42.92 40.29 3ids s ASP 334 CO -0.06 -1.61 2.08 -0.55 0.52 0.00 0.00 175.17 175.55 3ids h ASN 335 N 10.03 0.00 0.08 -0.34 -1.07 -1.90 -2.46 115.58 119.92 3ids h ASN 335 Ca -0.26 0.00 -0.19 0.00 0.07 0.00 0.00 56.30 55.92 3ids h ASN 335 Cb 1.06 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.31 3ids h ASN 335 CO 1.20 0.12 -0.95 -0.33 0.07 0.00 0.00 177.43 177.54 3ids h GLU 336 N 0.00 0.17 0.06 4.14 5.08 -1.98 -3.40 114.58 118.66 3ids h GLU 336 Ca -0.00 -0.30 -0.14 0.00 -1.00 0.00 0.00 59.36 57.93 3ids h GLU 336 Cb 0.30 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 3ids h GLU 336 CO 0.01 1.14 -0.67 2.35 -1.00 0.00 0.00 179.01 180.85 3ids h TRP 337 N -0.56 0.22 -0.29 4.33 2.91 -1.76 -2.75 115.95 118.05 3ids h TRP 337 Ca -0.21 -0.16 0.02 0.00 1.13 0.00 0.00 58.89 59.67 3ids h TRP 337 Cb 1.51 -0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 30.13 3ids h TRP 337 CO 0.17 1.26 0.13 0.78 -1.03 0.00 0.00 178.44 179.75 3ids h GLY 338 N -0.64 0.37 0.93 2.65 0.00 -1.53 -2.62 103.07 102.24 3ids h GLY 338 Ca -0.15 -0.09 0.02 0.00 0.00 0.00 0.00 47.33 47.12 3ids h GLY 338 CO 0.02 0.07 0.53 -1.82 0.00 0.00 0.00 176.54 175.33 3ids h TYR 339 N 0.28 1.00 -0.60 5.60 5.03 -1.75 -2.04 116.97 124.49 3ids h TYR 339 Ca 0.12 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.50 3ids h TYR 339 Cb 0.06 -0.33 -0.05 0.00 1.55 0.00 0.00 36.73 37.96 3ids h TYR 339 CO -0.11 0.60 0.33 0.77 -1.32 0.00 0.00 178.16 178.43 3ids h SER 340 N 1.05 0.50 -0.14 -2.11 0.02 -1.23 -0.83 113.55 110.82 3ids h SER 340 Ca 0.31 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.22 3ids h SER 340 Cb -0.05 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 3ids h SER 340 CO -0.09 0.34 -0.10 0.45 -1.14 0.00 0.00 176.83 176.28 3ids h HIS 341 N 0.63 0.50 -0.59 3.45 3.86 -1.17 -2.90 115.15 118.93 3ids h HIS 341 Ca 0.26 -0.07 -0.10 0.00 -1.16 0.00 0.00 60.37 59.30 3ids h HIS 341 Cb 0.13 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 3ids h HIS 341 CO -0.08 0.57 -0.03 0.00 0.86 0.00 0.00 177.93 179.25 3ids h ARG 342 N 0.44 1.06 -0.52 2.45 2.47 -0.61 0.70 114.38 120.36 3ids h ARG 342 Ca 0.09 -0.35 0.06 0.00 -1.26 0.00 0.00 59.98 58.51 3ids h ARG 342 Cb 0.45 -0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 28.63 3ids h ARG 342 CO 0.02 1.05 0.24 0.28 0.56 0.00 0.00 179.97 182.13 3ids h VAL 343 N 0.96 0.91 -0.49 2.04 2.07 -1.04 0.80 116.25 121.49 3ids h VAL 343 Ca 0.17 -0.16 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 3ids h VAL 343 Cb 0.59 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3ids h VAL 343 CO 0.04 0.09 0.02 0.58 0.02 0.00 0.00 177.57 178.31 3ids h VAL 344 N 0.47 1.26 -0.53 2.57 2.07 -1.31 -2.21 116.25 118.56 3ids h VAL 344 Ca 0.24 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.73 3ids h VAL 344 Cb 0.19 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3ids h VAL 344 CO -0.19 0.37 0.35 0.44 0.02 0.00 0.00 177.57 178.55 3ids h ASP 345 N 0.72 0.59 -0.19 0.57 3.32 -0.37 -1.67 116.42 119.39 3ids h ASP 345 Ca 0.14 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3ids h ASP 345 Cb 0.49 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 3ids h ASP 345 CO 0.02 0.43 0.11 0.25 -1.72 0.00 0.00 179.24 178.33 3ids h LEU 346 N 0.71 0.24 -0.44 1.55 5.85 -0.74 -0.10 115.31 122.38 3ids h LEU 346 Ca 0.20 -0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.93 3ids h LEU 346 Cb -0.06 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.83 3ids h LEU 346 CO -0.05 0.24 -0.02 0.58 -0.34 0.00 0.00 178.44 178.85 3ids h VAL 347 N 0.21 0.64 -0.93 1.05 2.07 -1.23 0.10 116.25 118.17 3ids h VAL 347 Ca 0.07 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 3ids h VAL 347 Cb 0.05 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 3ids h VAL 347 CO -0.01 0.02 0.57 0.03 0.02 0.00 0.00 177.57 178.19 3ids h ARG 348 N 0.09 1.25 -0.11 1.57 3.08 -1.00 0.27 114.38 119.52 3ids h ARG 348 Ca 0.22 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 3ids h ARG 348 Cb 0.32 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 3ids h ARG 348 CO -0.38 0.87 0.01 1.25 -1.07 0.00 0.00 179.97 180.65 3ids h HIS 349 N 1.28 0.20 -0.79 3.04 2.76 -0.30 -2.07 115.15 119.25 3ids h HIS 349 Ca 0.33 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.47 3ids h HIS 349 Cb -0.07 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 28.80 3ids h HIS 349 CO 0.00 0.40 0.49 0.52 -1.30 0.00 0.00 177.93 178.05 3ids h MET 350 N -0.06 1.07 0.22 5.26 2.86 -0.63 -1.93 114.93 121.72 3ids h MET 350 Ca 0.03 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3ids h MET 350 Cb 0.31 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 3ids h MET 350 CO 0.00 0.74 -0.46 0.00 1.06 0.00 0.00 176.91 178.25 3ids h ALA 351 N 1.27 -0.90 -0.27 6.32 0.00 -0.86 0.11 119.26 124.93 3ids h ALA 351 Ca 0.29 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3ids h ALA 351 Cb -0.07 0.74 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3ids h ALA 351 CO -0.06 -1.06 -0.04 0.66 0.00 0.00 0.00 179.25 178.75 3ids h SER 352 N -0.76 0.38 -0.24 0.00 4.64 -1.21 0.34 113.55 116.70 3ids h SER 352 Ca -0.01 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.15 3ids h SER 352 Cb 0.74 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3ids h SER 352 CO -0.20 0.47 -0.20 0.11 -0.87 0.00 0.00 176.83 176.14 3ids h LYS 353 N 0.39 0.57 -0.66 4.77 1.79 -1.22 -1.89 116.57 120.32 3ids h LYS 353 Ca 0.09 -0.29 0.04 0.00 -2.18 0.00 0.00 60.65 58.31 3ids h LYS 353 Cb 0.32 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.93 3ids h LYS 353 CO 0.01 0.87 0.39 -0.44 -1.08 0.00 0.00 179.45 179.20 3ids h ASP 354 N 0.28 0.61 -0.31 0.86 3.32 -0.17 0.60 116.42 121.61 3ids h ASP 354 Ca 0.04 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.15 3ids h ASP 354 Cb 0.75 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.15 3ids h ASP 354 CO 0.05 0.41 0.08 0.03 -1.72 0.00 0.00 179.24 178.09 3ids h ARG 355 N 0.74 0.19 -0.44 3.56 3.08 -0.91 -1.73 114.38 118.87 3ids h ARG 355 Ca 0.28 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.19 3ids h ARG 355 Cb 0.10 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 3ids h ARG 355 CO -0.14 0.12 -0.23 0.77 -1.07 0.00 0.00 179.97 179.43 3ids h SER 356 N 0.19 0.93 0.68 7.04 0.02 -0.91 -2.63 113.55 118.87 3ids h SER 356 Ca 0.14 -0.35 -0.08 0.00 -0.84 0.00 0.00 61.79 60.66 3ids h SER 356 Cb 0.14 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 3ids h SER 356 CO -0.17 1.12 -0.38 0.00 -1.14 0.00 0.00 176.83 176.25 3ids h ALA 357 N 0.95 1.09 -0.00 3.77 0.00 -0.79 -2.60 119.26 121.68 3ids h ALA 357 Ca 0.10 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 3ids h ALA 357 Cb 0.78 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3ids h ALA 357 CO 0.06 0.48 -0.79 0.07 0.00 0.00 0.00 179.25 179.07 3ids h ARG 358 N 0.00 0.01 0.00 0.00 0.11 -1.23 -3.51 114.38 109.76 3ids h ARG 358 Ca -0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 3ids h ARG 358 Cb 0.83 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.91 3ids h ARG 358 CO 0.05 0.80 0.00 1.47 0.10 0.00 0.00 179.97 182.39