#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m61 s ILE 17 N 0.00 4.86 0.00 1.39 -1.09 0.16 -4.15 121.20 122.37 3m61 s ILE 17 Ca 0.00 2.00 0.00 0.00 -2.23 0.00 0.00 60.65 60.42 3m61 s ILE 17 Cb 0.00 -4.29 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 3m61 s ILE 17 CO 0.00 0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.45 3m61 n GLY 18 N 2.98 -0.16 7.00 6.18 0.00 -1.26 -2.20 105.19 117.72 3m61 n GLY 18 Ca 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3m61 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m61 n GLY 19 N 0.00 0.49 3.08 -0.02 0.00 -1.26 -4.91 105.19 102.57 3m61 n GLY 19 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 3m61 n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3m61 s GLU 20 N 0.00 0.45 0.53 1.61 -1.05 0.44 -5.00 118.70 115.68 3m61 s GLU 20 Ca 0.00 -0.45 -0.20 0.00 -0.15 0.00 0.00 54.97 54.17 3m61 s GLU 20 Cb 0.00 0.18 -0.06 0.00 -0.44 0.00 0.00 34.13 33.81 3m61 s GLU 20 CO 0.00 -0.10 1.10 -0.06 0.95 0.00 0.00 175.26 177.15 3m61 s PHE 21 N -1.42 2.76 0.30 4.83 0.40 -1.26 -0.99 117.98 122.61 3m61 s PHE 21 Ca -0.15 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 57.73 3m61 s PHE 21 Cb -0.08 -3.22 -0.02 0.00 0.51 0.00 0.00 43.02 40.21 3m61 s PHE 21 CO 0.01 -1.36 0.34 -0.08 0.70 0.00 0.00 175.22 174.83 3m61 s THR 22 N -1.85 0.00 0.36 0.64 -1.32 -0.36 -4.81 115.64 108.31 3m61 s THR 22 Ca 0.71 -1.80 0.04 0.00 -1.21 0.00 0.00 61.69 59.43 3m61 s THR 22 Cb -0.22 -2.53 -0.06 0.00 -1.51 0.00 0.00 72.50 68.19 3m61 s THR 22 CO 0.25 0.00 0.05 0.42 -2.21 0.00 0.00 174.62 173.13 3m61 s THR 23 N -3.50 1.33 0.26 5.08 -4.23 -1.26 -4.10 115.64 109.23 3m61 s THR 23 Ca 0.35 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.13 3m61 s THR 23 Cb 0.02 -2.78 0.28 0.00 1.34 0.00 0.00 72.50 71.36 3m61 s THR 23 CO 0.20 0.00 1.96 -0.29 -0.54 0.00 0.00 174.62 175.95 3m61 h ILE 24 N 1.97 0.49 -0.38 2.99 6.09 -1.89 -1.93 117.51 124.84 3m61 h ILE 24 Ca -0.41 -0.79 0.11 0.00 -1.37 0.00 0.00 64.86 62.39 3m61 h ILE 24 Cb 1.25 1.55 -0.02 0.00 0.47 0.00 0.00 36.82 40.07 3m61 h ILE 24 CO 0.72 0.15 0.33 -0.33 -3.07 0.00 0.00 178.15 175.95 3m61 h GLU 25 N 0.00 0.00 -0.00 2.19 3.07 -1.86 -1.13 114.58 116.85 3m61 h GLU 25 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3m61 h GLU 25 Cb 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 3m61 h GLU 25 CO 0.02 0.00 -0.47 0.09 -1.40 0.00 0.00 179.01 177.25 3m61 n ASN 26 N -4.04 0.53 -2.97 1.42 3.02 -0.73 -4.40 115.26 108.09 3m61 n ASN 26 Ca 0.06 -0.29 -0.15 0.00 -0.03 0.00 0.00 54.58 54.18 3m61 n ASN 26 Cb 0.51 0.23 0.01 0.00 -0.61 0.00 0.00 39.78 39.92 3m61 n ASN 26 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3m61 n GLN 27 N -1.43 0.90 0.00 3.52 -0.06 -0.53 -5.03 117.38 114.74 3m61 n GLN 27 Ca 0.06 -2.60 0.14 0.00 -2.00 0.00 0.00 57.00 52.60 3m61 n GLN 27 Cb 0.34 -1.36 0.83 0.00 -4.06 0.00 0.00 30.24 25.98 3m61 n GLN 27 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 3m61 n PRO 28 N 0.80 0.84 0.00 3.69 -0.04 -0.59 -0.96 135.00 138.73 3m61 n PRO 28 Ca 0.16 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.75 3m61 n PRO 28 Cb 0.64 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.96 3m61 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3m61 n TRP 29 N -1.03 0.00 -2.19 0.54 2.14 -1.17 -1.39 117.44 114.34 3m61 n TRP 29 Ca 0.20 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.35 3m61 n TRP 29 Cb 0.11 -0.11 -0.03 0.00 -0.81 0.00 0.00 31.31 30.47 3m61 n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 3m61 s PHE 30 N -2.48 3.21 -0.11 -2.67 2.19 -0.14 -0.34 117.98 117.65 3m61 s PHE 30 Ca 0.24 0.96 0.00 0.00 0.33 0.00 0.00 56.93 58.47 3m61 s PHE 30 Cb 0.19 -3.66 -0.02 0.00 -1.31 0.00 0.00 43.02 38.22 3m61 s PHE 30 CO 0.52 -2.33 -0.11 0.00 1.83 0.00 0.00 175.22 175.12 3m61 s ALA 31 N 1.23 2.72 -0.32 11.12 0.00 -0.05 -4.36 121.76 132.09 3m61 s ALA 31 Ca 0.64 -0.90 -0.12 0.00 0.00 0.00 0.00 51.96 51.58 3m61 s ALA 31 Cb -0.36 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 3m61 s ALA 31 CO 0.30 0.36 0.23 0.00 0.00 0.00 0.00 175.76 176.64 3m61 s ALA 32 N -0.06 3.51 -0.16 0.00 0.00 -0.40 -1.36 121.76 123.29 3m61 s ALA 32 Ca -0.02 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 3m61 s ALA 32 Cb -0.14 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.35 3m61 s ALA 32 CO 0.04 -0.85 -0.05 0.42 0.00 0.00 0.00 175.76 175.32 3m61 s ILE 33 N 1.73 3.66 0.21 0.00 1.01 -0.50 -0.71 121.20 126.60 3m61 s ILE 33 Ca 0.06 -0.43 0.09 0.00 0.00 0.00 0.00 60.65 60.37 3m61 s ILE 33 Cb -0.17 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 3m61 s ILE 33 CO 0.11 0.48 -0.17 -0.31 0.00 0.00 0.00 174.94 175.05 3m61 s TYR 34 N 0.57 1.86 -0.06 3.97 2.02 0.31 -0.62 117.35 125.41 3m61 s TYR 34 Ca -0.04 -0.50 0.05 0.00 -0.37 0.00 0.00 57.07 56.21 3m61 s TYR 34 Cb -0.15 -0.86 -0.00 0.00 -0.40 0.00 0.00 41.96 40.55 3m61 s TYR 34 CO 0.03 0.42 -0.21 0.50 -1.57 0.00 0.00 175.55 174.73 3m61 s ARG 35 N -3.39 2.20 0.04 -0.62 3.52 0.60 -1.33 118.95 119.96 3m61 s ARG 35 Ca 0.22 -0.74 -0.25 0.00 -0.13 0.00 0.00 55.73 54.83 3m61 s ARG 35 Cb -0.03 -1.85 -0.05 0.00 -1.56 0.00 0.00 34.95 31.46 3m61 s ARG 35 CO 0.08 0.27 0.78 1.03 -0.81 0.00 0.00 175.30 176.66 3m61 s ARG 36 N 0.03 4.51 0.06 5.12 0.52 0.12 -1.65 118.95 127.66 3m61 s ARG 36 Ca -0.06 1.09 -0.01 0.00 -0.52 0.00 0.00 55.73 56.23 3m61 s ARG 36 Cb -0.13 -3.37 -0.04 0.00 0.52 0.00 0.00 34.95 31.92 3m61 s ARG 36 CO 0.04 0.25 0.22 -1.01 0.02 0.00 0.00 175.30 174.81 3m61 s HIS 37 N 0.06 3.52 -0.30 -0.53 3.76 0.23 -4.86 115.29 117.16 3m61 s HIS 37 Ca 0.39 0.29 -0.24 0.00 -0.15 0.00 0.00 55.06 55.36 3m61 s HIS 37 Cb -0.20 -1.79 -0.27 0.00 1.11 0.00 0.00 32.58 31.42 3m61 s HIS 37 CO 0.23 0.58 1.57 2.89 -0.85 0.00 0.00 174.74 179.16 3m61 n ARG 37 N 0.37 0.03 0.00 1.40 0.00 -1.26 -3.41 116.66 113.78 3m61 n ARG 37 Ca -0.06 -1.01 0.13 0.00 -0.00 0.00 0.00 57.85 56.91 3m61 n ARG 37 Cb 0.51 -2.63 0.45 0.00 -0.00 0.00 0.00 32.46 30.79 3m61 n ARG 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3m61 n GLY 37 N 5.10 -1.18 3.71 2.89 0.00 -1.26 -5.15 105.19 109.31 3m61 n GLY 37 Ca 0.37 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3m61 n GLY 37 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3m61 s SER 37 N -2.82 6.58 -0.11 1.61 0.15 -1.22 -5.00 113.70 112.89 3m61 s SER 37 Ca 0.17 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.44 3m61 s SER 37 Cb 0.19 -2.59 -0.02 0.00 -1.71 0.00 0.00 66.02 61.89 3m61 s SER 37 CO 0.58 -0.84 -0.11 0.68 1.20 0.00 0.00 173.24 174.76 3m61 s VAL 38 N 1.36 3.31 0.06 4.45 -7.23 -1.26 0.76 120.40 121.86 3m61 s VAL 38 Ca 0.71 -0.59 0.04 0.00 -1.81 0.00 0.00 61.98 60.33 3m61 s VAL 38 Cb -0.43 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.10 3m61 s VAL 38 CO 0.31 0.55 -0.13 0.42 -0.31 0.00 0.00 175.10 175.94 3m61 s THR 39 N -0.08 0.98 0.33 5.32 -4.23 -0.66 -4.95 115.64 112.35 3m61 s THR 39 Ca -0.01 -1.20 -0.29 0.00 -1.18 0.00 0.00 61.69 59.02 3m61 s THR 39 Cb -0.14 -0.95 -0.10 0.00 1.34 0.00 0.00 72.50 72.65 3m61 s THR 39 CO 0.03 -0.22 1.31 -0.47 -0.54 0.00 0.00 174.62 174.73 3m61 s TYR 40 N -1.21 3.06 -0.05 3.99 5.04 -1.26 -0.29 117.35 126.61 3m61 s TYR 40 Ca -0.03 1.41 -0.09 0.00 -2.44 0.00 0.00 57.07 55.91 3m61 s TYR 40 Cb -0.10 -3.68 -0.03 0.00 0.35 0.00 0.00 41.96 38.50 3m61 s TYR 40 CO 0.02 -1.87 -0.18 0.28 -1.34 0.00 0.00 175.55 172.46 3m61 n VAL 41 N 0.87 1.23 -3.53 3.14 0.31 0.21 -4.82 118.33 115.74 3m61 n VAL 41 Ca 0.00 0.26 -0.09 0.00 -0.01 0.00 0.00 64.34 64.50 3m61 n VAL 41 Cb 0.42 -1.94 -0.02 0.00 -0.91 0.00 0.00 33.84 31.39 3m61 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m61 s GLY 43 N -2.65 1.71 0.28 0.00 0.00 -0.49 -1.42 107.32 104.76 3m61 s GLY 43 Ca 0.05 -1.04 -0.20 0.00 0.00 0.00 0.00 44.72 43.53 3m61 s GLY 43 CO -0.08 -0.44 0.86 -0.32 0.00 0.00 0.00 173.10 173.11 3m61 s GLY 44 N -4.72 0.12 -0.03 0.20 0.00 -0.47 -3.82 107.32 98.61 3m61 s GLY 44 Ca 0.67 -0.43 0.02 0.00 0.00 0.00 0.00 44.72 44.98 3m61 s GLY 44 CO 0.49 0.38 -0.07 -0.56 0.00 0.00 0.00 173.10 173.35 3m61 s SER 45 N -3.09 1.01 -0.27 1.64 0.01 -0.15 -0.88 113.70 111.97 3m61 s SER 45 Ca 0.15 -0.15 -0.29 0.00 1.31 0.00 0.00 55.95 56.97 3m61 s SER 45 Cb -0.04 -0.35 0.00 0.00 0.21 0.00 0.00 66.02 65.84 3m61 s SER 45 CO 0.08 0.01 1.20 -0.22 0.41 0.00 0.00 173.24 174.72 3m61 s LEU 46 N 0.46 3.98 -0.01 2.44 2.96 0.54 -0.72 118.68 128.33 3m61 s LEU 46 Ca -0.07 1.28 0.14 0.00 -0.22 0.00 0.00 54.13 55.26 3m61 s LEU 46 Cb -0.10 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.87 3m61 s LEU 46 CO 0.00 -0.92 0.48 2.30 -1.32 0.00 0.00 176.35 176.90 3m61 n ILE 47 N 5.85 0.00 -3.85 6.68 -5.35 -0.32 -1.52 119.36 120.85 3m61 n ILE 47 Ca 0.13 -0.23 -0.07 0.00 -0.27 0.00 0.00 62.75 62.31 3m61 n ILE 47 Cb 0.46 0.69 -0.02 0.00 -1.74 0.00 0.00 39.64 39.03 3m61 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3m61 s SER 48 N -2.82 -0.26 0.45 7.28 1.04 -1.17 -4.71 113.70 113.50 3m61 s SER 48 Ca 0.01 -0.60 0.19 0.00 0.48 0.00 0.00 55.95 56.03 3m61 s SER 48 Cb 0.10 0.72 1.14 0.00 0.10 0.00 0.00 66.02 68.08 3m61 s SER 48 CO 0.58 -1.32 1.92 -0.65 0.98 0.00 0.00 173.24 174.75 3m61 h PRO 49 N 2.01 0.31 -0.14 4.02 0.11 -1.95 -2.05 132.00 134.31 3m61 h PRO 49 Ca -0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3m61 h PRO 49 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3m61 h PRO 49 CO 0.24 0.20 0.00 0.00 -0.21 0.00 0.00 178.00 178.24 3m61 s TRP 51 N -1.48 1.06 -0.08 0.00 0.52 -0.77 -0.72 118.94 117.46 3m61 s TRP 51 Ca 0.26 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 56.07 3m61 s TRP 51 Cb 0.17 -0.81 -0.02 0.00 -1.15 0.00 0.00 33.47 31.66 3m61 s TRP 51 CO 0.25 -0.20 -0.15 0.08 0.02 0.00 0.00 176.95 176.95 3m61 s VAL 52 N 0.64 2.98 -0.05 4.03 1.01 -0.20 -1.18 120.40 127.63 3m61 s VAL 52 Ca -0.11 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3m61 s VAL 52 Cb -0.14 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 3m61 s VAL 52 CO 0.02 0.57 -0.02 -0.51 0.00 0.00 0.00 175.10 175.15 3m61 s ILE 53 N -0.32 4.08 0.00 2.22 2.07 0.10 -0.69 121.20 128.65 3m61 s ILE 53 Ca 0.03 -0.45 0.00 0.00 -1.41 0.00 0.00 60.65 58.82 3m61 s ILE 53 Cb -0.13 -2.74 0.00 0.00 0.13 0.00 0.00 42.46 39.72 3m61 s ILE 53 CO 0.02 0.52 0.00 -0.24 -1.91 0.00 0.00 174.94 173.33 3m61 n SER 54 N 1.89 0.00 -4.46 4.50 2.88 -0.03 -0.98 113.62 117.42 3m61 n SER 54 Ca -0.17 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.04 3m61 n SER 54 Cb 0.53 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.86 3m61 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3m61 s ALA 55 N -1.34 2.63 0.39 -1.46 0.00 -1.26 -1.54 121.76 119.17 3m61 s ALA 55 Ca 0.00 -0.98 0.08 0.00 0.00 0.00 0.00 51.96 51.06 3m61 s ALA 55 Cb 0.00 -0.96 0.79 0.00 0.00 0.00 0.00 23.12 22.95 3m61 s ALA 55 CO 0.00 0.53 1.95 1.15 0.00 0.00 0.00 175.76 179.38 3m61 h THR 56 N 4.45 1.16 0.00 0.00 2.02 -1.74 -2.83 112.91 115.97 3m61 h THR 56 Ca -0.44 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.10 3m61 h THR 56 Cb 1.16 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3m61 h THR 56 CO 0.50 0.21 -0.02 1.12 0.37 0.00 0.00 175.52 177.71 3m61 h HIS 57 N 0.32 0.00 0.00 3.16 2.07 -1.92 -0.64 115.15 118.14 3m61 h HIS 57 Ca 0.07 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.58 3m61 h HIS 57 Cb 0.27 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.25 3m61 h HIS 57 CO 0.01 0.02 -0.05 0.00 -3.07 0.00 0.00 177.93 174.83 3m61 n PHE 59 N -3.21 0.00 -0.15 0.00 3.72 -0.30 -4.83 117.46 112.70 3m61 n PHE 59 Ca -0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.43 3m61 n PHE 59 Cb 0.27 0.00 0.33 0.00 -0.94 0.00 0.00 39.48 39.14 3m61 n PHE 59 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 3m61 h ILE 60 N 0.00 1.11 0.00 4.37 6.09 -1.52 -0.13 117.51 127.43 3m61 h ILE 60 Ca 0.00 -0.28 -0.01 0.00 -1.37 0.00 0.00 64.86 63.20 3m61 h ILE 60 Cb 0.00 0.23 -0.00 0.00 0.47 0.00 0.00 36.82 37.51 3m61 h ILE 60 CO 0.00 0.15 -0.05 0.44 -3.07 0.00 0.00 178.15 175.61 3m61 h ASP 60 N 0.81 0.00 -2.14 2.19 5.19 -1.88 -3.38 116.42 117.22 3m61 h ASP 60 Ca 0.26 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 56.10 3m61 h ASP 60 Cb 0.04 0.00 -0.39 0.00 0.18 0.00 0.00 39.33 39.16 3m61 h ASP 60 CO -0.07 0.05 -1.04 -1.22 -3.12 0.00 0.00 179.24 173.85 3m61 n TYR 60 N -3.13 -0.30 1.97 4.55 4.02 -0.09 -5.01 117.16 119.18 3m61 n TYR 60 Ca 0.02 -3.52 0.16 0.00 -0.01 0.00 0.00 57.90 54.55 3m61 n TYR 60 Cb 0.46 -0.18 0.93 0.00 -0.02 0.00 0.00 39.34 40.53 3m61 n TYR 60 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3m61 n PRO 60 N 1.82 1.03 -2.56 -0.72 -0.05 -1.04 -4.83 135.00 128.65 3m61 n PRO 60 Ca 0.24 -0.04 -0.43 0.00 -0.05 0.00 0.00 63.50 63.22 3m61 n PRO 60 Cb 0.51 -1.50 -0.02 0.00 -0.05 0.00 0.00 33.50 32.43 3m61 n PRO 60 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 175.50 175.66 3m61 s LYS 61 N -2.00 4.35 0.43 0.54 2.20 -1.26 -4.89 119.74 119.10 3m61 s LYS 61 Ca 0.47 1.53 0.12 0.00 -0.36 0.00 0.00 55.97 57.73 3m61 s LYS 61 Cb 0.22 -3.59 0.95 0.00 -1.51 0.00 0.00 37.83 33.89 3m61 s LYS 61 CO 0.37 -0.46 2.00 1.57 -0.36 0.00 0.00 175.35 178.47 3m61 h LYS 62 N 7.43 0.18 0.00 4.03 2.10 -1.88 -2.81 116.57 125.63 3m61 h LYS 62 Ca -0.30 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 3m61 h LYS 62 Cb 1.13 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.43 3m61 h LYS 62 CO 0.90 0.25 0.00 0.39 -2.00 0.00 0.00 179.45 178.99 3m61 n GLU 62 N -4.37 0.12 0.11 0.07 -0.58 -1.26 -2.49 120.64 112.24 3m61 n GLU 62 Ca -0.01 0.43 0.13 0.00 -0.42 0.00 0.00 57.16 57.28 3m61 n GLU 62 Cb 0.20 -1.75 0.43 0.00 -0.57 0.00 0.00 31.44 29.75 3m61 n GLU 62 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3m61 n ASP 63 N -1.98 0.77 -4.69 1.62 8.00 -1.06 -4.92 116.55 114.30 3m61 n ASP 63 Ca 0.02 0.61 -0.29 0.00 0.71 0.00 0.00 54.79 55.83 3m61 n ASP 63 Cb 0.16 -0.80 -0.08 0.00 -0.02 0.00 0.00 41.12 40.37 3m61 n ASP 63 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3m61 s TYR 64 N -3.17 2.97 -0.03 1.24 1.51 -1.04 0.14 117.35 118.97 3m61 s TYR 64 Ca 0.09 -0.04 0.03 0.00 -1.01 0.00 0.00 57.07 56.13 3m61 s TYR 64 Cb 0.11 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.46 3m61 s TYR 64 CO 0.53 0.49 -0.11 0.42 -1.11 0.00 0.00 175.55 175.77 3m61 s ILE 65 N -1.40 0.95 -0.13 2.71 1.01 -0.44 -4.15 121.20 119.75 3m61 s ILE 65 Ca 0.26 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3m61 s ILE 65 Cb -0.11 -0.84 -0.01 0.00 0.01 0.00 0.00 42.46 41.51 3m61 s ILE 65 CO 0.19 0.29 -0.17 -0.69 0.00 0.00 0.00 174.94 174.55 3m61 s VAL 66 N 0.23 2.60 -0.04 2.92 1.01 -0.52 -0.53 120.40 126.08 3m61 s VAL 66 Ca -0.05 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.13 3m61 s VAL 66 Cb -0.10 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3m61 s VAL 66 CO 0.01 0.53 -0.04 -0.31 0.00 0.00 0.00 175.10 175.29 3m61 s TYR 67 N 0.50 2.98 0.14 5.22 2.02 0.11 -0.33 117.35 128.00 3m61 s TYR 67 Ca -0.12 0.04 0.10 0.00 -0.37 0.00 0.00 57.07 56.73 3m61 s TYR 67 Cb -0.16 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.67 3m61 s TYR 67 CO 0.05 0.39 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.69 3m61 s LEU 68 N -1.16 2.54 -0.88 -1.29 1.43 -0.26 -1.28 118.68 117.78 3m61 s LEU 68 Ca 0.15 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 3m61 s LEU 68 Cb -0.11 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.75 3m61 s LEU 68 CO 0.05 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.40 3m61 n GLY 69 N 0.65 0.17 3.45 -3.19 0.00 -1.25 -1.03 105.19 103.99 3m61 n GLY 69 Ca -0.15 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 3m61 n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m61 s ARG 70 N -4.20 3.62 -0.02 1.61 3.52 -1.26 -4.07 118.95 118.15 3m61 s ARG 70 Ca 0.00 -0.53 0.19 0.00 -0.13 0.00 0.00 55.73 55.25 3m61 s ARG 70 Cb 0.00 -3.00 -0.25 0.00 -1.56 0.00 0.00 34.95 30.13 3m61 s ARG 70 CO 0.00 0.09 0.56 0.43 -0.81 0.00 0.00 175.30 175.57 3m61 n SER 71 N 4.00 0.76 -4.27 -2.12 7.64 -1.26 -4.70 113.62 113.68 3m61 n SER 71 Ca -0.17 -0.38 -0.25 0.00 1.01 0.00 0.00 58.87 59.08 3m61 n SER 71 Cb 0.52 1.51 -0.13 0.00 -1.01 0.00 0.00 64.21 65.10 3m61 n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3m61 s ARG 72 N -3.07 1.24 0.00 1.43 0.52 -1.26 -1.53 118.95 116.28 3m61 s ARG 72 Ca -0.01 -1.05 -0.20 0.00 -0.52 0.00 0.00 55.73 53.94 3m61 s ARG 72 Cb 0.13 -1.43 -0.21 0.00 0.52 0.00 0.00 34.95 33.95 3m61 s ARG 72 CO 0.77 0.35 1.14 1.25 0.02 0.00 0.00 175.30 178.83 3m61 h LEU 73 N 4.45 0.47 -2.82 2.53 6.46 -1.22 -3.37 115.31 121.81 3m61 h LEU 73 Ca -0.44 -0.71 -0.02 0.00 -0.12 0.00 0.00 57.88 56.58 3m61 h LEU 73 Cb 1.17 -0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 40.91 3m61 h LEU 73 CO 0.42 1.11 -0.37 0.59 -0.62 0.00 0.00 178.44 179.56 3m61 n ASN 74 N -4.32 1.56 -4.03 1.25 3.02 -1.26 -5.00 115.26 106.48 3m61 n ASN 74 Ca -0.09 -2.99 -0.12 0.00 -0.03 0.00 0.00 54.58 51.35 3m61 n ASN 74 Cb 0.59 -0.40 -0.11 0.00 -0.61 0.00 0.00 39.78 39.24 3m61 n ASN 74 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3m61 s SER 75 N -2.54 0.63 0.33 6.41 0.01 -1.26 -5.15 113.70 112.14 3m61 s SER 75 Ca 0.28 -0.52 -0.26 0.00 1.31 0.00 0.00 55.95 56.77 3m61 s SER 75 Cb 0.27 0.06 -0.10 0.00 0.21 0.00 0.00 66.02 66.46 3m61 s SER 75 CO -0.03 -0.23 0.97 0.20 0.41 0.00 0.00 173.24 174.56 3m61 s ASN 76 N -1.48 7.23 -0.10 2.44 0.01 -1.26 -4.48 114.94 117.29 3m61 s ASN 76 Ca -0.12 1.90 -0.02 0.00 -0.71 0.00 0.00 52.86 53.91 3m61 s ASN 76 Cb -0.10 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 3m61 s ASN 76 CO -0.00 -0.15 -0.02 -0.89 -1.51 0.00 0.00 177.10 174.53 3m61 s THR 77 N -1.60 4.11 0.24 1.60 2.01 -1.26 -4.96 115.64 115.77 3m61 s THR 77 Ca 0.51 -0.31 -0.31 0.00 0.31 0.00 0.00 61.69 61.89 3m61 s THR 77 Cb -0.20 -2.74 -0.12 0.00 0.01 0.00 0.00 72.50 69.45 3m61 s THR 77 CO 0.25 0.57 1.69 -1.58 -0.69 0.00 0.00 174.62 174.87 3m61 s GLN 78 N -0.53 4.12 0.00 4.92 0.74 -1.26 -2.09 119.66 125.55 3m61 s GLN 78 Ca 0.09 2.62 0.00 0.00 0.05 0.00 0.00 55.36 58.11 3m61 s GLN 78 Cb -0.12 -3.05 0.00 0.00 1.10 0.00 0.00 33.01 30.94 3m61 s GLN 78 CO 0.02 -0.73 0.00 0.41 -0.55 0.00 0.00 175.29 174.44 3m61 n GLY 79 N 3.41 0.78 3.72 2.59 0.00 -1.26 -5.02 105.19 109.41 3m61 n GLY 79 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 3m61 n GLY 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3m61 s GLU 80 N -0.66 1.62 0.00 1.61 -1.05 -0.89 -4.89 118.70 114.45 3m61 s GLU 80 Ca 0.00 1.20 0.05 0.00 -0.15 0.00 0.00 54.97 56.07 3m61 s GLU 80 Cb 0.00 -1.82 -0.01 0.00 -0.44 0.00 0.00 34.13 31.85 3m61 s GLU 80 CO 0.00 -2.10 -0.14 -1.64 0.95 0.00 0.00 175.26 172.32 3m61 s MET 81 N -4.82 1.09 -0.11 -4.83 -1.94 -0.20 -4.99 119.30 103.50 3m61 s MET 81 Ca 0.63 -0.59 0.02 0.00 -1.71 0.00 0.00 55.69 54.04 3m61 s MET 81 Cb -0.19 -1.08 -0.01 0.00 2.01 0.00 0.00 34.83 35.56 3m61 s MET 81 CO 0.57 0.29 -0.17 0.21 -0.01 0.00 0.00 175.02 175.91 3m61 s LYS 82 N -0.58 3.17 0.07 2.03 2.20 -1.26 -1.10 119.74 124.27 3m61 s LYS 82 Ca 0.04 -0.75 0.04 0.00 -0.36 0.00 0.00 55.97 54.94 3m61 s LYS 82 Cb -0.06 -2.50 -0.03 0.00 -1.51 0.00 0.00 37.83 33.73 3m61 s LYS 82 CO 0.00 0.25 -0.10 -0.06 -0.36 0.00 0.00 175.35 175.08 3m61 s PHE 83 N 0.22 0.98 0.55 4.03 0.08 0.55 -4.57 117.98 119.82 3m61 s PHE 83 Ca -0.10 -0.56 -0.02 0.00 0.12 0.00 0.00 56.93 56.37 3m61 s PHE 83 Cb -0.16 -0.55 0.02 0.00 -0.57 0.00 0.00 43.02 41.76 3m61 s PHE 83 CO 0.06 -0.01 0.81 -1.21 -0.10 0.00 0.00 175.22 174.77 3m61 s GLU 84 N -2.13 2.76 -0.39 0.44 0.41 0.42 -1.44 118.70 118.77 3m61 s GLU 84 Ca -0.01 -0.39 -0.12 0.00 -0.41 0.00 0.00 54.97 54.03 3m61 s GLU 84 Cb -0.07 -2.40 0.04 0.00 -1.78 0.00 0.00 34.13 29.91 3m61 s GLU 84 CO 0.01 -0.65 0.24 0.08 -0.49 0.00 0.00 175.26 174.45 3m61 s VAL 85 N -2.83 4.69 0.16 2.63 1.01 -1.26 -1.46 120.40 123.33 3m61 s VAL 85 Ca 0.54 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 3m61 s VAL 85 Cb -0.10 -3.66 -0.13 0.00 0.00 0.00 0.00 36.38 32.49 3m61 s VAL 85 CO 0.41 -0.30 1.39 -0.08 0.00 0.00 0.00 175.10 176.52 3m61 h GLU 86 N 8.49 0.48 -2.95 2.72 4.81 -1.20 -3.42 114.58 123.51 3m61 h GLU 86 Ca -0.26 -0.41 -0.15 0.00 -0.13 0.00 0.00 59.36 58.41 3m61 h GLU 86 Cb 1.10 0.09 -0.26 0.00 0.63 0.00 0.00 28.75 30.31 3m61 h GLU 86 CO 0.70 1.04 -0.38 -0.80 -0.73 0.00 0.00 179.01 178.85 3m61 s ASN 87 N -7.02 -0.34 -0.29 1.04 -0.87 -1.20 -4.98 114.94 101.29 3m61 s ASN 87 Ca -0.07 0.64 0.02 0.00 -1.57 0.00 0.00 52.86 51.88 3m61 s ASN 87 Cb 0.10 0.60 0.07 0.00 -0.02 0.00 0.00 41.25 42.00 3m61 s ASN 87 CO 0.86 -0.13 -0.04 -0.22 -2.57 0.00 0.00 177.10 175.00 3m61 s LEU 88 N 0.57 3.90 -0.29 0.60 2.96 -1.26 -0.93 118.68 124.23 3m61 s LEU 88 Ca -0.03 -1.54 -0.06 0.00 -0.22 0.00 0.00 54.13 52.28 3m61 s LEU 88 Cb -0.05 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 45.03 3m61 s LEU 88 CO -0.03 -0.26 0.07 -0.63 -1.32 0.00 0.00 176.35 174.17 3m61 s ILE 89 N 1.11 3.90 0.17 6.68 1.01 0.57 -4.98 121.20 129.65 3m61 s ILE 89 Ca -0.04 -0.66 0.06 0.00 0.00 0.00 0.00 60.65 60.01 3m61 s ILE 89 Cb -0.20 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 3m61 s ILE 89 CO -0.04 0.12 0.09 -0.76 0.00 0.00 0.00 174.94 174.35 3m61 s LEU 90 N 1.50 3.66 -0.06 2.97 1.43 -1.26 -0.96 118.68 125.95 3m61 s LEU 90 Ca 0.03 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.62 3m61 s LEU 90 Cb -0.17 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 3m61 s LEU 90 CO 0.02 0.08 1.12 -2.28 0.23 0.00 0.00 176.35 175.51 3m61 s HIS 91 N -1.74 3.36 0.42 0.29 5.65 -1.16 -4.91 115.29 117.20 3m61 s HIS 91 Ca 0.30 1.39 0.37 0.00 0.25 0.00 0.00 55.06 57.37 3m61 s HIS 91 Cb -0.10 -3.32 1.88 0.00 -1.18 0.00 0.00 32.58 29.86 3m61 s HIS 91 CO 0.22 -0.85 2.18 0.87 -0.65 0.00 0.00 174.74 176.51 3m61 h LYS 92 N 7.23 0.00 -0.61 2.88 1.57 -1.93 -2.19 116.57 123.51 3m61 h LYS 92 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3m61 h LYS 92 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3m61 h LYS 92 CO 0.86 0.02 0.00 -0.25 -0.57 0.00 0.00 179.45 179.51 3m61 n ASP 93 N -3.21 5.15 -4.61 0.86 8.00 -1.26 -4.97 116.55 116.50 3m61 n ASP 93 Ca -0.02 -2.65 -0.46 0.00 0.71 0.00 0.00 54.79 52.37 3m61 n ASP 93 Cb 0.18 -0.62 -0.03 0.00 -0.02 0.00 0.00 41.12 40.64 3m61 n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3m61 n TYR 94 N 0.89 1.57 -3.90 1.24 9.36 -0.83 -4.61 117.16 120.88 3m61 n TYR 94 Ca 0.27 0.62 -0.10 0.00 3.32 0.00 0.00 57.90 62.01 3m61 n TYR 94 Cb 1.02 -2.32 -0.09 0.00 -0.63 0.00 0.00 39.34 37.31 3m61 n TYR 94 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3m61 s SER 95 N -0.12 0.14 -0.15 2.98 1.04 -0.95 -4.97 113.70 111.67 3m61 s SER 95 Ca 0.66 -0.51 0.01 0.00 0.48 0.00 0.00 55.95 56.60 3m61 s SER 95 Cb -0.73 0.26 0.02 0.00 0.10 0.00 0.00 66.02 65.66 3m61 s SER 95 CO 0.55 -0.55 -0.18 0.00 0.98 0.00 0.00 173.24 174.04 3m61 s ALA 96 N -2.78 2.04 -0.35 5.32 0.00 -1.26 -1.07 121.76 123.66 3m61 s ALA 96 Ca -0.03 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.93 3m61 s ALA 96 Cb -0.00 -1.04 0.11 0.00 0.00 0.00 0.00 23.12 22.19 3m61 s ALA 96 CO -0.05 -0.25 0.14 -0.51 0.00 0.00 0.00 175.76 175.09 3m61 s ASP 97 N 1.21 3.94 0.00 0.00 1.11 -1.26 -4.97 116.67 116.70 3m61 s ASP 97 Ca 0.00 -1.99 0.00 0.00 0.18 0.00 0.00 52.55 50.75 3m61 s ASP 97 Cb -0.14 -0.95 0.00 0.00 1.07 0.00 0.00 42.92 42.90 3m61 s ASP 97 CO -0.08 -0.37 0.00 0.41 1.18 0.00 0.00 175.17 176.32 3m61 n THR 97 N 4.39 0.00 0.00 -1.27 -1.04 -1.26 -1.15 114.28 113.95 3m61 n THR 97 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3m61 n THR 97 Cb 0.40 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 3m61 n THR 97 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3m61 n LEU 97 N 0.00 0.00 -4.57 -4.42 0.00 -1.26 -5.05 117.00 101.70 3m61 n LEU 97 Ca 0.00 -0.00 -0.36 0.00 0.00 0.00 0.00 56.01 55.65 3m61 n LEU 97 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 43.39 3m61 n LEU 97 CO 0.00 0.00 1.67 0.00 0.00 0.00 0.00 177.39 179.06 3m61 s ALA 98 N -0.36 2.52 0.09 1.96 0.00 -0.30 -4.83 121.76 120.83 3m61 s ALA 98 Ca 0.00 -2.40 -0.31 0.00 0.00 0.00 0.00 51.96 49.25 3m61 s ALA 98 Cb 0.00 -4.63 -0.07 0.00 0.00 0.00 0.00 23.12 18.41 3m61 s ALA 98 CO 0.00 -4.19 1.40 -1.01 0.00 0.00 0.00 175.76 171.96 3m61 s HIS 99 N 7.38 3.12 0.10 0.00 3.76 -1.26 -4.01 115.29 124.38 3m61 s HIS 99 Ca 0.60 0.90 -0.09 0.00 -0.15 0.00 0.00 55.06 56.32 3m61 s HIS 99 Cb 0.01 -3.69 -0.06 0.00 1.11 0.00 0.00 32.58 29.95 3m61 s HIS 99 CO 0.06 -2.45 0.40 -1.01 -0.85 0.00 0.00 174.74 170.90 3m61 s HIS 100 N 1.46 3.55 -1.35 1.40 3.76 -0.23 -4.41 115.29 119.47 3m61 s HIS 100 Ca 0.65 0.74 -0.04 0.00 -0.15 0.00 0.00 55.06 56.26 3m61 s HIS 100 Cb -0.36 -2.13 0.02 0.00 1.11 0.00 0.00 32.58 31.22 3m61 s HIS 100 CO 0.30 0.48 0.84 0.09 -0.85 0.00 0.00 174.74 175.60 3m61 n ASN 101 N 0.65 -2.49 -4.46 1.40 3.02 -1.26 -2.23 115.26 109.89 3m61 n ASN 101 Ca -0.06 -0.76 -0.44 0.00 -0.03 0.00 0.00 54.58 53.29 3m61 n ASN 101 Cb 0.52 -4.23 -0.01 0.00 -0.61 0.00 0.00 39.78 35.46 3m61 n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3m61 s ASP 102 N -4.05 6.92 -0.14 6.41 2.15 -1.26 -4.40 116.67 122.31 3m61 s ASP 102 Ca 0.20 -2.67 -0.17 0.00 0.43 0.00 0.00 52.55 50.34 3m61 s ASP 102 Cb -0.10 -2.41 0.04 0.00 -0.30 0.00 0.00 42.92 40.16 3m61 s ASP 102 CO 0.80 -0.87 0.46 -0.51 -0.17 0.00 0.00 175.17 174.88 3m61 s ILE 103 N 2.05 0.01 0.03 4.11 2.07 -1.26 -4.27 121.20 123.94 3m61 s ILE 103 Ca 0.40 -0.07 -0.14 0.00 -1.41 0.00 0.00 60.65 59.43 3m61 s ILE 103 Cb -0.03 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.91 3m61 s ILE 103 CO -0.03 -0.04 0.31 0.00 -1.91 0.00 0.00 174.94 173.27 3m61 s ALA 104 N -0.10 -0.71 -0.04 1.50 0.00 -0.59 -3.00 121.76 118.82 3m61 s ALA 104 Ca -0.03 0.08 0.05 0.00 0.00 0.00 0.00 51.96 52.07 3m61 s ALA 104 Cb -0.03 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 3m61 s ALA 104 CO 0.02 -0.38 -0.21 -0.51 0.00 0.00 0.00 175.76 174.68 3m61 s LEU 105 N -1.90 1.99 -0.19 0.00 1.43 -0.14 -0.85 118.68 119.03 3m61 s LEU 105 Ca -0.07 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 3m61 s LEU 105 Cb -0.02 -1.12 0.03 0.00 0.03 0.00 0.00 46.19 45.12 3m61 s LEU 105 CO -0.02 0.21 -0.15 -0.76 0.23 0.00 0.00 176.35 175.86 3m61 s LEU 106 N -0.17 2.23 -0.15 1.79 1.02 0.13 -0.31 118.68 123.22 3m61 s LEU 106 Ca -0.00 -0.76 -0.24 0.00 0.02 0.00 0.00 54.13 53.14 3m61 s LEU 106 Cb -0.11 -1.36 -0.02 0.00 0.02 0.00 0.00 46.19 44.72 3m61 s LEU 106 CO 0.02 -0.07 0.77 -0.75 0.02 0.00 0.00 176.35 176.33 3m61 s LYS 107 N 1.34 4.32 0.04 1.70 2.20 -0.10 -1.03 119.74 128.20 3m61 s LYS 107 Ca 0.02 0.92 0.02 0.00 -0.36 0.00 0.00 55.97 56.56 3m61 s LYS 107 Cb -0.15 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 3m61 s LYS 107 CO -0.10 -0.21 0.05 0.96 -0.36 0.00 0.00 175.35 175.69 3m61 s ILE 108 N 1.77 4.46 -0.17 5.43 -4.36 0.10 -0.63 121.20 127.79 3m61 s ILE 108 Ca 0.37 -0.65 -0.09 0.00 -0.26 0.00 0.00 60.65 60.02 3m61 s ILE 108 Cb -0.17 -3.08 0.06 0.00 1.25 0.00 0.00 42.46 40.53 3m61 s ILE 108 CO 0.14 0.25 0.40 -0.60 0.24 0.00 0.00 174.94 175.36 3m61 s ARG 109 N -2.00 0.36 0.86 0.37 3.52 -0.54 -4.66 118.95 116.87 3m61 s ARG 109 Ca 0.25 0.81 -0.12 0.00 -0.13 0.00 0.00 55.73 56.54 3m61 s ARG 109 Cb -0.12 0.02 0.11 0.00 -1.56 0.00 0.00 34.95 33.40 3m61 s ARG 109 CO 0.17 -0.18 1.10 -1.54 -0.81 0.00 0.00 175.30 174.04 3m61 s SER 110 N 1.61 3.84 0.61 -2.12 1.04 0.29 -0.43 113.70 118.53 3m61 s SER 110 Ca -0.08 1.32 0.30 0.00 0.48 0.00 0.00 55.95 57.97 3m61 s SER 110 Cb -0.09 -2.01 1.69 0.00 0.10 0.00 0.00 66.02 65.72 3m61 s SER 110 CO -0.12 -2.39 2.07 0.11 0.98 0.00 0.00 173.24 173.89 3m61 h LYS 110 N -1.38 0.00 -0.00 4.02 1.79 -1.90 0.39 116.57 119.49 3m61 h LYS 110 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3m61 h LYS 110 Cb 1.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 3m61 h LYS 110 CO 0.58 0.00 -0.10 0.39 -1.08 0.00 0.00 179.45 179.24 3m61 n GLU 110 N -3.60 0.30 -1.18 3.15 4.71 -1.26 -4.92 120.64 117.83 3m61 n GLU 110 Ca 0.02 -0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 3m61 n GLU 110 Cb 0.36 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.29 3m61 n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3m61 n GLY 110 N 1.38 0.40 3.64 0.62 0.00 0.14 -5.06 105.19 106.31 3m61 n GLY 110 Ca 0.11 -1.03 -0.23 0.00 0.00 0.00 0.00 46.02 44.87 3m61 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m61 s ARG 110 N -2.37 2.22 0.00 1.61 0.52 -1.26 -4.77 118.95 114.91 3m61 s ARG 110 Ca 0.00 -1.51 0.00 0.00 -0.52 0.00 0.00 55.73 53.70 3m61 s ARG 110 Cb 0.00 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 33.37 3m61 s ARG 110 CO 0.00 0.30 0.00 0.00 0.02 0.00 0.00 175.30 175.62 3m61 s ALA 112 N -2.83 3.23 -0.19 0.00 0.00 -0.27 -4.88 121.76 116.82 3m61 s ALA 112 Ca 0.00 1.16 -0.00 0.00 0.00 0.00 0.00 51.96 53.12 3m61 s ALA 112 Cb 0.00 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.67 3m61 s ALA 112 CO 0.00 -0.74 -0.15 -0.65 0.00 0.00 0.00 175.76 174.22 3m61 s GLN 113 N -2.24 3.13 0.44 0.00 -0.21 -1.26 -4.84 119.66 114.68 3m61 s GLN 113 Ca 0.57 -0.76 -0.25 0.00 0.02 0.00 0.00 55.36 54.94 3m61 s GLN 113 Cb -0.36 -2.70 -0.08 0.00 1.00 0.00 0.00 33.01 30.87 3m61 s GLN 113 CO 0.46 -0.17 1.32 -2.14 -2.12 0.00 0.00 175.29 172.63 3m61 s PRO 114 N 1.27 3.76 0.05 2.91 0.02 -1.26 -4.81 135.00 136.94 3m61 s PRO 114 Ca 0.04 2.17 -0.02 0.00 0.02 0.00 0.00 61.00 63.21 3m61 s PRO 114 Cb -0.14 -2.61 0.01 0.00 0.02 0.00 0.00 34.50 31.78 3m61 s PRO 114 CO -0.08 -0.67 0.10 -1.13 -0.33 0.00 0.00 177.00 174.89 3m61 n SER 115 N -0.19 -0.30 0.22 2.53 3.41 -0.22 -4.95 113.62 114.13 3m61 n SER 115 Ca 0.05 -1.22 0.12 0.00 -0.26 0.00 0.00 58.87 57.56 3m61 n SER 115 Cb 0.44 0.50 0.73 0.00 -0.26 0.00 0.00 64.21 65.61 3m61 n SER 115 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3m61 h ARG 116 N 0.00 0.00 -0.01 4.33 2.43 -2.00 -3.03 114.38 116.09 3m61 h ARG 116 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3m61 h ARG 116 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3m61 h ARG 116 CO 0.06 0.00 -0.14 0.25 -1.51 0.00 0.00 179.97 178.63 3m61 n THR 117 N -4.29 0.00 -3.67 0.20 -2.24 -1.26 -4.70 114.28 98.33 3m61 n THR 117 Ca -0.00 -0.43 -0.26 0.00 -2.27 0.00 0.00 64.05 61.09 3m61 n THR 117 Cb 0.20 1.21 -0.17 0.00 -2.10 0.00 0.00 70.33 69.47 3m61 n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3m61 s ILE 118 N -1.36 0.16 0.08 2.28 1.01 -1.15 -3.76 121.20 118.47 3m61 s ILE 118 Ca 0.13 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 3m61 s ILE 118 Cb 0.11 -0.70 -0.02 0.00 0.01 0.00 0.00 42.46 41.86 3m61 s ILE 118 CO 0.25 -0.18 0.11 -1.10 0.00 0.00 0.00 174.94 174.02 3m61 s GLN 119 N 2.03 0.77 0.45 2.79 -1.52 -0.49 -1.05 119.66 122.65 3m61 s GLN 119 Ca 0.01 -1.06 -0.04 0.00 -1.95 0.00 0.00 55.36 52.32 3m61 s GLN 119 Cb -0.16 0.30 -0.04 0.00 -0.22 0.00 0.00 33.01 32.89 3m61 s GLN 119 CO -0.08 -0.22 0.74 0.95 -0.25 0.00 0.00 175.29 176.44 3m61 s THR 120 N -3.89 4.94 -0.12 -0.19 -4.23 -1.26 -3.04 115.64 107.85 3m61 s THR 120 Ca 0.06 0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 60.65 3m61 s THR 120 Cb 0.06 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 3m61 s THR 120 CO -0.10 -0.79 -0.05 -0.51 -0.54 0.00 0.00 174.62 172.63 3m61 s ILE 121 N -2.65 3.79 0.45 2.99 1.10 -0.58 -4.83 121.20 121.46 3m61 s ILE 121 Ca 0.46 -0.42 -0.24 0.00 -0.51 0.00 0.00 60.65 59.94 3m61 s ILE 121 Cb -0.10 -2.61 -0.08 0.00 0.15 0.00 0.00 42.46 39.82 3m61 s ILE 121 CO 0.43 0.54 1.27 0.00 -2.11 0.00 0.00 174.94 175.07 3m61 s ALA 122 N -0.14 3.10 0.42 1.50 0.00 -1.26 -4.63 121.76 120.75 3m61 s ALA 122 Ca 0.02 1.16 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 3m61 s ALA 122 Cb -0.13 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.46 3m61 s ALA 122 CO 0.03 -0.86 0.81 -0.51 0.00 0.00 0.00 175.76 175.22 3m61 s LEU 123 N -2.79 3.79 0.82 0.00 1.43 -1.26 -1.31 118.68 119.35 3m61 s LEU 123 Ca 0.61 1.20 -0.11 0.00 -1.03 0.00 0.00 54.13 54.80 3m61 s LEU 123 Cb -0.35 -4.09 0.08 0.00 0.03 0.00 0.00 46.19 41.85 3m61 s LEU 123 CO 0.44 -0.43 1.09 -2.16 0.23 0.00 0.00 176.35 175.52 3m61 s PRO 124 N -3.90 1.90 0.65 1.29 0.04 -1.26 -4.85 135.00 128.87 3m61 s PRO 124 Ca 0.52 0.80 -0.14 0.00 0.04 0.00 0.00 61.00 62.22 3m61 s PRO 124 Cb -0.10 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 3m61 s PRO 124 CO 0.32 -1.79 1.07 -1.12 0.04 0.00 0.00 177.00 175.52 3m61 s SER 125 N -3.66 5.40 0.31 6.66 0.01 -1.26 -4.92 113.70 116.24 3m61 s SER 125 Ca 0.61 1.83 -0.29 0.00 1.31 0.00 0.00 55.95 59.41 3m61 s SER 125 Cb -0.16 -2.53 -0.12 0.00 0.21 0.00 0.00 66.02 63.42 3m61 s SER 125 CO 0.55 -1.43 1.45 1.15 0.41 0.00 0.00 173.24 175.37 3m61 n MET 126 N -2.49 2.38 -2.50 12.44 0.00 -1.26 -2.27 117.12 123.43 3m61 n MET 126 Ca 0.09 0.84 -0.14 0.00 0.00 0.00 0.00 57.70 58.50 3m61 n MET 126 Cb 0.53 -2.53 -0.01 0.00 0.00 0.00 0.00 33.22 31.21 3m61 n MET 126 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 3m61 n TYR 127 N 1.23 -1.42 -3.97 3.17 4.02 -0.72 -4.92 117.16 114.55 3m61 n TYR 127 Ca 0.07 0.03 -0.31 0.00 -0.01 0.00 0.00 57.90 57.68 3m61 n TYR 127 Cb 0.36 -2.88 -0.14 0.00 -0.02 0.00 0.00 39.34 36.66 3m61 n TYR 127 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 3m61 s ASN 128 N -2.08 4.68 0.19 7.72 2.47 -0.96 -5.09 114.94 121.87 3m61 s ASN 128 Ca 0.03 -2.44 0.10 0.00 0.42 0.00 0.00 52.86 50.96 3m61 s ASN 128 Cb -0.01 -1.65 -0.04 0.00 -1.45 0.00 0.00 41.25 38.09 3m61 s ASN 128 CO 0.03 -0.34 -0.20 -1.81 -3.72 0.00 0.00 177.10 171.05 3m61 s ASP 129 N 0.58 3.06 0.76 -4.21 1.01 -1.26 -4.57 116.67 112.04 3m61 s ASP 129 Ca 0.13 -0.89 -0.13 0.00 0.71 0.00 0.00 52.55 52.37 3m61 s ASP 129 Cb -0.21 -0.21 0.06 0.00 1.01 0.00 0.00 42.92 43.56 3m61 s ASP 129 CO -0.05 0.03 1.15 -2.84 0.21 0.00 0.00 175.17 173.67 3m61 s PRO 130 N -2.87 2.08 0.61 8.23 0.02 -1.26 -4.97 135.00 136.83 3m61 s PRO 130 Ca 0.20 1.53 -0.18 0.00 0.02 0.00 0.00 61.00 62.56 3m61 s PRO 130 Cb -0.06 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 3m61 s PRO 130 CO 0.09 -1.84 1.21 -1.14 -0.33 0.00 0.00 177.00 174.99 3m61 s GLN 131 N -4.28 2.88 0.54 5.54 0.74 -1.26 -4.93 119.66 118.89 3m61 s GLN 131 Ca 0.69 1.83 -0.20 0.00 0.05 0.00 0.00 55.36 57.73 3m61 s GLN 131 Cb -0.24 -1.92 -0.05 0.00 1.10 0.00 0.00 33.01 31.90 3m61 s GLN 131 CO 0.49 -1.28 1.17 -0.06 -0.55 0.00 0.00 175.29 175.06 3m61 s PHE 132 N -1.62 2.59 0.00 1.67 0.40 -1.26 -1.91 117.98 117.86 3m61 s PHE 132 Ca 0.77 1.52 0.00 0.00 -0.60 0.00 0.00 56.93 58.63 3m61 s PHE 132 Cb -0.31 -3.40 0.00 0.00 0.51 0.00 0.00 43.02 39.83 3m61 s PHE 132 CO 0.35 -1.84 0.00 0.41 0.70 0.00 0.00 175.22 174.83 3m61 n GLY 133 N 0.36 2.13 3.76 4.36 0.00 0.93 -4.97 105.19 111.76 3m61 n GLY 133 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3m61 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m61 s THR 134 N -2.31 2.68 0.11 2.61 2.01 -0.80 -4.63 115.64 115.30 3m61 s THR 134 Ca 0.00 0.65 -0.27 0.00 0.31 0.00 0.00 61.69 62.38 3m61 s THR 134 Cb 0.00 -3.41 -0.06 0.00 0.01 0.00 0.00 72.50 69.03 3m61 s THR 134 CO 0.00 0.14 0.84 -0.44 -0.69 0.00 0.00 174.62 174.47 3m61 s SER 135 N -0.22 7.37 0.19 3.53 0.01 -1.26 -1.24 113.70 122.09 3m61 s SER 135 Ca 0.52 1.64 0.02 0.00 1.31 0.00 0.00 55.95 59.44 3m61 s SER 135 Cb -0.41 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.25 3m61 s SER 135 CO 0.51 0.05 0.01 0.00 0.41 0.00 0.00 173.24 174.22 3m61 s GLU 137 N -3.92 2.61 0.08 0.00 2.02 0.07 -1.66 118.70 117.89 3m61 s GLU 137 Ca 0.27 -0.80 0.07 0.00 0.02 0.00 0.00 54.97 54.52 3m61 s GLU 137 Cb 0.06 -2.57 -0.03 0.00 0.10 0.00 0.00 34.13 31.69 3m61 s GLU 137 CO 0.06 0.55 -0.17 0.96 0.02 0.00 0.00 175.26 176.68 3m61 s ILE 138 N -1.30 1.41 -0.01 -1.63 -4.36 -0.27 -0.96 121.20 114.08 3m61 s ILE 138 Ca 0.26 -1.34 0.00 0.00 -0.26 0.00 0.00 60.65 59.31 3m61 s ILE 138 Cb -0.12 -1.29 0.01 0.00 1.25 0.00 0.00 42.46 42.31 3m61 s ILE 138 CO 0.18 -0.08 0.00 -0.89 0.24 0.00 0.00 174.94 174.40 3m61 s THR 139 N -1.12 0.01 -0.08 8.37 2.01 -1.21 -1.54 115.64 122.08 3m61 s THR 139 Ca 0.03 0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.76 3m61 s THR 139 Cb -0.10 -0.05 0.12 0.00 0.01 0.00 0.00 72.50 72.48 3m61 s THR 139 CO 0.03 0.03 1.39 -0.83 -0.69 0.00 0.00 174.62 174.55 3m61 s GLY 140 N 0.27 -0.32 -0.15 4.40 0.00 -0.63 -4.36 107.32 106.53 3m61 s GLY 140 Ca -0.02 0.46 0.17 0.00 0.00 0.00 0.00 44.72 45.33 3m61 s GLY 140 CO -0.01 4.11 1.65 0.69 0.00 0.00 0.00 173.10 179.54 3m61 n PHE 141 N -0.78 1.63 -1.06 1.90 3.72 -1.26 -1.64 117.46 119.96 3m61 n PHE 141 Ca -0.00 -0.66 -0.29 0.00 -0.05 0.00 0.00 57.45 56.44 3m61 n PHE 141 Cb 0.60 -0.33 0.22 0.00 -0.94 0.00 0.00 39.48 39.04 3m61 n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3m61 s GLY 142 N -0.94 1.57 0.51 1.37 0.00 -1.25 -4.14 107.32 104.44 3m61 s GLY 142 Ca 0.51 -0.71 -0.22 0.00 0.00 0.00 0.00 44.72 44.30 3m61 s GLY 142 CO 0.21 0.08 1.05 0.28 0.00 0.00 0.00 173.10 174.72 3m61 n LYS 143 N -4.61 1.27 0.04 2.90 5.02 -0.06 -2.35 118.16 120.36 3m61 n LYS 143 Ca 0.10 0.47 0.11 0.00 -2.02 0.00 0.00 58.31 56.97 3m61 n LYS 143 Cb 0.59 -2.19 0.06 0.00 -0.02 0.00 0.00 35.03 33.47 3m61 n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3m61 n GLU 144 N -0.45 0.34 -3.81 1.97 1.02 -1.26 -1.11 120.64 117.34 3m61 n GLU 144 Ca 0.11 0.03 -0.12 0.00 -0.02 0.00 0.00 57.16 57.16 3m61 n GLU 144 Cb 0.43 -1.65 -0.11 0.00 -0.02 0.00 0.00 31.44 30.10 3m61 n GLU 144 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3m61 s GLN 145 N -3.22 0.36 0.53 3.49 -0.21 -1.26 -4.28 119.66 115.08 3m61 s GLN 145 Ca 0.03 0.09 0.19 0.00 0.02 0.00 0.00 55.36 55.70 3m61 s GLN 145 Cb 0.13 0.17 1.36 0.00 1.00 0.00 0.00 33.01 35.67 3m61 s GLN 145 CO 0.78 -0.07 2.13 0.77 -2.12 0.00 0.00 175.29 176.78 3m61 h SER 146 N 5.20 0.00 0.32 5.90 0.02 -1.92 -1.55 113.55 121.52 3m61 h SER 146 Ca -0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3m61 h SER 146 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3m61 h SER 146 CO 0.38 0.00 -0.17 0.35 -1.14 0.00 0.00 176.83 176.25 3m61 n THR 147 N -4.42 0.00 -1.99 -2.27 -2.24 -1.26 -4.92 114.28 97.18 3m61 n THR 147 Ca -0.01 -0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.34 3m61 n THR 147 Cb 0.18 0.10 0.03 0.00 -2.10 0.00 0.00 70.33 68.54 3m61 n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3m61 s ASP 148 N -2.50 5.25 -0.23 3.42 1.01 -0.59 -4.97 116.67 118.06 3m61 s ASP 148 Ca 0.27 2.24 -0.14 0.00 0.71 0.00 0.00 52.55 55.62 3m61 s ASP 148 Cb 0.20 -2.58 -0.17 0.00 1.01 0.00 0.00 42.92 41.38 3m61 s ASP 148 CO 0.50 -1.54 -0.05 0.00 0.21 0.00 0.00 175.17 174.28 3m61 n TYR 149 N -1.77 0.53 -2.70 4.23 -0.00 -1.26 -5.00 117.16 111.19 3m61 n TYR 149 Ca 0.12 0.20 -0.33 0.00 -0.00 0.00 0.00 57.90 57.89 3m61 n TYR 149 Cb 0.51 -1.06 -0.06 0.00 -0.00 0.00 0.00 39.34 38.73 3m61 n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 3m61 s LEU 150 N -7.49 3.86 0.34 2.98 1.43 -1.26 -5.08 118.68 113.45 3m61 s LEU 150 Ca -0.33 1.68 -0.13 0.00 -1.03 0.00 0.00 54.13 54.32 3m61 s LEU 150 Cb 0.10 -4.53 -0.08 0.00 0.03 0.00 0.00 46.19 41.70 3m61 s LEU 150 CO 0.57 -0.45 0.73 -0.31 0.23 0.00 0.00 176.35 177.12 3m61 s TYR 151 N -2.27 3.40 0.60 0.29 2.02 -1.26 -4.67 117.35 115.46 3m61 s TYR 151 Ca 0.62 1.13 -0.19 0.00 -0.37 0.00 0.00 57.07 58.26 3m61 s TYR 151 Cb -0.10 -2.48 -0.03 0.00 -0.40 0.00 0.00 41.96 38.95 3m61 s TYR 151 CO 0.18 0.05 1.24 -1.25 -1.57 0.00 0.00 175.55 174.20 3m61 s PRO 152 N -3.21 2.92 0.30 -1.71 0.04 -1.26 -4.93 135.00 127.15 3m61 s PRO 152 Ca 0.53 1.91 0.23 0.00 0.04 0.00 0.00 61.00 63.71 3m61 s PRO 152 Cb -0.10 -1.95 0.32 0.00 0.04 0.00 0.00 34.50 32.80 3m61 s PRO 152 CO 0.22 -1.27 1.45 1.49 0.04 0.00 0.00 177.00 178.93 3m61 h GLU 153 N 0.90 0.00 -6.03 4.56 4.57 -1.97 -3.43 114.58 113.18 3m61 h GLU 153 Ca -0.51 0.00 -0.68 0.00 -1.18 0.00 0.00 59.36 56.99 3m61 h GLU 153 Cb 1.31 0.00 -0.22 0.00 -0.16 0.00 0.00 28.75 29.67 3m61 h GLU 153 CO 0.55 0.00 -0.74 -1.14 -1.18 0.00 0.00 179.01 176.50 3m61 s GLN 154 N -3.23 2.81 0.46 1.92 2.00 -1.26 -0.76 119.66 121.60 3m61 s GLN 154 Ca 0.05 -0.63 -0.24 0.00 -2.00 0.00 0.00 55.36 52.54 3m61 s GLN 154 Cb 0.08 -2.53 -0.08 0.00 0.80 0.00 0.00 33.01 31.28 3m61 s GLN 154 CO 0.70 0.55 1.29 -0.11 -0.50 0.00 0.00 175.29 177.21 3m61 n LEU 155 N 2.56 4.41 -4.37 3.68 7.94 -0.58 -4.87 117.00 125.77 3m61 n LEU 155 Ca -0.18 1.07 -0.22 0.00 -1.11 0.00 0.00 56.01 55.58 3m61 n LEU 155 Cb 0.53 -1.52 -0.11 0.00 0.53 0.00 0.00 43.42 42.85 3m61 n LEU 155 CO 0.27 -0.63 -0.47 -0.54 -1.11 0.00 0.00 177.39 174.91 3m61 s LYS 156 N -2.38 1.38 0.05 1.96 1.02 -0.65 -1.22 119.74 119.90 3m61 s LYS 156 Ca 0.63 -1.54 -0.01 0.00 0.02 0.00 0.00 55.97 55.08 3m61 s LYS 156 Cb -0.48 -1.39 -0.04 0.00 -0.52 0.00 0.00 37.83 35.41 3m61 s LYS 156 CO 0.56 0.27 -0.03 0.00 -0.92 0.00 0.00 175.35 175.22 3m61 s MET 157 N -3.18 0.57 0.29 1.68 0.23 -0.16 -1.61 119.30 117.13 3m61 s MET 157 Ca 0.21 -1.13 -0.05 0.00 -1.03 0.00 0.00 55.69 53.69 3m61 s MET 157 Cb -0.04 0.17 -0.01 0.00 -1.53 0.00 0.00 34.83 33.42 3m61 s MET 157 CO 0.08 -0.09 0.42 -0.08 -2.03 0.00 0.00 175.02 173.32 3m61 s THR 158 N -3.50 0.00 -0.10 3.16 -1.32 -0.59 -0.42 115.64 112.87 3m61 s THR 158 Ca 0.04 -1.60 0.01 0.00 -1.21 0.00 0.00 61.69 58.92 3m61 s THR 158 Cb 0.05 -2.48 -0.02 0.00 -1.51 0.00 0.00 72.50 68.54 3m61 s THR 158 CO -0.08 0.00 -0.14 -0.69 -2.21 0.00 0.00 174.62 171.50 3m61 s VAL 159 N -3.52 3.04 0.18 5.08 1.01 -1.26 -1.11 120.40 123.83 3m61 s VAL 159 Ca 0.29 -0.69 0.05 0.00 0.00 0.00 0.00 61.98 61.64 3m61 s VAL 159 Cb 0.01 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 3m61 s VAL 159 CO 0.16 0.55 -0.09 0.68 0.00 0.00 0.00 175.10 176.39 3m61 s VAL 160 N -0.04 1.31 -0.07 2.92 -7.23 -0.67 -4.80 120.40 111.83 3m61 s VAL 160 Ca -0.03 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.05 3m61 s VAL 160 Cb -0.14 -2.01 -0.03 0.00 0.56 0.00 0.00 36.38 34.76 3m61 s VAL 160 CO 0.04 -0.62 -0.06 -0.54 -0.31 0.00 0.00 175.10 173.61 3m61 s LYS 161 N -3.74 2.82 0.30 4.82 1.02 0.28 -0.45 119.74 124.79 3m61 s LYS 161 Ca 0.21 -0.54 -0.29 0.00 0.02 0.00 0.00 55.97 55.37 3m61 s LYS 161 Cb 0.02 -2.62 -0.10 0.00 -0.52 0.00 0.00 37.83 34.61 3m61 s LYS 161 CO 0.04 0.64 1.26 -0.51 -0.92 0.00 0.00 175.35 175.86 3m61 s LEU 162 N -0.74 4.45 -0.06 3.17 1.02 -0.38 -1.37 118.68 124.77 3m61 s LEU 162 Ca 0.11 2.56 0.04 0.00 0.02 0.00 0.00 54.13 56.86 3m61 s LEU 162 Cb -0.11 -3.64 -0.02 0.00 0.02 0.00 0.00 46.19 42.44 3m61 s LEU 162 CO 0.02 -0.45 -0.17 -0.63 0.02 0.00 0.00 176.35 175.14 3m61 s ILE 163 N -0.96 2.80 0.67 -0.59 1.01 0.06 -0.05 121.20 124.15 3m61 s ILE 163 Ca 0.49 -0.81 -0.15 0.00 0.00 0.00 0.00 60.65 60.18 3m61 s ILE 163 Cb -0.38 -2.09 0.01 0.00 0.01 0.00 0.00 42.46 40.01 3m61 s ILE 163 CO 0.48 0.57 1.13 -0.94 0.00 0.00 0.00 174.94 176.19 3m61 s SER 164 N -0.43 4.91 0.37 3.58 1.04 -1.26 -4.19 113.70 117.72 3m61 s SER 164 Ca 0.05 2.09 0.04 0.00 0.48 0.00 0.00 55.95 58.61 3m61 s SER 164 Cb -0.12 -2.56 0.72 0.00 0.10 0.00 0.00 66.02 64.16 3m61 s SER 164 CO 0.02 -1.77 2.02 -0.74 0.98 0.00 0.00 173.24 173.74 3m61 h HIS 165 N -0.01 0.66 -0.62 5.02 2.76 -1.96 -0.88 115.15 120.12 3m61 h HIS 165 Ca -0.47 0.01 0.07 0.00 -2.20 0.00 0.00 60.37 57.77 3m61 h HIS 165 Cb 1.26 -0.22 -0.06 0.00 1.55 0.00 0.00 27.41 29.94 3m61 h HIS 165 CO 0.53 0.44 0.31 -0.09 -1.30 0.00 0.00 177.93 177.81 3m61 h ARG 166 N 0.71 0.55 -0.12 5.26 2.43 -1.99 -1.27 114.38 119.95 3m61 h ARG 166 Ca 0.19 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 59.13 3m61 h ARG 166 Cb -0.04 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 29.39 3m61 h ARG 166 CO -0.04 0.37 -0.67 1.49 -1.51 0.00 0.00 179.97 179.61 3m61 h GLU 167 N 0.57 0.67 -0.02 0.20 4.81 -1.77 -3.30 114.58 115.74 3m61 h GLU 167 Ca 0.29 -0.55 -0.08 0.00 -0.13 0.00 0.00 59.36 58.88 3m61 h GLU 167 Cb 0.23 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 3m61 h GLU 167 CO -0.21 1.17 -0.37 0.00 -0.73 0.00 0.00 179.01 178.88 3m61 n GLN 169 N -4.10 0.36 -1.70 0.00 10.64 -0.50 -1.73 117.38 120.35 3m61 n GLN 169 Ca -0.02 -0.02 -0.39 0.00 -1.83 0.00 0.00 57.00 54.74 3m61 n GLN 169 Cb 0.41 -1.50 0.04 0.00 -0.86 0.00 0.00 30.24 28.32 3m61 n GLN 169 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3m61 n GLN 170 N -1.30 1.55 -0.35 2.61 6.02 -1.07 -3.23 117.38 121.61 3m61 n GLN 170 Ca 0.13 0.57 0.07 0.00 -0.01 0.00 0.00 57.00 57.75 3m61 n GLN 170 Cb 0.27 -2.41 0.23 0.00 1.02 0.00 0.00 30.24 29.34 3m61 n GLN 170 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 3m61 h PRO 170 N 1.39 0.91 0.00 -1.09 0.11 -1.91 -1.03 132.00 130.37 3m61 h PRO 170 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3m61 h PRO 170 Cb 1.32 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3m61 h PRO 170 CO 0.56 0.60 0.00 -2.39 -0.21 0.00 0.00 178.00 176.57 3m61 n HIS 170 N -4.66 0.00 0.00 0.65 1.44 -1.26 -4.27 115.22 107.13 3m61 n HIS 170 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 3m61 n HIS 170 Cb 0.35 -0.40 0.00 0.00 0.12 0.00 0.00 29.99 30.06 3m61 n HIS 170 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3m61 n TYR 171 N -1.40 0.00 0.09 -1.40 4.02 -0.50 -4.81 117.16 113.15 3m61 n TYR 171 Ca 0.08 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.98 3m61 n TYR 171 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 3m61 n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3m61 n TYR 172 N 0.00 0.00 -3.51 -0.72 4.01 -0.70 -4.91 117.16 111.32 3m61 n TYR 172 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3m61 n TYR 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3m61 n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3m61 n GLY 173 N 0.53 3.03 0.00 2.72 0.00 -0.55 -2.15 105.19 108.77 3m61 n GLY 173 Ca 0.01 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.86 3m61 n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3m61 n SER 174 N 1.67 0.00 0.23 1.61 3.41 -1.26 -3.49 113.62 115.80 3m61 n SER 174 Ca 0.00 -0.44 0.06 0.00 -0.26 0.00 0.00 58.87 58.23 3m61 n SER 174 Cb 0.00 -0.14 0.55 0.00 -0.26 0.00 0.00 64.21 64.36 3m61 n SER 174 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3m61 h GLU 175 N 0.00 0.00 -5.67 4.33 5.08 -1.82 -3.42 114.58 113.08 3m61 h GLU 175 Ca 0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 3m61 h GLU 175 Cb 0.12 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.29 3m61 h GLU 175 CO 0.00 0.14 -0.29 0.14 -1.00 0.00 0.00 179.01 178.00 3m61 s VAL 176 N -4.69 5.25 0.43 3.13 -7.23 -1.23 -4.89 120.40 111.17 3m61 s VAL 176 Ca -0.04 0.62 0.07 0.00 -1.81 0.00 0.00 61.98 60.82 3m61 s VAL 176 Cb 0.16 -3.64 -0.04 0.00 0.56 0.00 0.00 36.38 33.42 3m61 s VAL 176 CO 0.68 0.46 0.22 0.42 -0.31 0.00 0.00 175.10 176.57 3m61 s THR 177 N -0.12 2.23 -0.83 5.32 -4.23 -1.26 -4.94 115.64 111.81 3m61 s THR 177 Ca 0.19 -1.65 0.16 0.00 -1.18 0.00 0.00 61.69 59.21 3m61 s THR 177 Cb -0.14 -2.88 0.15 0.00 1.34 0.00 0.00 72.50 70.97 3m61 s THR 177 CO 0.07 0.00 1.51 0.35 -0.54 0.00 0.00 174.62 176.01 3m61 n THR 178 N -1.33 1.03 1.07 3.99 -2.24 -1.26 -2.00 114.28 113.54 3m61 n THR 178 Ca -0.01 0.28 0.06 0.00 -2.27 0.00 0.00 64.05 62.11 3m61 n THR 178 Cb 0.64 -1.11 0.20 0.00 -2.10 0.00 0.00 70.33 67.96 3m61 n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3m61 n LYS 179 N -1.74 1.71 -4.34 -0.78 5.02 -1.26 -4.86 118.16 111.91 3m61 n LYS 179 Ca 0.03 -1.10 -0.22 0.00 -2.02 0.00 0.00 58.31 54.99 3m61 n LYS 179 Cb 0.17 -1.28 -0.11 0.00 -0.02 0.00 0.00 35.03 33.79 3m61 n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3m61 s MET 180 N -1.63 1.30 -0.03 1.97 -1.94 -0.85 -0.85 119.30 117.27 3m61 s MET 180 Ca 0.24 -1.42 0.06 0.00 -1.71 0.00 0.00 55.69 52.86 3m61 s MET 180 Cb 0.12 -1.40 -0.01 0.00 2.01 0.00 0.00 34.83 35.55 3m61 s MET 180 CO 0.17 0.29 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.74 3m61 s LEU 181 N -2.65 2.02 0.02 -0.03 1.43 0.42 -4.78 118.68 115.11 3m61 s LEU 181 Ca 0.16 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 52.83 3m61 s LEU 181 Cb -0.06 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.93 3m61 s LEU 181 CO 0.07 0.24 0.12 0.00 0.23 0.00 0.00 176.35 177.02 3m61 s ALA 183 N -1.31 -0.70 0.32 0.00 0.00 -0.59 -0.76 121.76 118.72 3m61 s ALA 183 Ca 0.27 0.46 -0.19 0.00 0.00 0.00 0.00 51.96 52.50 3m61 s ALA 183 Cb -0.12 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.90 3m61 s ALA 183 CO 0.19 -0.21 0.74 0.00 0.00 0.00 0.00 175.76 176.48 3m61 s ALA 184 N -0.78 -1.02 0.14 0.00 0.00 -0.47 -1.47 121.76 118.17 3m61 s ALA 184 Ca -0.09 -0.49 -0.16 0.00 0.00 0.00 0.00 51.96 51.23 3m61 s ALA 184 Cb -0.04 0.78 -0.07 0.00 0.00 0.00 0.00 23.12 23.79 3m61 s ALA 184 CO 0.02 -1.02 0.57 0.34 0.00 0.00 0.00 175.76 175.68 3m61 s ASP 185 N -2.98 6.88 0.51 0.00 2.15 -1.26 -0.56 116.67 121.42 3m61 s ASP 185 Ca 0.13 1.14 0.19 0.00 0.43 0.00 0.00 52.55 54.44 3m61 s ASP 185 Cb -0.06 -2.31 1.30 0.00 -0.30 0.00 0.00 42.92 41.55 3m61 s ASP 185 CO 0.09 0.12 2.12 -0.65 -0.17 0.00 0.00 175.17 176.68 3m61 h PRO 185 N 3.70 0.00 -0.18 4.34 0.11 -1.96 0.07 132.00 138.08 3m61 h PRO 185 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3m61 h PRO 185 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3m61 h PRO 185 CO 0.65 0.06 0.00 1.04 -0.21 0.00 0.00 178.00 179.54 3m61 n GLN 185 N -4.30 1.97 -1.77 1.05 1.13 -1.26 -4.96 117.38 109.24 3m61 n GLN 185 Ca -0.03 -1.45 -0.19 0.00 -1.94 0.00 0.00 57.00 53.39 3m61 n GLN 185 Cb 0.14 -1.44 -0.06 0.00 0.11 0.00 0.00 30.24 28.98 3m61 n GLN 185 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 3m61 n TRP 186 N 0.69 -0.33 1.08 1.08 7.02 0.01 -4.87 117.44 122.13 3m61 n TRP 186 Ca 0.17 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.77 3m61 n TRP 186 Cb 0.43 -3.41 0.16 0.00 -2.42 0.00 0.00 31.31 26.06 3m61 n TRP 186 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 3m61 n LYS 187 N -2.45 0.53 -3.92 -0.99 2.85 -1.26 -4.31 118.16 108.62 3m61 n LYS 187 Ca -0.20 -0.38 -0.11 0.00 -1.05 0.00 0.00 58.31 56.58 3m61 n LYS 187 Cb 0.64 -1.49 -0.12 0.00 -0.65 0.00 0.00 35.03 33.41 3m61 n LYS 187 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 3m61 s THR 188 N -2.73 0.06 -0.00 0.58 -1.32 -1.26 -4.41 115.64 106.56 3m61 s THR 188 Ca 0.16 -0.47 -0.30 0.00 -1.21 0.00 0.00 61.69 59.87 3m61 s THR 188 Cb 0.18 -0.18 0.11 0.00 -1.51 0.00 0.00 72.50 71.10 3m61 s THR 188 CO 0.65 -0.26 1.15 -0.62 -2.21 0.00 0.00 174.62 173.33 3m61 s ASP 189 N -0.78 -0.13 0.64 8.08 -1.08 -0.94 -4.06 116.67 118.41 3m61 s ASP 189 Ca -0.09 -0.17 -0.13 0.00 -0.52 0.00 0.00 52.55 51.65 3m61 s ASP 189 Cb -0.05 0.26 -0.02 0.00 -1.46 0.00 0.00 42.92 41.65 3m61 s ASP 189 CO -0.00 -0.47 1.05 -0.94 0.52 0.00 0.00 175.17 175.32 3m61 s SER 190 N -2.78 5.78 0.17 -0.34 1.04 -1.26 -0.66 113.70 115.64 3m61 s SER 190 Ca 0.12 1.62 0.03 0.00 0.48 0.00 0.00 55.95 58.20 3m61 s SER 190 Cb 0.02 -2.50 -0.01 0.00 0.10 0.00 0.00 66.02 63.62 3m61 s SER 190 CO -0.03 -1.17 0.17 0.00 0.98 0.00 0.00 173.24 173.18 3m61 n GLN 192 N -0.32 1.20 0.00 0.00 7.27 -1.26 -1.17 117.38 123.10 3m61 n GLN 192 Ca 0.03 0.43 0.00 0.00 0.07 0.00 0.00 57.00 57.54 3m61 n GLN 192 Cb 0.31 -2.09 0.00 0.00 2.41 0.00 0.00 30.24 30.86 3m61 n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3m61 n GLY 193 N 2.97 0.80 0.01 1.69 0.00 -1.26 -0.88 105.19 108.51 3m61 n GLY 193 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 3m61 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m61 n ASP 194 N 0.00 0.41 -4.60 1.61 8.00 -0.32 -3.79 116.55 117.86 3m61 n ASP 194 Ca 0.00 0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.09 3m61 n ASP 194 Cb 0.00 0.03 0.01 0.00 -0.02 0.00 0.00 41.12 41.14 3m61 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3m61 n SER 195 N -1.60 1.15 0.00 -2.24 7.64 -1.26 -2.09 113.62 115.21 3m61 n SER 195 Ca 0.06 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.97 3m61 n SER 195 Cb 0.35 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 3m61 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m61 n GLY 196 N 1.22 2.50 3.84 0.23 0.00 -0.20 -1.39 105.19 111.38 3m61 n GLY 196 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 3m61 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3m61 s GLY 197 N -1.85 1.62 0.24 -0.02 0.00 -0.89 -3.46 107.32 102.96 3m61 s GLY 197 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 44.72 44.12 3m61 s GLY 197 CO 0.00 0.11 1.03 2.56 0.00 0.00 0.00 173.10 176.80 3m61 s PRO 198 N -5.27 4.73 -0.27 2.90 0.04 -1.26 -0.87 135.00 135.01 3m61 s PRO 198 Ca 0.60 1.65 -0.05 0.00 0.04 0.00 0.00 61.00 63.23 3m61 s PRO 198 Cb -0.13 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.17 3m61 s PRO 198 CO 0.53 0.33 0.03 -1.17 0.04 0.00 0.00 177.00 176.75 3m61 s LEU 199 N -1.14 3.50 -0.13 -3.56 2.96 -0.14 -3.33 118.68 116.84 3m61 s LEU 199 Ca 0.44 -0.62 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 3m61 s LEU 199 Cb -0.29 -1.82 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 3m61 s LEU 199 CO 0.36 -0.13 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.41 3m61 s VAL 200 N 1.48 2.74 0.19 1.68 1.01 -0.13 -1.22 120.40 126.15 3m61 s VAL 200 Ca 0.03 -0.77 0.09 0.00 0.00 0.00 0.00 61.98 61.33 3m61 s VAL 200 Cb -0.16 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 3m61 s VAL 200 CO 0.00 0.53 -0.18 0.00 0.00 0.00 0.00 175.10 175.46 3m61 s SER 202 N -2.97 6.24 -0.21 0.00 0.15 -1.26 -0.52 113.70 115.13 3m61 s SER 202 Ca 0.20 0.05 0.02 0.00 0.70 0.00 0.00 55.95 56.91 3m61 s SER 202 Cb -0.04 -2.22 0.04 0.00 -1.71 0.00 0.00 66.02 62.09 3m61 s SER 202 CO 0.08 -0.29 -0.13 -0.76 1.20 0.00 0.00 173.24 173.34 3m61 s LEU 203 N 2.11 2.62 -1.52 3.45 1.43 -0.13 -4.74 118.68 121.90 3m61 s LEU 203 Ca 0.14 -0.99 -0.05 0.00 -1.03 0.00 0.00 54.13 52.20 3m61 s LEU 203 Cb -0.16 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.67 3m61 s LEU 203 CO 0.11 -0.12 0.55 0.00 0.23 0.00 0.00 176.35 177.12 3m61 n GLN 204 N 4.58 -4.47 -0.92 1.70 6.02 -1.26 -1.87 117.38 121.16 3m61 n GLN 204 Ca -0.16 0.84 0.00 0.00 -0.01 0.00 0.00 57.00 57.67 3m61 n GLN 204 Cb 0.46 -5.67 0.00 0.00 1.02 0.00 0.00 30.24 26.05 3m61 n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m61 n GLY 205 N -1.43 0.48 3.09 1.08 0.00 -1.26 -5.05 105.19 102.09 3m61 n GLY 205 Ca -0.11 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.13 3m61 n GLY 205 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m61 s ARG 206 N -0.96 2.17 0.09 1.61 3.52 -0.78 -5.11 118.95 119.48 3m61 s ARG 206 Ca 0.00 -0.57 -0.31 0.00 -0.13 0.00 0.00 55.73 54.72 3m61 s ARG 206 Cb 0.00 -1.72 -0.08 0.00 -1.56 0.00 0.00 34.95 31.59 3m61 s ARG 206 CO 0.00 0.07 1.53 -1.64 -0.81 0.00 0.00 175.30 174.45 3m61 s MET 207 N 0.58 4.24 -0.02 5.12 -1.94 -1.26 -0.95 119.30 125.06 3m61 s MET 207 Ca -0.16 2.22 0.02 0.00 -1.71 0.00 0.00 55.69 56.06 3m61 s MET 207 Cb -0.16 -3.40 0.01 0.00 2.01 0.00 0.00 34.83 33.28 3m61 s MET 207 CO 0.05 -0.61 -0.06 0.99 -0.01 0.00 0.00 175.02 175.38 3m61 s THR 208 N 1.88 0.57 -0.82 2.05 2.01 0.32 -4.03 115.64 117.62 3m61 s THR 208 Ca 0.69 -0.22 -0.25 0.00 0.31 0.00 0.00 61.69 62.21 3m61 s THR 208 Cb -0.39 -0.53 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 3m61 s THR 208 CO 0.30 0.20 1.78 -0.22 -0.69 0.00 0.00 174.62 175.99 3m61 s LEU 209 N 0.36 3.25 -0.02 4.42 2.96 -0.43 -1.72 118.68 127.50 3m61 s LEU 209 Ca -0.05 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 3m61 s LEU 209 Cb -0.09 -2.55 -0.27 0.00 0.50 0.00 0.00 46.19 43.78 3m61 s LEU 209 CO 0.00 -2.37 0.77 0.74 -1.32 0.00 0.00 176.35 174.18 3m61 h THR 210 N 6.96 1.05 -3.87 3.68 2.02 -1.50 -3.38 112.91 117.88 3m61 h THR 210 Ca -0.03 -2.73 -0.10 0.00 0.77 0.00 0.00 66.41 64.32 3m61 h THR 210 Cb 1.06 2.68 -0.11 0.00 -1.74 0.00 0.00 68.15 70.05 3m61 h THR 210 CO 1.25 0.79 -0.24 -0.83 0.37 0.00 0.00 175.52 176.86 3m61 s GLY 211 N -5.05 0.73 -0.08 2.16 0.00 -0.77 -2.02 107.32 102.29 3m61 s GLY 211 Ca -0.10 -1.06 0.01 0.00 0.00 0.00 0.00 44.72 43.57 3m61 s GLY 211 CO 0.84 -0.81 -0.11 -0.42 0.00 0.00 0.00 173.10 172.60 3m61 s ILE 212 N -4.05 1.10 0.12 0.90 1.01 -1.03 -0.97 121.20 118.30 3m61 s ILE 212 Ca 0.26 -0.42 -0.33 0.00 0.00 0.00 0.00 60.65 60.16 3m61 s ILE 212 Cb 0.01 -1.04 -0.13 0.00 0.01 0.00 0.00 42.46 41.31 3m61 s ILE 212 CO 0.09 0.36 1.70 0.52 0.00 0.00 0.00 174.94 177.61 3m61 n VAL 213 N 4.18 0.17 0.07 2.92 0.31 -0.04 -0.75 118.33 125.19 3m61 n VAL 213 Ca -0.20 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3m61 n VAL 213 Cb 0.51 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.66 3m61 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3m61 n SER 214 N 4.47 0.63 -3.37 4.52 2.88 -0.72 -1.03 113.62 121.00 3m61 n SER 214 Ca 0.18 0.22 -0.09 0.00 -1.33 0.00 0.00 58.87 57.85 3m61 n SER 214 Cb 0.32 -0.09 -0.01 0.00 -0.75 0.00 0.00 64.21 63.68 3m61 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3m61 s TRP 215 N -1.87 0.18 0.00 0.66 1.48 -0.81 -4.94 118.94 113.63 3m61 s TRP 215 Ca 0.00 -0.70 0.00 0.00 -1.06 0.00 0.00 56.10 54.34 3m61 s TRP 215 Cb 0.00 0.61 0.00 0.00 -1.16 0.00 0.00 33.47 32.92 3m61 s TRP 215 CO 0.00 -1.35 0.00 0.41 -4.06 0.00 0.00 176.95 171.95 3m61 n GLY 216 N -0.50 1.27 3.60 3.67 0.00 -1.26 -0.47 105.19 111.51 3m61 n GLY 216 Ca -0.05 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.98 3m61 n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m61 s ARG 217 N -2.00 3.92 3.34 1.61 3.52 -1.26 -4.88 118.95 123.20 3m61 s ARG 217 Ca 0.00 0.42 0.00 0.00 -0.13 0.00 0.00 55.73 56.02 3m61 s ARG 217 Cb 0.00 -3.73 0.00 0.00 -1.56 0.00 0.00 34.95 29.66 3m61 s ARG 217 CO 0.00 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.27 3m61 n GLY 219 N 4.33 0.98 3.02 8.12 0.00 -1.26 -4.76 105.19 115.62 3m61 n GLY 219 Ca 0.01 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.19 3m61 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m61 n ALA 221 N 2.89 -1.65 -2.67 0.00 0.00 -1.26 -4.95 120.51 112.87 3m61 n ALA 221 Ca -0.13 -0.14 -0.35 0.00 0.00 0.00 0.00 53.44 52.82 3m61 n ALA 221 Cb 0.59 -2.48 -0.10 0.00 0.00 0.00 0.00 19.45 17.46 3m61 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3m61 s LEU 222 N -7.13 3.53 0.23 0.00 1.43 -1.26 -4.75 118.68 110.73 3m61 s LEU 222 Ca 0.36 0.12 -0.31 0.00 -1.03 0.00 0.00 54.13 53.26 3m61 s LEU 222 Cb -0.19 -1.82 -0.14 0.00 0.03 0.00 0.00 46.19 44.07 3m61 s LEU 222 CO 0.91 0.37 1.36 1.17 0.23 0.00 0.00 176.35 180.39 3m61 n LYS 223 N 2.10 1.88 -1.43 1.70 4.81 -1.26 -2.12 118.16 123.84 3m61 n LYS 223 Ca -0.18 0.67 -0.15 0.00 -0.87 0.00 0.00 58.31 57.78 3m61 n LYS 223 Cb 0.53 -2.29 -0.06 0.00 0.02 0.00 0.00 35.03 33.23 3m61 n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3m61 n ASP 223 N 2.11 -4.90 -3.48 3.14 8.00 -1.26 -4.93 116.55 115.24 3m61 n ASP 223 Ca 0.12 0.36 -0.27 0.00 0.71 0.00 0.00 54.79 55.72 3m61 n ASP 223 Cb 0.30 -3.69 -0.10 0.00 -0.02 0.00 0.00 41.12 37.62 3m61 n ASP 223 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3m61 n LYS 224 N -2.40 0.73 -1.01 -1.24 4.76 -0.90 -4.24 118.16 113.86 3m61 n LYS 224 Ca -0.15 -3.54 -0.30 0.00 -2.87 0.00 0.00 58.31 51.46 3m61 n LYS 224 Cb 0.50 -1.77 0.17 0.00 -1.84 0.00 0.00 35.03 32.09 3m61 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3m61 s PRO 225 N -0.57 0.74 0.53 1.97 0.04 -1.26 -4.39 135.00 132.05 3m61 s PRO 225 Ca 0.32 0.89 -0.21 0.00 0.04 0.00 0.00 61.00 62.04 3m61 s PRO 225 Cb 0.05 -1.74 -0.06 0.00 0.04 0.00 0.00 34.50 32.78 3m61 s PRO 225 CO -0.17 -2.62 1.17 0.20 0.04 0.00 0.00 177.00 175.62 3m61 s GLY 226 N -3.16 2.72 -0.07 0.56 0.00 -0.54 -4.55 107.32 102.28 3m61 s GLY 226 Ca 0.65 0.93 0.04 0.00 0.00 0.00 0.00 44.72 46.34 3m61 s GLY 226 CO 0.59 1.33 -0.20 0.14 0.00 0.00 0.00 173.10 174.96 3m61 s VAL 227 N -1.63 1.72 0.03 1.40 1.01 0.38 -1.55 120.40 121.76 3m61 s VAL 227 Ca 0.71 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.91 3m61 s VAL 227 Cb -0.28 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 3m61 s VAL 227 CO 0.32 0.48 -0.19 -0.31 0.00 0.00 0.00 175.10 175.40 3m61 s TYR 228 N 0.26 1.65 0.18 5.22 1.51 0.34 -1.75 117.35 124.76 3m61 s TYR 228 Ca -0.12 -0.35 -0.31 0.00 -1.01 0.00 0.00 57.07 55.27 3m61 s TYR 228 Cb -0.15 -1.00 -0.09 0.00 -0.11 0.00 0.00 41.96 40.60 3m61 s TYR 228 CO 0.05 0.06 1.47 0.99 -1.11 0.00 0.00 175.55 177.01 3m61 s THR 229 N -0.73 2.85 -0.66 -0.71 2.01 0.08 -0.44 115.64 118.03 3m61 s THR 229 Ca 0.06 0.64 -0.24 0.00 0.31 0.00 0.00 61.69 62.46 3m61 s THR 229 Cb -0.08 -3.41 0.05 0.00 0.01 0.00 0.00 72.50 69.07 3m61 s THR 229 CO 0.01 0.07 1.06 -0.60 -0.69 0.00 0.00 174.62 174.47 3m61 s ARG 230 N 0.62 3.18 0.32 4.92 3.52 -0.03 -2.45 118.95 129.03 3m61 s ARG 230 Ca 0.65 -0.53 0.02 0.00 -0.13 0.00 0.00 55.73 55.73 3m61 s ARG 230 Cb -0.41 -4.18 0.55 0.00 -1.56 0.00 0.00 34.95 29.35 3m61 s ARG 230 CO 0.35 -1.85 1.91 0.28 -0.81 0.00 0.00 175.30 175.18 3m61 h VAL 231 N 6.00 1.19 0.00 7.11 2.07 -1.68 -1.72 116.25 129.22 3m61 h VAL 231 Ca -0.28 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.64 3m61 h VAL 231 Cb 1.06 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3m61 h VAL 231 CO 1.20 0.24 0.00 -1.54 0.02 0.00 0.00 177.57 177.48 3m61 n SER 232 N -4.34 0.00 -0.99 0.57 3.41 -1.26 -1.20 113.62 109.82 3m61 n SER 232 Ca 0.04 0.50 0.11 0.00 -0.26 0.00 0.00 58.87 59.27 3m61 n SER 232 Cb 0.16 -0.50 0.25 0.00 -0.26 0.00 0.00 64.21 63.86 3m61 n SER 232 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3m61 n HIS 233 N -1.50 0.41 -1.25 7.33 8.25 -0.65 -1.76 115.22 126.05 3m61 n HIS 233 Ca 0.01 -0.20 0.05 0.00 -0.26 0.00 0.00 57.72 57.32 3m61 n HIS 233 Cb 0.06 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.25 3m61 n HIS 233 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3m61 n PHE 234 N 1.17 0.00 -0.27 4.41 3.01 -0.34 -4.84 117.46 120.60 3m61 n PHE 234 Ca 0.18 -0.56 -0.05 0.00 1.01 0.00 0.00 57.45 58.03 3m61 n PHE 234 Cb 0.53 -0.10 0.09 0.00 -0.01 0.00 0.00 39.48 39.99 3m61 n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 3m61 h LEU 235 N 0.00 1.06 -0.67 4.37 3.38 -1.78 -0.01 115.31 121.67 3m61 h LEU 235 Ca 0.00 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 3m61 h LEU 235 Cb 1.07 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 3m61 h LEU 235 CO 0.00 0.95 0.02 -0.65 0.09 0.00 0.00 178.44 178.85 3m61 h PRO 236 N 1.12 1.06 -0.28 1.13 0.11 -1.94 -0.82 132.00 132.37 3m61 h PRO 236 Ca 0.26 -0.32 0.02 0.00 0.11 0.00 0.00 66.00 66.07 3m61 h PRO 236 Cb 0.22 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.20 3m61 h PRO 236 CO -0.02 1.02 0.13 2.35 -0.21 0.00 0.00 178.00 181.26 3m61 h TRP 237 N 0.97 0.23 -0.51 0.65 7.01 -1.83 -1.86 115.95 120.61 3m61 h TRP 237 Ca 0.18 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.20 3m61 h TRP 237 Cb 0.53 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.50 3m61 h TRP 237 CO 0.04 0.12 0.33 0.82 -2.79 0.00 0.00 178.44 176.96 3m61 h ILE 238 N 0.27 1.11 -0.55 2.65 2.04 -0.73 -2.34 117.51 119.96 3m61 h ILE 238 Ca 0.12 -0.23 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 3m61 h ILE 238 Cb 0.05 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 3m61 h ILE 238 CO -0.10 0.12 0.01 0.03 0.00 0.00 0.00 178.15 178.22 3m61 h ARG 239 N 0.67 0.96 -0.34 2.37 3.08 -0.98 -1.61 114.38 118.53 3m61 h ARG 239 Ca 0.19 -0.30 -0.10 0.00 0.07 0.00 0.00 59.98 59.84 3m61 h ARG 239 Cb -0.06 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3m61 h ARG 239 CO -0.05 0.96 -0.17 0.66 -1.07 0.00 0.00 179.97 180.30 3m61 h SER 240 N 0.84 0.74 1.83 7.04 4.64 -1.30 -3.29 113.55 124.05 3m61 h SER 240 Ca 0.16 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3m61 h SER 240 Cb 0.52 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3m61 h SER 240 CO 0.03 0.98 0.00 0.45 -0.87 0.00 0.00 176.83 177.42 3m61 h HIS 241 N 0.50 0.00 -0.01 4.77 3.86 -1.26 -2.84 115.15 120.17 3m61 h HIS 241 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3m61 h HIS 241 Cb 0.71 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.18 3m61 h HIS 241 CO 0.06 0.00 0.00 0.25 0.86 0.00 0.00 177.93 179.10 3m61 n THR 242 N -2.85 0.01 -0.95 2.45 -2.24 -0.62 -2.27 114.28 107.81 3m61 n THR 242 Ca 0.04 -0.02 0.05 0.00 -2.27 0.00 0.00 64.05 61.85 3m61 n THR 242 Cb 0.50 -0.33 0.37 0.00 -2.10 0.00 0.00 70.33 68.77 3m61 n THR 242 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3m61 n LYS 243 N -0.81 4.51 0.00 -0.78 5.02 -1.07 -5.10 118.16 119.93 3m61 n LYS 243 Ca 0.19 -3.13 0.06 0.00 -2.02 0.00 0.00 58.31 53.41 3m61 n LYS 243 Cb 0.11 -2.22 0.05 0.00 -0.02 0.00 0.00 35.03 32.94 3m61 n LYS 243 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27