#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4kbp s ASP 10 N 0.00 7.04 0.34 0.55 1.01 -1.26 -2.04 116.67 122.31 4kbp s ASP 10 Ca 0.00 2.24 -0.29 0.00 0.71 0.00 0.00 52.55 55.22 4kbp s ASP 10 Cb 0.00 -2.60 -0.11 0.00 1.01 0.00 0.00 42.92 41.21 4kbp s ASP 10 CO 0.00 -0.42 1.51 0.23 0.21 0.00 0.00 175.17 176.70 4kbp n MET 11 N 2.73 2.64 -1.45 8.23 2.81 0.29 -4.84 117.12 127.52 4kbp n MET 11 Ca 0.05 0.93 -0.32 0.00 -1.81 0.00 0.00 57.70 56.55 4kbp n MET 11 Cb 0.44 -2.67 0.08 0.00 -0.71 0.00 0.00 33.22 30.36 4kbp n MET 11 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 4kbp s PRO 12 N -1.50 2.35 0.50 0.03 0.04 -1.26 -4.91 135.00 130.25 4kbp s PRO 12 Ca 0.57 1.40 0.26 0.00 0.04 0.00 0.00 61.00 63.28 4kbp s PRO 12 Cb -0.49 -1.89 1.35 0.00 0.04 0.00 0.00 34.50 33.50 4kbp s PRO 12 CO 0.58 -1.60 1.90 -0.07 0.04 0.00 0.00 177.00 177.85 4kbp h LEU 13 N -0.55 0.12 -0.20 -3.56 3.38 -2.01 0.05 115.31 112.55 4kbp h LEU 13 Ca -0.46 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.53 4kbp h LEU 13 Cb 1.25 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.99 4kbp h LEU 13 CO 0.51 0.05 0.00 -2.24 0.09 0.00 0.00 178.44 176.85 4kbp h ASP 14 N 0.12 0.00 -1.01 -0.43 2.03 -1.97 -3.44 116.42 111.73 4kbp h ASP 14 Ca 0.41 0.00 -0.79 0.00 -0.73 0.00 0.00 57.03 55.92 4kbp h ASP 14 Cb 1.42 0.00 0.05 0.00 -0.83 0.00 0.00 39.33 39.97 4kbp h ASP 14 CO -0.06 0.00 0.09 -1.20 -1.03 0.00 0.00 179.24 177.04 4kbp n SER 15 N -2.47 0.06 -0.45 4.15 7.64 0.00 -4.67 113.62 117.88 4kbp n SER 15 Ca 0.04 1.16 0.41 0.00 1.01 0.00 0.00 58.87 61.50 4kbp n SER 15 Cb 0.41 -0.92 0.75 0.00 -1.01 0.00 0.00 64.21 63.44 4kbp n SER 15 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 4kbp h ASP 16 N 3.09 0.00 0.35 6.43 2.03 -1.90 0.17 116.42 126.58 4kbp h ASP 16 Ca -0.51 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 55.73 4kbp h ASP 16 Cb 1.43 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.92 4kbp h ASP 16 CO 0.66 0.00 -0.32 1.62 -1.03 0.00 0.00 179.24 180.17 4kbp h VAL 17 N 0.00 1.19 -0.02 4.15 3.04 -1.95 -3.02 116.25 119.65 4kbp h VAL 17 Ca 0.69 -1.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 4kbp h VAL 17 Cb 2.89 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 33.78 4kbp h VAL 17 CO -0.01 0.31 0.00 0.49 -1.01 0.00 0.00 177.57 177.36 4kbp n PHE 18 N -4.10 0.00 -1.68 3.17 3.72 0.59 -3.98 117.46 115.18 4kbp n PHE 18 Ca -0.02 -0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 4kbp n PHE 18 Cb 0.37 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.90 4kbp n PHE 18 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 4kbp n ARG 19 N 0.30 1.96 -3.46 -1.08 1.74 -1.14 -4.94 116.66 110.03 4kbp n ARG 19 Ca 0.18 0.69 -0.37 0.00 -0.77 0.00 0.00 57.85 57.58 4kbp n ARG 19 Cb 0.38 -2.23 -0.07 0.00 -1.02 0.00 0.00 32.46 29.53 4kbp n ARG 19 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 4kbp s VAL 20 N -1.09 5.26 0.18 1.55 0.11 -1.26 -5.01 120.40 120.13 4kbp s VAL 20 Ca 0.56 0.69 -0.33 0.00 -2.93 0.00 0.00 61.98 59.97 4kbp s VAL 20 Cb -0.60 -3.69 -0.15 0.00 -1.53 0.00 0.00 36.38 30.41 4kbp s VAL 20 CO 0.62 0.38 1.33 -0.81 -3.33 0.00 0.00 175.10 173.29 4kbp n PRO 21 N 3.52 1.58 -2.43 1.54 -0.04 -1.26 -4.92 135.00 132.99 4kbp n PRO 21 Ca -0.10 0.56 -0.34 0.00 -0.04 0.00 0.00 63.50 63.58 4kbp n PRO 21 Cb 0.52 -2.18 -0.02 0.00 -0.04 0.00 0.00 33.50 31.78 4kbp n PRO 21 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 4kbp s PRO 22 N -0.05 3.63 0.00 0.54 0.04 -1.26 -4.77 135.00 133.13 4kbp s PRO 22 Ca 0.74 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.22 4kbp s PRO 22 Cb -0.78 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 31.70 4kbp s PRO 22 CO 0.48 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.35 4kbp n GLY 23 N -0.15 3.57 3.68 0.56 0.00 -1.26 -4.85 105.19 106.75 4kbp n GLY 23 Ca 0.10 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 4kbp n GLY 23 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 4kbp s TYR 24 N -2.15 3.17 -1.14 1.61 5.04 -1.26 -3.46 117.35 119.16 4kbp s TYR 24 Ca 0.00 1.22 -0.13 0.00 -2.44 0.00 0.00 57.07 55.72 4kbp s TYR 24 Cb 0.00 -3.41 -0.03 0.00 0.35 0.00 0.00 41.96 38.87 4kbp s TYR 24 CO 0.00 -1.26 0.81 -1.71 -1.34 0.00 0.00 175.55 172.05 4kbp n ASN 25 N 5.40 -4.94 -4.72 4.32 4.05 -1.26 -3.33 115.26 114.79 4kbp n ASN 25 Ca 0.11 -0.89 -0.38 0.00 0.45 0.00 0.00 54.58 53.87 4kbp n ASN 25 Cb 0.46 -4.03 -0.06 0.00 1.23 0.00 0.00 39.78 37.38 4kbp n ASN 25 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 4kbp s ALA 26 N -3.48 3.46 -0.08 5.20 0.00 -1.22 -4.01 121.76 121.62 4kbp s ALA 26 Ca 0.38 -0.15 -0.35 0.00 0.00 0.00 0.00 51.96 51.85 4kbp s ALA 26 Cb -0.11 -2.69 -0.12 0.00 0.00 0.00 0.00 23.12 20.20 4kbp s ALA 26 CO 0.82 -0.03 1.83 -2.30 0.00 0.00 0.00 175.76 176.08 4kbp n PRO 27 N 3.72 2.06 -4.46 0.00 -0.02 -1.26 -4.68 135.00 130.36 4kbp n PRO 27 Ca -0.06 0.75 -0.22 0.00 -2.02 0.00 0.00 63.50 61.95 4kbp n PRO 27 Cb 0.52 -2.57 -0.11 0.00 -0.02 0.00 0.00 33.50 31.32 4kbp n PRO 27 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 4kbp s GLN 28 N 3.63 1.65 -1.34 -0.52 -2.07 0.70 -4.79 119.66 116.93 4kbp s GLN 28 Ca 0.92 -1.89 -0.09 0.00 -1.82 0.00 0.00 55.36 52.48 4kbp s GLN 28 Cb -0.73 -1.06 0.01 0.00 -1.09 0.00 0.00 33.01 30.14 4kbp s GLN 28 CO 0.51 -0.09 1.17 1.04 -1.32 0.00 0.00 175.29 176.60 4kbp n GLN 29 N -0.68 -7.86 -2.30 9.60 6.02 -1.26 -0.92 117.38 119.98 4kbp n GLN 29 Ca -0.04 0.82 -0.41 0.00 -0.01 0.00 0.00 57.00 57.36 4kbp n GLN 29 Cb 0.65 -5.84 -0.03 0.00 1.02 0.00 0.00 30.24 26.05 4kbp n GLN 29 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 4kbp s VAL 30 N -3.32 3.21 -0.18 5.09 1.01 -1.26 -4.43 120.40 120.52 4kbp s VAL 30 Ca 0.57 1.14 -0.24 0.00 0.00 0.00 0.00 61.98 63.45 4kbp s VAL 30 Cb -0.25 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.46 4kbp s VAL 30 CO 0.72 0.24 0.64 -1.38 0.00 0.00 0.00 175.10 175.32 4kbp s HIS 31 N -0.79 -0.67 0.38 5.22 -3.43 -0.43 -3.96 115.29 111.61 4kbp s HIS 31 Ca 0.49 1.49 0.06 0.00 -0.80 0.00 0.00 55.06 56.30 4kbp s HIS 31 Cb -0.35 0.28 -0.07 0.00 -1.43 0.00 0.00 32.58 31.00 4kbp s HIS 31 CO 0.44 -0.42 0.01 0.96 -2.00 0.00 0.00 174.74 173.73 4kbp s ILE 32 N -0.17 1.81 0.17 -5.38 -4.36 -0.20 -1.38 121.20 111.70 4kbp s ILE 32 Ca -0.04 -2.03 -0.24 0.00 -0.26 0.00 0.00 60.65 58.08 4kbp s ILE 32 Cb -0.03 -2.89 0.06 0.00 1.25 0.00 0.00 42.46 40.85 4kbp s ILE 32 CO 0.04 -0.04 0.85 -0.89 0.24 0.00 0.00 174.94 175.14 4kbp s THR 33 N -2.86 0.00 0.20 8.37 2.01 -1.01 -3.29 115.64 119.07 4kbp s THR 33 Ca 0.35 -0.64 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 4kbp s THR 33 Cb 0.09 -1.80 -0.09 0.00 0.01 0.00 0.00 72.50 70.70 4kbp s THR 33 CO 0.17 0.00 1.35 -1.58 -0.69 0.00 0.00 174.62 173.87 4kbp s GLN 34 N -3.50 4.35 0.00 4.92 0.74 -1.26 -0.23 119.66 124.68 4kbp s GLN 34 Ca 0.10 2.12 0.20 0.00 0.05 0.00 0.00 55.36 57.83 4kbp s GLN 34 Cb -0.03 -3.18 0.15 0.00 1.10 0.00 0.00 33.01 31.05 4kbp s GLN 34 CO 0.01 -0.31 1.12 0.41 -0.55 0.00 0.00 175.29 175.97 4kbp n GLY 35 N 2.44 0.53 1.80 2.59 0.00 -0.21 -4.17 105.19 108.17 4kbp n GLY 35 Ca 0.07 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 4kbp n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4kbp n ASP 36 N 1.04 -0.50 0.13 1.61 5.75 -1.26 -4.78 116.55 118.54 4kbp n ASP 36 Ca 0.11 -2.16 -0.01 0.00 -0.01 0.00 0.00 54.79 52.72 4kbp n ASP 36 Cb 0.49 1.07 0.14 0.00 -1.03 0.00 0.00 41.12 41.79 4kbp n ASP 36 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 4kbp h LEU 37 N 0.00 0.00 -1.34 -2.12 5.85 -1.89 -3.39 115.31 112.42 4kbp h LEU 37 Ca -0.14 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.58 4kbp h LEU 37 Cb 0.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.69 4kbp h LEU 37 CO 0.19 0.64 0.00 1.33 -0.34 0.00 0.00 178.44 180.26 4kbp n VAL 38 N -3.62 0.14 0.00 1.05 0.24 -1.26 0.24 118.33 115.12 4kbp n VAL 38 Ca -0.01 -0.57 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 4kbp n VAL 38 Cb 0.67 0.96 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 4kbp n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 4kbp n GLY 39 N 0.04 1.66 2.34 7.63 0.00 -1.26 -4.61 105.19 110.99 4kbp n GLY 39 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 4kbp n GLY 39 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 4kbp n ARG 40 N -0.10 2.86 -3.60 1.61 1.85 -1.26 -4.46 116.66 113.55 4kbp n ARG 40 Ca 0.00 -3.48 -0.16 0.00 -1.00 0.00 0.00 57.85 53.21 4kbp n ARG 40 Cb 0.00 -2.29 -0.07 0.00 -1.05 0.00 0.00 32.46 29.05 4kbp n ARG 40 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 4kbp s ALA 41 N -3.81 -1.59 0.05 2.89 0.00 -1.26 -1.63 121.76 116.42 4kbp s ALA 41 Ca 0.61 1.39 0.05 0.00 0.00 0.00 0.00 51.96 54.01 4kbp s ALA 41 Cb 0.48 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 4kbp s ALA 41 CO -0.05 -0.33 -0.14 -1.64 0.00 0.00 0.00 175.76 173.60 4kbp s MET 42 N -0.63 0.89 -0.26 0.00 -1.94 -0.47 -1.04 119.30 115.85 4kbp s MET 42 Ca -0.07 -0.85 -0.06 0.00 -1.71 0.00 0.00 55.69 53.00 4kbp s MET 42 Cb -0.02 -0.91 -0.01 0.00 2.01 0.00 0.00 34.83 35.90 4kbp s MET 42 CO 0.06 0.22 0.05 0.42 -0.01 0.00 0.00 175.02 175.75 4kbp s ILE 43 N -1.03 3.99 -0.18 2.53 1.01 0.68 -0.55 121.20 127.66 4kbp s ILE 43 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 60.65 60.13 4kbp s ILE 43 Cb -0.09 -2.93 -0.05 0.00 0.01 0.00 0.00 42.46 39.41 4kbp s ILE 43 CO 0.02 0.26 0.13 -0.63 0.00 0.00 0.00 174.94 174.71 4kbp s ILE 44 N 1.54 5.40 0.00 2.92 -1.09 0.15 -2.39 121.20 127.73 4kbp s ILE 44 Ca 0.05 0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.66 4kbp s ILE 44 Cb -0.16 -3.43 -0.01 0.00 -1.58 0.00 0.00 42.46 37.28 4kbp s ILE 44 CO 0.02 0.49 -0.05 -0.44 -1.23 0.00 0.00 174.94 173.73 4kbp s SER 45 N 0.00 0.57 0.36 3.58 0.01 -0.48 -0.52 113.70 117.22 4kbp s SER 45 Ca 0.10 -0.15 -0.15 0.00 1.31 0.00 0.00 55.95 57.05 4kbp s SER 45 Cb -0.11 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.12 4kbp s SER 45 CO -0.00 0.01 0.75 -1.66 0.41 0.00 0.00 173.24 172.75 4kbp s TRP 46 N -0.30 0.16 -0.02 2.43 -2.14 -0.38 -1.32 118.94 117.38 4kbp s TRP 46 Ca -0.00 -0.77 0.03 0.00 2.66 0.00 0.00 56.10 58.02 4kbp s TRP 46 Cb -0.03 0.73 0.00 0.00 -3.10 0.00 0.00 33.47 31.07 4kbp s TRP 46 CO -0.00 -1.48 -0.09 0.08 -2.66 0.00 0.00 176.95 172.80 4kbp s VAL 47 N -2.63 0.77 -0.05 -0.66 1.01 -0.10 -0.04 120.40 118.70 4kbp s VAL 47 Ca 0.16 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.83 4kbp s VAL 47 Cb -0.05 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 4kbp s VAL 47 CO 0.12 0.24 -0.19 0.42 0.00 0.00 0.00 175.10 175.69 4kbp s THR 48 N 0.12 2.66 -0.02 3.92 -4.23 -0.87 -0.21 115.64 117.00 4kbp s THR 48 Ca -0.02 -0.87 0.12 0.00 -1.18 0.00 0.00 61.69 59.74 4kbp s THR 48 Cb -0.08 -2.01 -0.18 0.00 1.34 0.00 0.00 72.50 71.58 4kbp s THR 48 CO 0.00 0.58 0.24 0.23 -0.54 0.00 0.00 174.62 175.13 4kbp n MET 49 N 2.54 0.46 0.02 3.99 2.81 -1.26 -0.62 117.12 125.06 4kbp n MET 49 Ca -0.17 -0.10 -0.19 0.00 -1.81 0.00 0.00 57.70 55.43 4kbp n MET 49 Cb 0.52 -1.28 -0.14 0.00 -0.71 0.00 0.00 33.22 31.61 4kbp n MET 49 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 4kbp h ASP 50 N 0.00 0.38 -5.01 7.83 3.32 -1.95 -3.47 116.42 117.52 4kbp h ASP 50 Ca -0.02 -0.93 -0.03 0.00 0.02 0.00 0.00 57.03 56.07 4kbp h ASP 50 Cb 0.60 -0.12 -0.13 0.00 0.22 0.00 0.00 39.33 39.89 4kbp h ASP 50 CO 0.00 1.37 0.16 -1.83 -1.72 0.00 0.00 179.24 177.22 4kbp s GLU 51 N -2.40 1.21 0.07 3.56 -1.05 -1.26 -5.05 118.70 113.78 4kbp s GLU 51 Ca -0.16 -0.41 -0.14 0.00 -0.15 0.00 0.00 54.97 54.12 4kbp s GLU 51 Cb 0.01 0.56 -0.03 0.00 -0.44 0.00 0.00 34.13 34.22 4kbp s GLU 51 CO 0.80 -0.50 0.88 -2.30 0.95 0.00 0.00 175.26 175.09 4kbp n PRO 52 N -0.16 -0.20 0.00 -4.83 -0.02 -1.26 -4.84 135.00 123.69 4kbp n PRO 52 Ca -0.17 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 4kbp n PRO 52 Cb 0.64 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 4kbp n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4kbp n GLY 53 N -1.11 -2.32 3.89 -1.23 0.00 -1.26 -4.80 105.19 98.36 4kbp n GLY 53 Ca 0.01 -1.59 -0.34 0.00 0.00 0.00 0.00 46.02 44.10 4kbp n GLY 53 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4kbp s SER 54 N -2.93 6.50 -0.27 1.61 0.15 -1.26 -4.99 113.70 112.51 4kbp s SER 54 Ca 0.00 0.57 0.12 0.00 0.70 0.00 0.00 55.95 57.34 4kbp s SER 54 Cb 0.00 -2.09 0.69 0.00 -1.71 0.00 0.00 66.02 62.91 4kbp s SER 54 CO 0.00 0.19 1.67 -1.20 1.20 0.00 0.00 173.24 175.10 4kbp n SER 55 N 0.78 4.55 -4.86 5.45 7.64 -1.26 -4.70 113.62 121.22 4kbp n SER 55 Ca -0.08 -3.18 -0.31 0.00 1.01 0.00 0.00 58.87 56.31 4kbp n SER 55 Cb 0.52 -0.68 -0.05 0.00 -1.01 0.00 0.00 64.21 63.00 4kbp n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4kbp s ALA 56 N -2.94 3.35 -0.05 -0.43 0.00 -1.26 -0.52 121.76 119.90 4kbp s ALA 56 Ca 0.51 -0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.40 4kbp s ALA 56 Cb 0.41 -2.72 0.01 0.00 0.00 0.00 0.00 23.12 20.82 4kbp s ALA 56 CO 0.11 0.17 -0.11 0.08 0.00 0.00 0.00 175.76 176.02 4kbp s VAL 57 N -2.17 1.01 -0.14 0.00 1.01 0.96 -4.52 120.40 116.54 4kbp s VAL 57 Ca 0.52 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 62.01 4kbp s VAL 57 Cb -0.10 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 4kbp s VAL 57 CO 0.24 0.32 0.09 -0.60 0.00 0.00 0.00 175.10 175.15 4kbp s ARG 58 N 0.56 3.62 0.08 2.72 3.52 -0.64 -0.73 118.95 128.08 4kbp s ARG 58 Ca -0.11 -0.26 -0.13 0.00 -0.13 0.00 0.00 55.73 55.09 4kbp s ARG 58 Cb -0.14 -3.15 0.02 0.00 -1.56 0.00 0.00 34.95 30.12 4kbp s ARG 58 CO 0.03 0.54 0.31 1.52 -0.81 0.00 0.00 175.30 176.88 4kbp s TYR 59 N -0.37 -0.08 0.07 5.12 1.13 0.43 0.55 117.35 124.21 4kbp s TYR 59 Ca 0.10 -0.19 -0.26 0.00 -1.41 0.00 0.00 57.07 55.31 4kbp s TYR 59 Cb -0.12 0.11 0.08 0.00 -1.10 0.00 0.00 41.96 40.94 4kbp s TYR 59 CO 0.02 -0.58 0.71 1.67 -2.51 0.00 0.00 175.55 174.86 4kbp s TRP 60 N -3.30 -0.49 0.28 -3.49 -2.14 -0.72 -0.05 118.94 109.04 4kbp s TRP 60 Ca 0.00 0.40 -0.05 0.00 2.66 0.00 0.00 56.10 59.11 4kbp s TRP 60 Cb 0.02 0.53 -0.05 0.00 -3.10 0.00 0.00 33.47 30.86 4kbp s TRP 60 CO -0.08 -0.71 0.55 -1.54 -2.66 0.00 0.00 176.95 172.51 4kbp s SER 61 N -2.42 6.45 0.28 -2.66 1.04 -1.23 -0.56 113.70 114.61 4kbp s SER 61 Ca 0.01 0.71 0.02 0.00 0.48 0.00 0.00 55.95 57.17 4kbp s SER 61 Cb -0.01 -2.14 0.59 0.00 0.10 0.00 0.00 66.02 64.55 4kbp s SER 61 CO -0.09 -0.18 1.81 -0.08 0.98 0.00 0.00 173.24 175.68 4kbp h GLU 62 N 1.75 0.85 0.00 4.02 4.81 -1.76 -3.23 114.58 121.02 4kbp h GLU 62 Ca -0.48 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 4kbp h GLU 62 Cb 1.19 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.38 4kbp h GLU 62 CO 0.66 0.56 0.00 0.36 -0.73 0.00 0.00 179.01 179.87 4kbp n LYS 63 N -4.70 0.00 -2.84 1.92 2.85 -1.26 -4.48 118.16 109.64 4kbp n LYS 63 Ca 0.19 0.42 -0.43 0.00 -1.05 0.00 0.00 58.31 57.44 4kbp n LYS 63 Cb 0.42 -1.05 -0.02 0.00 -0.65 0.00 0.00 35.03 33.73 4kbp n LYS 63 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 4kbp s ASN 64 N -2.50 6.76 0.00 -5.58 3.04 -1.24 -4.90 114.94 110.52 4kbp s ASN 64 Ca 0.00 -2.28 0.00 0.00 0.04 0.00 0.00 52.86 50.62 4kbp s ASN 64 Cb 0.00 -2.44 0.00 0.00 -1.54 0.00 0.00 41.25 37.27 4kbp s ASN 64 CO 0.00 -1.05 0.00 0.61 -3.04 0.00 0.00 177.10 173.62 4kbp n GLY 65 N 5.29 0.00 3.61 1.21 0.00 -1.22 -3.53 105.19 110.55 4kbp n GLY 65 Ca 0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 4kbp n GLY 65 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 4kbp s ARG 66 N -1.30 3.40 -0.12 1.61 3.52 -1.26 -4.86 118.95 119.95 4kbp s ARG 66 Ca 0.00 1.91 -0.30 0.00 -0.13 0.00 0.00 55.73 57.21 4kbp s ARG 66 Cb 0.00 -4.26 -0.01 0.00 -1.56 0.00 0.00 34.95 29.12 4kbp s ARG 66 CO 0.00 -1.79 1.04 0.15 -0.81 0.00 0.00 175.30 173.90 4kbp s LYS 67 N 5.71 4.39 0.30 5.12 1.02 -1.26 -4.48 119.74 130.52 4kbp s LYS 67 Ca 0.90 1.43 0.11 0.00 0.02 0.00 0.00 55.97 58.43 4kbp s LYS 67 Cb -0.31 -3.56 -0.05 0.00 -0.52 0.00 0.00 37.83 33.39 4kbp s LYS 67 CO 0.35 -0.39 -0.10 1.03 -0.92 0.00 0.00 175.35 175.32 4kbp s ARG 68 N 2.24 1.93 -0.06 1.68 0.52 0.93 -4.94 118.95 121.25 4kbp s ARG 68 Ca 0.49 -1.70 0.04 0.00 -0.52 0.00 0.00 55.73 54.04 4kbp s ARG 68 Cb -0.19 -1.89 0.00 0.00 0.52 0.00 0.00 34.95 33.39 4kbp s ARG 68 CO 0.17 0.28 -0.17 0.42 0.02 0.00 0.00 175.30 176.02 4kbp s ILE 69 N -2.48 1.44 0.01 1.52 1.01 -1.26 -0.42 121.20 121.02 4kbp s ILE 69 Ca 0.32 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.33 4kbp s ILE 69 Cb -0.04 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 4kbp s ILE 69 CO 0.17 0.42 -0.15 0.00 0.00 0.00 0.00 174.94 175.38 4kbp s ALA 70 N 0.24 2.71 -0.18 9.38 0.00 0.09 -4.92 121.76 129.07 4kbp s ALA 70 Ca -0.09 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.74 4kbp s ALA 70 Cb -0.13 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 4kbp s ALA 70 CO 0.03 0.58 -0.08 0.21 0.00 0.00 0.00 175.76 176.50 4kbp s LYS 71 N -1.29 3.36 0.00 0.00 2.36 -1.26 -0.03 119.74 122.88 4kbp s LYS 71 Ca 0.15 -0.66 0.00 0.00 -2.55 0.00 0.00 55.97 52.91 4kbp s LYS 71 Cb -0.11 -2.85 0.00 0.00 -1.05 0.00 0.00 37.83 33.83 4kbp s LYS 71 CO 0.05 -0.04 0.00 0.41 1.55 0.00 0.00 175.35 177.32 4kbp n GLY 72 N 4.30 2.87 3.24 5.54 0.00 0.32 -4.73 105.19 116.73 4kbp n GLY 72 Ca -0.18 -1.88 -0.14 0.00 0.00 0.00 0.00 46.02 43.82 4kbp n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4kbp s LYS 73 N 3.37 1.06 0.10 1.61 1.02 -0.55 -4.87 119.74 121.49 4kbp s LYS 73 Ca 0.00 -1.47 0.09 0.00 0.02 0.00 0.00 55.97 54.61 4kbp s LYS 73 Cb 0.00 -0.47 -0.04 0.00 -0.52 0.00 0.00 37.83 36.80 4kbp s LYS 73 CO 0.00 -0.01 -0.24 1.41 -0.92 0.00 0.00 175.35 175.59 4kbp s MET 74 N -3.81 1.33 0.18 1.68 -2.45 -1.26 -1.51 119.30 113.46 4kbp s MET 74 Ca 0.19 -1.22 -0.11 0.00 -1.25 0.00 0.00 55.69 53.29 4kbp s MET 74 Cb 0.04 -1.68 0.00 0.00 1.25 0.00 0.00 34.83 34.45 4kbp s MET 74 CO 0.01 0.40 0.36 -1.54 1.05 0.00 0.00 175.02 175.30 4kbp s SER 75 N -1.86 -0.04 0.06 1.11 1.04 0.63 -4.96 113.70 109.67 4kbp s SER 75 Ca 0.10 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.65 4kbp s SER 75 Cb -0.10 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.51 4kbp s SER 75 CO 0.05 -0.95 0.24 0.42 0.98 0.00 0.00 173.24 173.98 4kbp s THR 76 N -3.95 0.10 0.09 2.02 -4.23 -1.26 -0.17 115.64 108.25 4kbp s THR 76 Ca 0.15 -0.86 -0.10 0.00 -1.18 0.00 0.00 61.69 59.71 4kbp s THR 76 Cb 0.02 -1.02 0.00 0.00 1.34 0.00 0.00 72.50 72.84 4kbp s THR 76 CO -0.00 -0.47 0.22 -0.72 -0.54 0.00 0.00 174.62 173.11 4kbp s TYR 77 N -2.89 0.09 -0.05 3.99 -0.85 -1.26 -5.00 117.35 111.38 4kbp s TYR 77 Ca -0.03 -0.48 0.06 0.00 -0.52 0.00 0.00 57.07 56.10 4kbp s TYR 77 Cb 0.00 -0.01 -0.01 0.00 0.38 0.00 0.00 41.96 42.33 4kbp s TYR 77 CO -0.06 -0.56 -0.23 1.03 -1.52 0.00 0.00 175.55 174.21 4kbp s ARG 78 N -3.75 2.29 0.00 -3.49 0.52 -1.26 -0.71 118.95 112.55 4kbp s ARG 78 Ca 0.04 -0.84 0.00 0.00 -0.52 0.00 0.00 55.73 54.41 4kbp s ARG 78 Cb 0.04 -1.99 0.00 0.00 0.52 0.00 0.00 34.95 33.52 4kbp s ARG 78 CO -0.11 0.38 0.00 0.34 0.02 0.00 0.00 175.30 175.93 4kbp n PHE 79 N 2.90 0.00 0.00 -0.53 7.35 -0.86 -4.98 117.46 121.34 4kbp n PHE 79 Ca -0.17 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.52 4kbp n PHE 79 Cb 0.52 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.35 4kbp n PHE 79 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 4kbp n PHE 80 N -1.42 0.00 -0.35 -5.13 7.35 -1.26 -4.74 117.46 111.91 4kbp n PHE 80 Ca 0.00 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.79 4kbp n PHE 80 Cb 0.00 0.00 0.32 0.00 0.35 0.00 0.00 39.48 40.15 4kbp n PHE 80 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 4kbp n ASN 81 N -0.41 4.18 -4.90 -2.13 6.94 -1.26 -4.92 115.26 112.75 4kbp n ASN 81 Ca 0.00 -2.27 -0.29 0.00 -0.02 0.00 0.00 54.58 52.00 4kbp n ASN 81 Cb 0.00 -0.52 -0.04 0.00 -2.36 0.00 0.00 39.78 36.86 4kbp n ASN 81 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 4kbp s TYR 82 N -1.56 3.47 -0.12 -2.53 5.04 -1.26 -5.12 117.35 115.27 4kbp s TYR 82 Ca 0.47 0.59 -0.04 0.00 -2.44 0.00 0.00 57.07 55.65 4kbp s TYR 82 Cb 0.28 -2.05 0.06 0.00 0.35 0.00 0.00 41.96 40.60 4kbp s TYR 82 CO 0.26 0.28 0.14 -1.12 -1.34 0.00 0.00 175.55 173.77 4kbp s SER 83 N -2.93 1.27 1.06 4.32 0.01 -1.26 -2.02 113.70 114.15 4kbp s SER 83 Ca 0.43 -0.01 -0.12 0.00 1.31 0.00 0.00 55.95 57.56 4kbp s SER 83 Cb -0.11 0.11 0.23 0.00 0.21 0.00 0.00 66.02 66.46 4kbp s SER 83 CO 0.28 -0.28 1.07 -0.94 0.41 0.00 0.00 173.24 173.77 4kbp s SER 84 N 2.24 1.81 0.00 2.44 1.04 0.11 -5.01 113.70 116.34 4kbp s SER 84 Ca 0.04 1.73 0.00 0.00 0.48 0.00 0.00 55.95 58.20 4kbp s SER 84 Cb -0.14 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.61 4kbp s SER 84 CO -0.07 -3.72 0.00 0.61 0.98 0.00 0.00 173.24 171.04 4kbp n GLY 85 N 0.43 1.06 3.44 7.32 0.00 -1.26 -4.79 105.19 111.38 4kbp n GLY 85 Ca 0.06 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 4kbp n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4kbp s PHE 86 N 1.00 3.24 0.01 1.61 0.08 0.20 -4.61 117.98 119.52 4kbp s PHE 86 Ca 0.00 -0.67 -0.25 0.00 0.12 0.00 0.00 56.93 56.13 4kbp s PHE 86 Cb 0.00 -2.52 -0.05 0.00 -0.57 0.00 0.00 43.02 39.89 4kbp s PHE 86 CO 0.00 -0.58 0.77 0.42 -0.10 0.00 0.00 175.22 175.73 4kbp s ILE 87 N 1.64 4.83 0.00 0.64 1.01 0.76 -2.06 121.20 128.02 4kbp s ILE 87 Ca 0.04 1.62 0.07 0.00 0.00 0.00 0.00 60.65 62.38 4kbp s ILE 87 Cb -0.19 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.15 4kbp s ILE 87 CO 0.09 0.32 -0.23 -1.00 0.00 0.00 0.00 174.94 174.11 4kbp s HIS 88 N 0.26 2.07 -0.13 3.97 3.76 0.94 -0.27 115.29 125.89 4kbp s HIS 88 Ca 0.39 -0.39 -0.04 0.00 -0.15 0.00 0.00 55.06 54.87 4kbp s HIS 88 Cb -0.20 -1.30 0.05 0.00 1.11 0.00 0.00 32.58 32.24 4kbp s HIS 88 CO 0.22 0.01 0.07 -1.01 -0.85 0.00 0.00 174.74 173.19 4kbp s HIS 89 N -0.62 0.20 -0.03 1.40 3.76 -0.57 -1.24 115.29 118.20 4kbp s HIS 89 Ca 0.09 -0.15 0.04 0.00 -0.15 0.00 0.00 55.06 54.90 4kbp s HIS 89 Cb -0.09 -0.64 -0.01 0.00 1.11 0.00 0.00 32.58 32.95 4kbp s HIS 89 CO -0.00 -0.40 -0.14 0.99 -0.85 0.00 0.00 174.74 174.33 4kbp s THR 90 N 2.13 1.18 -0.19 1.30 2.01 0.32 -1.49 115.64 120.90 4kbp s THR 90 Ca 0.03 -0.60 -0.04 0.00 0.31 0.00 0.00 61.69 61.38 4kbp s THR 90 Cb -0.15 -1.01 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 4kbp s THR 90 CO -0.07 0.34 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.29 4kbp s THR 91 N -0.08 3.81 -0.20 -0.82 2.01 -1.26 0.32 115.64 119.42 4kbp s THR 91 Ca 0.00 -0.37 -0.11 0.00 0.31 0.00 0.00 61.69 61.52 4kbp s THR 91 Cb -0.08 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 4kbp s THR 91 CO 0.01 0.45 0.19 -0.63 -0.69 0.00 0.00 174.62 173.94 4kbp s ILE 92 N 0.89 5.36 0.43 1.82 1.01 0.29 -4.84 121.20 126.16 4kbp s ILE 92 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 60.65 61.01 4kbp s ILE 92 Cb -0.14 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.75 4kbp s ILE 92 CO 0.02 0.39 0.15 -0.13 0.00 0.00 0.00 174.94 175.36 4kbp s ARG 93 N 0.66 2.17 -1.34 2.79 0.52 -1.26 -1.37 118.95 121.12 4kbp s ARG 93 Ca 0.10 -1.94 -0.02 0.00 -0.52 0.00 0.00 55.73 53.35 4kbp s ARG 93 Cb -0.12 -1.89 -0.00 0.00 0.52 0.00 0.00 34.95 33.45 4kbp s ARG 93 CO 0.02 -0.15 0.58 1.63 0.02 0.00 0.00 175.30 177.40 4kbp n LYS 94 N -1.22 -3.90 -1.95 3.54 5.02 -0.90 -4.94 118.16 113.81 4kbp n LYS 94 Ca -0.03 0.51 -0.30 0.00 -2.02 0.00 0.00 58.31 56.47 4kbp n LYS 94 Cb 0.65 -4.82 0.03 0.00 -0.02 0.00 0.00 35.03 30.87 4kbp n LYS 94 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 4kbp s LEU 95 N -6.78 3.06 0.28 -0.35 1.43 -0.64 -5.05 118.68 110.63 4kbp s LEU 95 Ca 0.04 1.18 -0.10 0.00 -1.03 0.00 0.00 54.13 54.22 4kbp s LEU 95 Cb -0.01 -4.06 -0.07 0.00 0.03 0.00 0.00 46.19 42.08 4kbp s LEU 95 CO 0.85 -1.14 0.61 -0.54 0.23 0.00 0.00 176.35 176.36 4kbp s LYS 96 N -5.25 3.81 0.55 1.70 3.01 -1.26 -4.81 119.74 117.49 4kbp s LYS 96 Ca 0.56 0.32 -0.16 0.00 -1.01 0.00 0.00 55.97 55.69 4kbp s LYS 96 Cb -0.11 -2.58 -0.06 0.00 -1.01 0.00 0.00 37.83 34.07 4kbp s LYS 96 CO 0.52 0.23 1.01 0.71 0.51 0.00 0.00 175.35 178.33 4kbp s TYR 97 N -1.95 3.30 -1.17 3.18 2.02 -1.26 -4.17 117.35 117.30 4kbp s TYR 97 Ca 0.48 1.47 -0.17 0.00 -0.37 0.00 0.00 57.07 58.49 4kbp s TYR 97 Cb -0.11 -2.86 -0.01 0.00 -0.40 0.00 0.00 41.96 38.58 4kbp s TYR 97 CO 0.23 -0.65 0.76 -1.71 -1.57 0.00 0.00 175.55 172.61 4kbp n ASN 98 N -1.81 -4.70 -3.88 2.29 5.15 -0.49 -4.92 115.26 106.89 4kbp n ASN 98 Ca 0.07 -0.99 -0.11 0.00 -0.60 0.00 0.00 54.58 52.95 4kbp n ASN 98 Cb 0.54 -3.50 -0.12 0.00 -0.53 0.00 0.00 39.78 36.17 4kbp n ASN 98 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 4kbp s THR 99 N -3.52 0.04 0.04 -0.44 2.01 -1.24 -4.87 115.64 107.66 4kbp s THR 99 Ca 0.40 -0.34 -0.20 0.00 0.31 0.00 0.00 61.69 61.87 4kbp s THR 99 Cb -0.14 -0.20 -0.06 0.00 0.01 0.00 0.00 72.50 72.11 4kbp s THR 99 CO 0.85 -0.19 0.59 -0.75 -0.69 0.00 0.00 174.62 174.44 4kbp s LYS 100 N -0.57 4.27 0.11 4.92 2.20 -1.26 -0.81 119.74 128.60 4kbp s LYS 100 Ca -0.06 0.75 0.06 0.00 -0.36 0.00 0.00 55.97 56.36 4kbp s LYS 100 Cb -0.04 -3.29 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 4kbp s LYS 100 CO 0.00 0.51 -0.15 0.71 -0.36 0.00 0.00 175.35 176.06 4kbp s TYR 101 N -0.69 1.45 0.00 4.03 1.51 0.59 -1.95 117.35 122.30 4kbp s TYR 101 Ca 0.30 -0.51 0.07 0.00 -1.01 0.00 0.00 57.07 55.92 4kbp s TYR 101 Cb -0.19 -0.77 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 4kbp s TYR 101 CO 0.18 0.15 -0.20 0.71 -1.11 0.00 0.00 175.55 175.29 4kbp s TYR 102 N -1.83 2.52 0.01 2.71 2.02 0.28 -1.56 117.35 121.51 4kbp s TYR 102 Ca 0.07 -0.29 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 4kbp s TYR 102 Cb -0.07 -1.51 -0.01 0.00 -0.40 0.00 0.00 41.96 39.98 4kbp s TYR 102 CO 0.03 0.16 -0.04 1.52 -1.57 0.00 0.00 175.55 175.65 4kbp s TYR 103 N -0.79 0.31 0.03 2.71 -0.85 0.73 -1.75 117.35 117.74 4kbp s TYR 103 Ca 0.12 -0.24 0.08 0.00 -0.52 0.00 0.00 57.07 56.52 4kbp s TYR 103 Cb -0.10 -0.20 -0.03 0.00 0.38 0.00 0.00 41.96 42.01 4kbp s TYR 103 CO 0.02 -0.06 -0.23 -1.21 -1.52 0.00 0.00 175.55 172.55 4kbp s GLU 104 N -0.66 1.61 0.02 -3.49 2.02 0.19 0.08 118.70 118.48 4kbp s GLU 104 Ca -0.05 -0.98 0.01 0.00 0.02 0.00 0.00 54.97 53.97 4kbp s GLU 104 Cb -0.05 -1.72 -0.02 0.00 0.10 0.00 0.00 34.13 32.44 4kbp s GLU 104 CO -0.00 0.45 -0.05 0.54 0.02 0.00 0.00 175.26 176.22 4kbp s VAL 105 N -0.76 0.32 0.00 2.63 0.11 0.18 -1.62 120.40 121.26 4kbp s VAL 105 Ca 0.09 -0.73 0.00 0.00 -2.93 0.00 0.00 61.98 58.42 4kbp s VAL 105 Cb -0.09 -0.38 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 4kbp s VAL 105 CO 0.01 -0.27 0.00 0.61 -3.33 0.00 0.00 175.10 172.12 4kbp n GLY 106 N 2.00 0.83 0.26 6.54 0.00 -1.26 -0.99 105.19 112.56 4kbp n GLY 106 Ca -0.20 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.52 4kbp n GLY 106 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 4kbp h LEU 107 N 0.00 0.21 -0.00 0.99 3.38 -1.84 -2.90 115.31 115.16 4kbp h LEU 107 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 4kbp h LEU 107 Cb 0.55 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 4kbp h LEU 107 CO 0.00 0.27 -0.00 0.03 0.09 0.00 0.00 178.44 178.83 4kbp h ARG 108 N 0.24 0.00 0.00 1.13 3.08 -1.94 -3.46 114.38 113.43 4kbp h ARG 108 Ca 0.06 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 4kbp h ARG 108 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 4kbp h ARG 108 CO 0.00 0.48 0.00 0.09 -1.07 0.00 0.00 179.97 179.48 4kbp n ASN 109 N -4.86 0.00 -4.49 7.04 4.13 -1.21 -5.01 115.26 110.87 4kbp n ASN 109 Ca -0.08 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.75 4kbp n ASN 109 Cb 0.25 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.40 4kbp n ASN 109 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 4kbp s THR 110 N 0.00 5.11 0.13 3.41 2.01 -1.21 -5.01 115.64 120.08 4kbp s THR 110 Ca 0.00 -0.31 -0.19 0.00 0.31 0.00 0.00 61.69 61.50 4kbp s THR 110 Cb 0.00 -4.00 -0.07 0.00 0.01 0.00 0.00 72.50 68.43 4kbp s THR 110 CO 0.00 -0.37 0.62 -0.89 -0.69 0.00 0.00 174.62 173.29 4kbp s THR 111 N 2.09 4.67 -0.01 -0.82 2.01 -1.10 -4.33 115.64 118.16 4kbp s THR 111 Ca 0.12 1.23 0.04 0.00 0.31 0.00 0.00 61.69 63.38 4kbp s THR 111 Cb -0.17 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.43 4kbp s THR 111 CO 0.13 0.43 -0.12 -0.13 -0.69 0.00 0.00 174.62 174.24 4kbp s ARG 112 N -1.43 0.96 0.05 4.92 0.52 -0.16 -4.96 118.95 118.84 4kbp s ARG 112 Ca 0.34 -0.42 0.06 0.00 -0.52 0.00 0.00 55.73 55.19 4kbp s ARG 112 Cb -0.19 -0.93 -0.04 0.00 0.52 0.00 0.00 34.95 34.32 4kbp s ARG 112 CO 0.20 0.25 -0.11 0.50 0.02 0.00 0.00 175.30 176.16 4kbp s ARG 113 N -0.25 2.28 0.35 3.54 3.52 -1.26 -0.65 118.95 126.49 4kbp s ARG 113 Ca 0.04 -0.89 -0.00 0.00 -0.13 0.00 0.00 55.73 54.75 4kbp s ARG 113 Cb -0.05 -2.35 -0.00 0.00 -1.56 0.00 0.00 34.95 30.99 4kbp s ARG 113 CO -0.00 0.55 0.46 -0.06 -0.81 0.00 0.00 175.30 175.44 4kbp s PHE 114 N -1.04 1.23 0.02 5.12 0.08 0.11 -4.98 117.98 118.53 4kbp s PHE 114 Ca 0.18 -1.40 -0.18 0.00 0.12 0.00 0.00 56.93 55.65 4kbp s PHE 114 Cb -0.11 -0.19 0.03 0.00 -0.57 0.00 0.00 43.02 42.18 4kbp s PHE 114 CO 0.09 -1.12 0.41 -1.54 -0.10 0.00 0.00 175.22 172.95 4kbp s SER 115 N -3.28 -0.28 0.15 1.36 1.04 -1.26 -0.19 113.70 111.23 4kbp s SER 115 Ca 0.32 0.07 -0.10 0.00 0.48 0.00 0.00 55.95 56.73 4kbp s SER 115 Cb -0.00 0.40 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 4kbp s SER 115 CO 0.23 -0.61 0.28 0.72 0.98 0.00 0.00 173.24 174.84 4kbp s PHE 116 N -2.11 0.27 -0.12 5.02 -0.12 -0.60 -4.49 117.98 115.83 4kbp s PHE 116 Ca -0.08 -0.65 0.03 0.00 -0.05 0.00 0.00 56.93 56.18 4kbp s PHE 116 Cb -0.02 -0.01 0.01 0.00 -0.63 0.00 0.00 43.02 42.37 4kbp s PHE 116 CO 0.00 -0.69 -0.21 0.42 -0.05 0.00 0.00 175.22 174.70 4kbp s ILE 117 N -3.93 1.93 0.70 -4.49 1.01 -1.26 -0.30 121.20 114.86 4kbp s ILE 117 Ca 0.13 -0.91 -0.14 0.00 0.00 0.00 0.00 60.65 59.72 4kbp s ILE 117 Cb 0.03 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.83 4kbp s ILE 117 CO -0.04 0.53 1.14 0.42 0.00 0.00 0.00 174.94 176.99 4kbp s THR 118 N 0.71 2.93 0.75 2.92 -4.23 0.01 -4.83 115.64 113.89 4kbp s THR 118 Ca -0.11 0.42 -0.07 0.00 -1.18 0.00 0.00 61.69 60.76 4kbp s THR 118 Cb -0.16 -2.93 0.10 0.00 1.34 0.00 0.00 72.50 70.85 4kbp s THR 118 CO 0.01 -0.28 1.05 -2.16 -0.54 0.00 0.00 174.62 172.71 4kbp s PRO 119 N -4.13 1.82 0.83 3.99 0.04 -1.26 -2.75 135.00 133.54 4kbp s PRO 119 Ca 0.69 -0.49 -0.11 0.00 0.04 0.00 0.00 61.00 61.13 4kbp s PRO 119 Cb -0.23 -2.16 0.09 0.00 0.04 0.00 0.00 34.50 32.24 4kbp s PRO 119 CO 0.44 -1.47 1.10 -2.14 0.04 0.00 0.00 177.00 174.97 4kbp s PRO 120 N -5.32 1.76 0.52 0.56 0.02 -1.26 -1.39 135.00 129.89 4kbp s PRO 120 Ca 0.64 1.14 -0.22 0.00 0.02 0.00 0.00 61.00 62.58 4kbp s PRO 120 Cb -0.08 -1.84 -0.06 0.00 0.02 0.00 0.00 34.50 32.54 4kbp s PRO 120 CO 0.46 -1.98 1.27 -1.14 -0.33 0.00 0.00 177.00 175.28 4kbp s GLN 121 N -4.86 3.34 0.33 5.54 0.74 -1.26 -4.23 119.66 119.27 4kbp s GLN 121 Ca 0.63 2.03 -0.29 0.00 0.05 0.00 0.00 55.36 57.77 4kbp s GLN 121 Cb -0.18 -2.28 -0.12 0.00 1.10 0.00 0.00 33.01 31.53 4kbp s GLN 121 CO 0.57 -0.96 1.45 0.25 -0.55 0.00 0.00 175.29 176.05 4kbp n THR 122 N -0.89 1.67 -3.61 -0.34 -2.24 -1.26 -4.71 114.28 102.89 4kbp n THR 122 Ca 0.10 -0.42 -0.09 0.00 -2.27 0.00 0.00 64.05 61.37 4kbp n THR 122 Cb 0.47 -1.81 -0.02 0.00 -2.10 0.00 0.00 70.33 66.87 4kbp n THR 122 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 4kbp s GLY 123 N 0.01 -0.38 0.15 3.38 0.00 -1.05 -4.99 107.32 104.43 4kbp s GLY 123 Ca 0.58 0.32 -0.15 0.00 0.00 0.00 0.00 44.72 45.46 4kbp s GLY 123 CO 0.58 0.10 1.73 -2.00 0.00 0.00 0.00 173.10 173.52 4kbp h LEU 124 N 2.00 0.57 -3.23 0.66 5.85 -1.80 -3.20 115.31 116.17 4kbp h LEU 124 Ca -0.26 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.34 4kbp h LEU 124 Cb 1.27 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.15 4kbp h LEU 124 CO 0.30 0.53 0.00 0.47 -0.34 0.00 0.00 178.44 179.40 4kbp n ASP 125 N -4.67 3.74 -4.64 1.25 8.00 -1.26 -3.78 116.55 115.19 4kbp n ASP 125 Ca 0.01 -3.00 -0.43 0.00 0.71 0.00 0.00 54.79 52.08 4kbp n ASP 125 Cb 0.10 -0.53 -0.02 0.00 -0.02 0.00 0.00 41.12 40.65 4kbp n ASP 125 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 4kbp s VAL 126 N -2.80 4.24 0.59 2.53 1.01 -1.21 -4.73 120.40 120.03 4kbp s VAL 126 Ca 0.41 1.44 -0.11 0.00 0.00 0.00 0.00 61.98 63.72 4kbp s VAL 126 Cb 0.33 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 4kbp s VAL 126 CO 0.08 -0.33 0.99 -2.16 0.00 0.00 0.00 175.10 173.69 4kbp s PRO 127 N 3.84 3.64 -0.19 2.72 0.04 -1.26 -3.58 135.00 140.20 4kbp s PRO 127 Ca 0.55 0.70 -0.30 0.00 0.04 0.00 0.00 61.00 61.99 4kbp s PRO 127 Cb -0.18 -2.13 0.14 0.00 0.04 0.00 0.00 34.50 32.37 4kbp s PRO 127 CO 0.19 -0.48 1.08 -0.47 0.04 0.00 0.00 177.00 177.35 4kbp s TYR 128 N -3.05 -0.29 -0.14 0.56 5.04 -1.00 -4.86 117.35 113.61 4kbp s TYR 128 Ca 0.54 0.50 0.01 0.00 -2.44 0.00 0.00 57.07 55.68 4kbp s TYR 128 Cb -0.11 0.46 0.02 0.00 0.35 0.00 0.00 41.96 42.68 4kbp s TYR 128 CO 0.50 -0.27 -0.18 -0.08 -1.34 0.00 0.00 175.55 174.18 4kbp s THR 129 N -1.11 1.79 -0.05 4.34 -1.32 -1.26 -1.19 115.64 116.83 4kbp s THR 129 Ca 0.01 -0.79 -0.03 0.00 -1.21 0.00 0.00 61.69 59.67 4kbp s THR 129 Cb -0.01 -1.62 -0.04 0.00 -1.51 0.00 0.00 72.50 69.33 4kbp s THR 129 CO -0.01 0.50 0.12 -0.36 -2.21 0.00 0.00 174.62 172.65 4kbp s PHE 130 N 1.14 3.43 0.19 9.09 0.08 -0.27 -0.27 117.98 131.36 4kbp s PHE 130 Ca -0.01 0.33 -0.00 0.00 0.12 0.00 0.00 56.93 57.37 4kbp s PHE 130 Cb -0.14 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 4kbp s PHE 130 CO -0.06 0.62 0.36 0.20 -0.10 0.00 0.00 175.22 176.24 4kbp s GLY 131 N -1.51 1.80 -0.18 4.36 0.00 0.32 -0.86 107.32 111.26 4kbp s GLY 131 Ca 0.21 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 44.07 4kbp s GLY 131 CO 0.11 -0.83 -0.08 1.08 0.00 0.00 0.00 173.10 173.38 4kbp s LEU 132 N -3.26 1.89 -0.01 0.66 1.02 0.32 -0.57 118.68 118.72 4kbp s LEU 132 Ca 0.38 -0.73 0.02 0.00 0.02 0.00 0.00 54.13 53.82 4kbp s LEU 132 Cb -0.11 -1.07 -0.00 0.00 0.02 0.00 0.00 46.19 45.03 4kbp s LEU 132 CO 0.29 -0.15 -0.08 -0.63 0.02 0.00 0.00 176.35 175.80 4kbp s ILE 133 N 1.52 0.63 -0.06 -0.59 1.01 -1.03 -0.75 121.20 121.93 4kbp s ILE 133 Ca 0.00 -0.31 -0.12 0.00 0.00 0.00 0.00 60.65 60.22 4kbp s ILE 133 Cb -0.15 -0.55 0.02 0.00 0.01 0.00 0.00 42.46 41.79 4kbp s ILE 133 CO -0.08 0.19 0.30 -0.83 0.00 0.00 0.00 174.94 174.52 4kbp s GLY 134 N -0.00 -0.18 -1.31 6.18 0.00 -1.13 -1.56 107.32 109.32 4kbp s GLY 134 Ca 0.00 0.55 -0.08 0.00 0.00 0.00 0.00 44.72 45.19 4kbp s GLY 134 CO -0.00 0.39 1.11 1.22 0.00 0.00 0.00 173.10 175.82 4kbp n ASP 135 N 2.06 -6.20 0.40 1.64 8.00 -0.04 -2.68 116.55 119.73 4kbp n ASP 135 Ca -0.18 -0.50 -0.16 0.00 0.71 0.00 0.00 54.79 54.66 4kbp n ASP 135 Cb 0.57 -4.84 -0.08 0.00 -0.02 0.00 0.00 41.12 36.76 4kbp n ASP 135 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 4kbp h LEU 136 N -2.53 -0.87 0.00 0.64 5.85 -1.75 -0.71 115.31 115.94 4kbp h LEU 136 Ca -0.54 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.21 4kbp h LEU 136 Cb 1.35 0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.61 4kbp h LEU 136 CO 0.54 -0.61 0.00 0.61 -0.34 0.00 0.00 178.44 178.64 4kbp n GLY 137 N -1.37 -0.20 2.74 3.75 0.00 -0.21 -1.59 105.19 108.31 4kbp n GLY 137 Ca -0.13 -1.05 -0.05 0.00 0.00 0.00 0.00 46.02 44.79 4kbp n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4kbp n GLN 138 N 0.00 1.40 -2.62 1.61 10.64 -1.24 -4.87 117.38 122.30 4kbp n GLN 138 Ca 0.00 -3.23 -0.22 0.00 -1.83 0.00 0.00 57.00 51.72 4kbp n GLN 138 Cb 0.00 -1.29 0.06 0.00 -0.86 0.00 0.00 30.24 28.15 4kbp n GLN 138 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 4kbp s SER 139 N -3.26 4.95 0.35 2.61 1.04 -1.19 -0.55 113.70 117.65 4kbp s SER 139 Ca 0.26 -0.14 0.03 0.00 0.48 0.00 0.00 55.95 56.58 4kbp s SER 139 Cb 0.40 -0.56 0.65 0.00 0.10 0.00 0.00 66.02 66.61 4kbp s SER 139 CO -0.00 -1.40 2.01 -0.26 0.98 0.00 0.00 173.24 174.56 4kbp h PHE 140 N -0.15 0.78 -0.90 5.02 0.04 -1.74 0.77 116.94 120.77 4kbp h PHE 140 Ca -0.40 0.02 0.12 0.00 2.80 0.00 0.00 57.97 60.51 4kbp h PHE 140 Cb 1.29 -0.26 -0.08 0.00 2.20 0.00 0.00 35.95 39.09 4kbp h PHE 140 CO 0.19 0.49 0.53 -0.44 -0.60 0.00 0.00 178.31 178.47 4kbp h ASP 141 N 0.84 0.74 -0.76 2.17 3.32 -1.91 0.27 116.42 121.10 4kbp h ASP 141 Ca 0.23 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.33 4kbp h ASP 141 Cb -0.08 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 4kbp h ASP 141 CO -0.05 0.38 0.42 0.28 -1.72 0.00 0.00 179.24 178.55 4kbp h SER 142 N 0.83 0.94 -0.78 6.45 0.02 -0.98 -1.01 113.55 119.01 4kbp h SER 142 Ca 0.46 -0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.35 4kbp h SER 142 Cb 0.50 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 4kbp h SER 142 CO -0.28 0.76 0.49 -1.13 -1.14 0.00 0.00 176.83 175.53 4kbp h ASN 143 N 1.04 0.80 0.07 3.07 -1.24 -0.17 -0.29 115.58 118.85 4kbp h ASN 143 Ca 0.27 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.28 4kbp h ASN 143 Cb 0.02 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 38.91 4kbp h ASN 143 CO -0.04 0.54 -0.03 0.74 -1.29 0.00 0.00 177.43 177.34 4kbp h THR 144 N 0.94 1.03 -0.22 -3.57 2.02 -0.20 -1.70 112.91 111.20 4kbp h THR 144 Ca 0.32 -0.30 0.05 0.00 0.77 0.00 0.00 66.41 67.25 4kbp h THR 144 Cb 0.06 1.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.65 4kbp h THR 144 CO -0.13 0.08 -0.08 0.74 0.37 0.00 0.00 175.52 176.50 4kbp h THR 145 N -0.22 0.73 -0.82 3.16 2.02 -0.53 0.16 112.91 117.41 4kbp h THR 145 Ca -0.01 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.28 4kbp h THR 145 Cb 0.19 0.73 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 4kbp h THR 145 CO 0.01 0.00 0.53 0.25 0.37 0.00 0.00 175.52 176.69 4kbp h LEU 146 N -0.04 0.64 0.25 2.58 5.85 -0.85 -0.60 115.31 123.15 4kbp h LEU 146 Ca 0.11 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 4kbp h LEU 146 Cb 0.21 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.13 4kbp h LEU 146 CO -0.25 0.37 -0.12 0.28 -0.34 0.00 0.00 178.44 178.38 4kbp h SER 147 N 0.70 -0.29 -1.01 1.25 0.02 0.16 -1.04 113.55 113.34 4kbp h SER 147 Ca 0.39 -0.22 0.28 0.00 -0.84 0.00 0.00 61.79 61.39 4kbp h SER 147 Cb 0.54 0.07 -0.13 0.00 0.14 0.00 0.00 62.40 63.02 4kbp h SER 147 CO -0.16 0.11 0.59 0.45 -1.14 0.00 0.00 176.83 176.68 4kbp h HIS 148 N -0.74 0.97 -0.36 3.45 3.86 -0.53 0.45 115.15 122.25 4kbp h HIS 148 Ca -0.03 0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 4kbp h HIS 148 Cb 0.49 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 4kbp h HIS 148 CO 0.04 -0.02 0.03 -0.92 0.86 0.00 0.00 177.93 177.91 4kbp h TYR 149 N 0.48 0.67 0.00 2.45 3.20 -0.76 -0.62 116.97 122.40 4kbp h TYR 149 Ca 0.68 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 62.43 4kbp h TYR 149 Cb 1.41 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.50 4kbp h TYR 149 CO -0.01 0.70 -0.05 0.93 -1.64 0.00 0.00 178.16 178.09 4kbp h GLU 150 N 0.45 0.00 0.00 1.82 5.08 0.11 -2.64 114.58 119.40 4kbp h GLU 150 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 4kbp h GLU 150 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 4kbp h GLU 150 CO 0.01 0.05 -0.74 1.28 -1.00 0.00 0.00 179.01 178.61 4kbp n LEU 151 N -4.44 0.65 -4.69 1.33 4.77 0.42 -4.92 117.00 110.11 4kbp n LEU 151 Ca -0.03 -0.12 -0.61 0.00 -0.03 0.00 0.00 56.01 55.22 4kbp n LEU 151 Cb 0.14 -0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 40.99 4kbp n LEU 151 CO 0.34 0.13 1.16 -1.20 -1.33 0.00 0.00 177.39 176.50 4kbp n SER 152 N -1.62 1.72 -0.12 -1.43 7.64 -0.29 -4.77 113.62 114.76 4kbp n SER 152 Ca 0.04 1.12 0.10 0.00 1.01 0.00 0.00 58.87 61.15 4kbp n SER 152 Cb 0.36 -1.04 0.45 0.00 -1.01 0.00 0.00 64.21 62.97 4kbp n SER 152 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 4kbp h PRO 153 N 5.85 0.52 -5.09 1.43 0.13 -1.90 -3.24 132.00 129.71 4kbp h PRO 153 Ca -0.46 -0.03 -0.68 0.00 -0.87 0.00 0.00 66.00 63.96 4kbp h PRO 153 Cb 1.35 -0.12 -0.17 0.00 0.13 0.00 0.00 31.00 32.19 4kbp h PRO 153 CO 0.92 0.34 0.07 -1.59 -0.23 0.00 0.00 178.00 177.51 4kbp s LYS 154 N -5.49 3.16 0.08 0.86 -2.85 -1.26 -5.01 119.74 109.23 4kbp s LYS 154 Ca -0.08 -0.75 -0.30 0.00 -1.00 0.00 0.00 55.97 53.84 4kbp s LYS 154 Cb 0.20 -4.06 -0.05 0.00 -2.06 0.00 0.00 37.83 31.86 4kbp s LYS 154 CO 0.76 -1.16 0.97 -1.59 0.10 0.00 0.00 175.35 174.42 4kbp s LYS 155 N 2.69 4.66 0.57 1.78 0.00 -1.22 -5.04 119.74 123.19 4kbp s LYS 155 Ca 0.17 1.45 -0.18 0.00 0.00 0.00 0.00 55.97 57.41 4kbp s LYS 155 Cb -0.18 -3.40 -0.04 0.00 0.00 0.00 0.00 37.83 34.21 4kbp s LYS 155 CO 0.14 0.14 1.09 0.20 0.00 0.00 0.00 175.35 176.92 4kbp s GLY 156 N 0.28 2.37 0.00 0.59 0.00 -1.26 -4.81 107.32 104.49 4kbp s GLY 156 Ca 0.48 0.61 0.01 0.00 0.00 0.00 0.00 44.72 45.82 4kbp s GLY 156 CO 0.29 0.95 0.39 -1.06 0.00 0.00 0.00 173.10 173.67 4kbp n GLN 157 N -1.69 1.21 -3.65 2.90 6.02 0.63 -4.97 117.38 117.83 4kbp n GLN 157 Ca 0.10 -0.40 -0.02 0.00 -0.01 0.00 0.00 57.00 56.68 4kbp n GLN 157 Cb 0.52 -0.88 -0.07 0.00 1.02 0.00 0.00 30.24 30.83 4kbp n GLN 157 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 4kbp s THR 158 N -0.34 0.00 -0.13 5.09 2.01 -1.25 -4.60 115.64 116.43 4kbp s THR 158 Ca 0.01 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 4kbp s THR 158 Cb 0.01 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.47 4kbp s THR 158 CO 0.01 0.00 0.23 -0.69 -0.69 0.00 0.00 174.62 173.48 4kbp s VAL 159 N 0.81 5.35 -0.37 3.82 1.01 -0.85 -0.52 120.40 129.66 4kbp s VAL 159 Ca -0.04 0.41 -0.13 0.00 0.00 0.00 0.00 61.98 62.22 4kbp s VAL 159 Cb -0.04 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.82 4kbp s VAL 159 CO -0.12 0.51 0.25 -0.76 0.00 0.00 0.00 175.10 174.98 4kbp s LEU 160 N -0.35 4.77 -0.21 3.92 1.43 0.27 -0.72 118.68 127.78 4kbp s LEU 160 Ca 0.16 -0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 52.37 4kbp s LEU 160 Cb -0.13 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 4kbp s LEU 160 CO 0.04 -0.35 0.31 0.12 0.23 0.00 0.00 176.35 176.70 4kbp s PHE 161 N 1.66 3.36 -0.55 0.29 2.19 -0.17 -2.46 117.98 122.29 4kbp s PHE 161 Ca 0.05 0.47 0.12 0.00 0.33 0.00 0.00 56.93 57.90 4kbp s PHE 161 Cb -0.18 -2.42 0.67 0.00 -1.31 0.00 0.00 43.02 39.77 4kbp s PHE 161 CO 0.09 0.03 1.52 0.28 1.83 0.00 0.00 175.22 178.98 4kbp n VAL 162 N 4.27 2.13 0.00 3.12 0.31 -0.60 -2.67 118.33 124.88 4kbp n VAL 162 Ca -0.11 -1.12 0.00 0.00 -0.01 0.00 0.00 64.34 63.10 4kbp n VAL 162 Cb 0.51 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 4kbp n VAL 162 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 4kbp n GLY 163 N 0.62 2.62 2.63 2.92 0.00 -1.18 -4.24 105.19 108.56 4kbp n GLY 163 Ca 0.23 -1.94 -0.03 0.00 0.00 0.00 0.00 46.02 44.28 4kbp n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 4kbp n ASP 164 N 0.00 -7.35 -0.03 1.61 9.92 -1.26 -0.86 116.55 118.57 4kbp n ASP 164 Ca 0.00 0.95 -0.00 0.00 -0.53 0.00 0.00 54.79 55.21 4kbp n ASP 164 Cb 0.00 -4.90 -0.00 0.00 -0.64 0.00 0.00 41.12 35.58 4kbp n ASP 164 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 4kbp h LEU 165 N 2.33 0.00 0.00 0.64 4.07 -1.91 -3.18 115.31 117.26 4kbp h LEU 165 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 4kbp h LEU 165 Cb 0.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.11 4kbp h LEU 165 CO 0.13 0.34 -0.27 -1.54 -1.08 0.00 0.00 178.44 176.01 4kbp n SER 166 N -3.80 0.94 -1.70 -0.43 3.41 -1.26 -1.04 113.62 109.74 4kbp n SER 166 Ca -0.00 -0.44 -0.17 0.00 -0.26 0.00 0.00 58.87 58.00 4kbp n SER 166 Cb 0.01 1.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.94 4kbp n SER 166 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 4kbp n TYR 167 N -1.14 -0.48 0.23 7.33 4.02 -1.26 -4.48 117.16 121.38 4kbp n TYR 167 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 4kbp n TYR 167 Cb 0.03 -3.25 0.55 0.00 -0.02 0.00 0.00 39.34 36.65 4kbp n TYR 167 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 4kbp h ALA 168 N 0.48 1.44 0.00 -0.72 0.00 -1.88 -2.33 119.26 116.25 4kbp h ALA 168 Ca -0.39 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.34 4kbp h ALA 168 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 4kbp h ALA 168 CO 0.50 0.26 0.00 -0.40 0.00 0.00 0.00 179.25 179.60 4kbp n ASP 169 N -3.97 0.00 0.15 0.00 5.75 -1.26 -0.95 116.55 116.28 4kbp n ASP 169 Ca -0.02 0.15 0.09 0.00 -0.01 0.00 0.00 54.79 55.00 4kbp n ASP 169 Cb 0.29 -0.28 0.07 0.00 -1.03 0.00 0.00 41.12 40.16 4kbp n ASP 169 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 4kbp h ARG 170 N 0.00 0.00 -7.32 0.11 3.08 -1.78 -3.42 114.38 105.05 4kbp h ARG 170 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 4kbp h ARG 170 Cb 0.09 0.00 0.06 0.00 0.08 0.00 0.00 29.97 30.19 4kbp h ARG 170 CO 0.00 0.12 0.40 0.71 -1.07 0.00 0.00 179.97 180.13 4kbp s TYR 171 N -3.18 3.51 0.36 3.04 2.02 -0.12 -4.98 117.35 118.00 4kbp s TYR 171 Ca 0.03 1.35 -0.28 0.00 -0.37 0.00 0.00 57.07 57.80 4kbp s TYR 171 Cb 0.07 -2.76 -0.10 0.00 -0.40 0.00 0.00 41.96 38.77 4kbp s TYR 171 CO 0.73 -0.70 1.35 -1.25 -1.57 0.00 0.00 175.55 174.11 4kbp s PRO 172 N -4.90 4.19 -1.15 -1.71 0.04 -1.26 -1.94 135.00 128.26 4kbp s PRO 172 Ca 0.56 2.28 -0.01 0.00 0.04 0.00 0.00 61.00 63.88 4kbp s PRO 172 Cb -0.11 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.47 4kbp s PRO 172 CO 0.49 -0.35 0.05 0.09 0.04 0.00 0.00 177.00 177.32 4kbp n ASN 173 N 0.54 -4.15 -2.26 6.66 5.03 -1.26 -0.63 115.26 119.19 4kbp n ASN 173 Ca 0.01 0.13 -0.10 0.00 0.87 0.00 0.00 54.58 55.49 4kbp n ASN 173 Cb 0.42 -3.51 -0.01 0.00 -1.02 0.00 0.00 39.78 35.66 4kbp n ASN 173 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 4kbp n HIS 174 N -3.52 -1.38 0.00 3.10 8.25 -0.82 -4.38 115.22 116.48 4kbp n HIS 174 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 4kbp n HIS 174 Cb 0.61 -2.33 0.00 0.00 1.12 0.00 0.00 29.99 29.40 4kbp n HIS 174 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 4kbp n ASP 175 N -1.46 0.00 0.00 0.41 -0.08 0.20 -4.47 116.55 111.15 4kbp n ASP 175 Ca -0.11 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.17 4kbp n ASP 175 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 4kbp n ASP 175 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 4kbp n ASN 176 N 0.00 0.00 -0.01 1.67 5.03 -1.26 -1.49 115.26 119.20 4kbp n ASN 176 Ca 0.00 0.15 -0.03 0.00 0.87 0.00 0.00 54.58 55.57 4kbp n ASN 176 Cb 0.00 -0.15 0.21 0.00 -1.02 0.00 0.00 39.78 38.82 4kbp n ASN 176 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 4kbp h VAL 177 N 0.00 1.25 0.00 2.41 2.07 -1.98 -1.08 116.25 118.92 4kbp h VAL 177 Ca 0.00 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.37 4kbp h VAL 177 Cb 0.08 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 4kbp h VAL 177 CO 0.00 0.38 0.00 0.54 0.02 0.00 0.00 177.57 178.51 4kbp n ARG 178 N -4.16 0.09 0.03 1.57 5.12 -0.56 -0.08 116.66 118.68 4kbp n ARG 178 Ca 0.00 0.53 -0.13 0.00 -1.93 0.00 0.00 57.85 56.32 4kbp n ARG 178 Cb 0.37 -1.77 -0.14 0.00 -1.16 0.00 0.00 32.46 29.75 4kbp n ARG 178 CO 0.00 0.00 0.00 -1.49 -1.93 0.00 0.00 177.63 174.21 4kbp h TRP 179 N 0.00 0.26 -0.18 -1.55 4.06 -1.40 -2.91 115.95 114.23 4kbp h TRP 179 Ca 0.00 -0.19 -0.08 0.00 2.06 0.00 0.00 58.89 60.68 4kbp h TRP 179 Cb 0.07 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.22 4kbp h TRP 179 CO 0.00 1.25 -0.19 -0.44 -3.56 0.00 0.00 178.44 175.50 4kbp h ASP 180 N 0.04 0.48 -0.35 -3.49 3.32 -0.30 -2.15 116.42 113.97 4kbp h ASP 180 Ca -0.23 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 56.32 4kbp h ASP 180 Cb 1.98 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 41.38 4kbp h ASP 180 CO 0.13 0.86 0.15 0.71 -1.72 0.00 0.00 179.24 179.37 4kbp h THR 181 N 0.10 1.18 -1.00 0.35 1.35 -1.01 -2.38 112.91 111.49 4kbp h THR 181 Ca 0.03 -0.54 0.07 0.00 -0.55 0.00 0.00 66.41 65.42 4kbp h THR 181 Cb 0.73 0.89 -0.07 0.00 -1.73 0.00 0.00 68.15 67.98 4kbp h THR 181 CO 0.05 0.19 0.65 -0.25 -0.25 0.00 0.00 175.52 175.91 4kbp h TRP 182 N 0.41 1.20 0.00 4.73 7.01 -1.50 0.12 115.95 127.92 4kbp h TRP 182 Ca 0.12 0.03 -0.07 0.00 2.11 0.00 0.00 58.89 61.07 4kbp h TRP 182 Cb 0.17 -0.39 -0.01 0.00 -2.10 0.00 0.00 29.16 26.82 4kbp h TRP 182 CO -0.01 0.61 -0.35 0.78 -2.79 0.00 0.00 178.44 176.68 4kbp h GLY 183 N 1.16 0.00 1.28 2.65 0.00 -1.09 -0.99 103.07 106.09 4kbp h GLY 183 Ca 0.44 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.43 4kbp h GLY 183 CO -0.18 0.00 -1.48 3.21 0.00 0.00 0.00 176.54 178.09 4kbp h ARG 184 N 0.00 0.53 0.15 4.80 3.08 -0.77 -3.07 114.38 119.10 4kbp h ARG 184 Ca -0.00 -0.91 0.01 0.00 0.07 0.00 0.00 59.98 59.15 4kbp h ARG 184 Cb 0.72 0.34 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 4kbp h ARG 184 CO 0.05 1.43 -0.20 0.35 -1.07 0.00 0.00 179.97 180.53 4kbp h PHE 185 N 0.14 -0.51 0.00 3.04 3.57 -0.40 -2.97 116.94 119.80 4kbp h PHE 185 Ca -0.25 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.25 4kbp h PHE 185 Cb 2.17 0.21 0.00 0.00 2.79 0.00 0.00 35.95 41.11 4kbp h PHE 185 CO 0.13 -0.29 0.00 0.25 -2.23 0.00 0.00 178.31 176.17 4kbp n THR 186 N -5.32 0.58 -0.35 4.41 -2.24 -0.41 -4.11 114.28 106.83 4kbp n THR 186 Ca -0.07 0.03 0.17 0.00 -2.27 0.00 0.00 64.05 61.91 4kbp n THR 186 Cb 0.23 -0.79 0.38 0.00 -2.10 0.00 0.00 70.33 68.06 4kbp n THR 186 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 4kbp h GLU 187 N 0.00 0.58 -0.02 -0.78 4.81 -1.42 0.11 114.58 117.86 4kbp h GLU 187 Ca 0.00 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 4kbp h GLU 187 Cb 0.47 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 4kbp h GLU 187 CO 0.00 0.38 0.20 0.07 -0.73 0.00 0.00 179.01 178.93 4kbp h ARG 188 N 0.60 0.00 0.00 1.92 0.11 -1.78 -0.03 114.38 115.20 4kbp h ARG 188 Ca 0.64 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.66 4kbp h ARG 188 Cb 1.20 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.27 4kbp h ARG 188 CO -0.46 0.00 -1.01 0.45 0.10 0.00 0.00 179.97 179.06 4kbp n SER 189 N -3.05 1.71 0.29 0.08 2.88 0.33 -4.68 113.62 111.18 4kbp n SER 189 Ca -0.02 0.28 0.20 0.00 -1.33 0.00 0.00 58.87 58.00 4kbp n SER 189 Cb 0.27 -0.64 0.98 0.00 -0.75 0.00 0.00 64.21 64.06 4kbp n SER 189 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 4kbp h VAL 190 N -0.77 0.00 0.00 2.46 2.07 -1.34 -0.87 116.25 117.81 4kbp h VAL 190 Ca -0.09 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.29 4kbp h VAL 190 Cb 0.89 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 4kbp h VAL 190 CO -0.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.54 4kbp n ALA 191 N -2.03 2.01 -0.02 1.67 0.00 -0.03 -1.03 120.51 121.08 4kbp n ALA 191 Ca -0.02 0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 4kbp n ALA 191 Cb 0.13 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.11 4kbp n ALA 191 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 4kbp n TYR 192 N -2.15 0.00 -4.15 0.00 4.01 -0.40 -4.59 117.16 109.89 4kbp n TYR 192 Ca 0.04 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.63 4kbp n TYR 192 Cb 0.33 -0.26 -0.14 0.00 -0.31 0.00 0.00 39.34 38.96 4kbp n TYR 192 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 4kbp s GLN 193 N -2.22 0.41 0.63 -0.72 -2.07 -0.82 -4.35 119.66 110.51 4kbp s GLN 193 Ca -0.03 -0.18 -0.19 0.00 -1.82 0.00 0.00 55.36 53.15 4kbp s GLN 193 Cb 0.02 -0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 31.53 4kbp s GLN 193 CO 0.25 0.11 1.28 -1.25 -1.32 0.00 0.00 175.29 174.36 4kbp s PRO 194 N -0.11 2.70 -0.07 9.60 0.04 -1.26 -4.19 135.00 141.71 4kbp s PRO 194 Ca 0.02 2.03 0.05 0.00 0.04 0.00 0.00 61.00 63.14 4kbp s PRO 194 Cb -0.02 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 4kbp s PRO 194 CO -0.00 -1.47 -0.25 -1.58 0.04 0.00 0.00 177.00 173.74 4kbp s TRP 195 N -1.43 2.47 -0.19 0.56 0.52 -1.21 -2.01 118.94 117.66 4kbp s TRP 195 Ca 0.80 -0.85 -0.17 0.00 0.02 0.00 0.00 56.10 55.91 4kbp s TRP 195 Cb -0.36 -1.63 -0.04 0.00 -1.15 0.00 0.00 33.47 30.29 4kbp s TRP 195 CO 0.39 -0.29 0.45 0.42 0.02 0.00 0.00 176.95 177.93 4kbp s ILE 196 N 0.03 5.16 0.07 2.03 -1.09 0.10 -4.69 121.20 122.82 4kbp s ILE 196 Ca -0.09 0.82 -0.15 0.00 -2.23 0.00 0.00 60.65 58.99 4kbp s ILE 196 Cb -0.15 -3.78 -0.06 0.00 -1.58 0.00 0.00 42.46 36.89 4kbp s ILE 196 CO 0.06 0.23 0.48 0.26 -1.23 0.00 0.00 174.94 174.74 4kbp s TRP 197 N 1.36 3.70 -0.03 3.97 0.52 -1.26 -1.00 118.94 126.20 4kbp s TRP 197 Ca 0.21 1.05 0.02 0.00 0.02 0.00 0.00 56.10 57.40 4kbp s TRP 197 Cb -0.15 -2.34 0.01 0.00 -1.15 0.00 0.00 33.47 29.84 4kbp s TRP 197 CO 0.09 0.56 -0.07 0.99 0.02 0.00 0.00 176.95 178.54 4kbp s THR 198 N -1.23 0.62 -0.09 2.01 2.01 -1.09 -4.99 115.64 112.89 4kbp s THR 198 Ca 0.30 -0.25 -0.25 0.00 0.31 0.00 0.00 61.69 61.79 4kbp s THR 198 Cb -0.17 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 4kbp s THR 198 CO 0.17 0.21 0.79 0.00 -0.69 0.00 0.00 174.62 175.09 4kbp s ALA 199 N 0.35 3.36 0.54 7.40 0.00 -1.26 -3.08 121.76 129.07 4kbp s ALA 199 Ca -0.05 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.12 4kbp s ALA 199 Cb -0.09 -3.10 0.03 0.00 0.00 0.00 0.00 23.12 19.95 4kbp s ALA 199 CO 0.00 -0.29 0.28 0.20 0.00 0.00 0.00 175.76 175.95 4kbp s GLY 200 N 0.95 2.59 0.42 0.00 0.00 -1.26 -4.56 107.32 105.47 4kbp s GLY 200 Ca 0.40 -0.92 0.12 0.00 0.00 0.00 0.00 44.72 44.32 4kbp s GLY 200 CO 0.18 -2.03 1.97 3.45 0.00 0.00 0.00 173.10 176.68 4kbp h ASN 201 N 0.91 0.13 0.45 1.64 -1.07 -1.97 -1.36 115.58 114.32 4kbp h ASN 201 Ca -0.39 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 55.96 4kbp h ASN 201 Cb 1.31 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 37.53 4kbp h ASN 201 CO 0.62 0.27 0.00 1.41 0.07 0.00 0.00 177.43 179.80 4kbp n HIS 202 N -4.33 0.00 0.09 4.14 8.25 -1.26 -1.75 115.22 120.36 4kbp n HIS 202 Ca -0.01 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.54 4kbp n HIS 202 Cb 0.23 -0.45 -0.02 0.00 1.12 0.00 0.00 29.99 30.86 4kbp n HIS 202 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 4kbp n GLU 203 N -1.45 0.61 -0.02 -0.41 4.71 -0.52 -4.41 120.64 119.16 4kbp n GLU 203 Ca 0.04 0.12 -0.10 0.00 -0.01 0.00 0.00 57.16 57.21 4kbp n GLU 203 Cb 0.16 -1.81 -0.04 0.00 -1.01 0.00 0.00 31.44 28.74 4kbp n GLU 203 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 4kbp h ILE 204 N 0.00 0.95 -6.40 -3.67 2.04 -1.36 -3.19 117.51 105.87 4kbp h ILE 204 Ca -0.03 -0.03 -0.48 0.00 1.00 0.00 0.00 64.86 65.32 4kbp h ILE 204 Cb 1.09 0.84 0.01 0.00 -0.74 0.00 0.00 36.82 38.02 4kbp h ILE 204 CO 0.01 0.02 -0.91 -0.62 0.00 0.00 0.00 178.15 176.64 4kbp n GLU 205 N -5.07 -2.41 -2.95 2.37 1.02 -1.26 -0.74 120.64 111.61 4kbp n GLU 205 Ca -0.04 0.41 -0.43 0.00 -0.02 0.00 0.00 57.16 57.08 4kbp n GLU 205 Cb 0.07 -4.29 -0.05 0.00 -0.02 0.00 0.00 31.44 27.15 4kbp n GLU 205 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 4kbp s PHE 206 N -3.74 2.88 -0.61 -0.32 5.36 -1.26 -4.74 117.98 115.54 4kbp s PHE 206 Ca 0.21 -0.23 0.06 0.00 -0.96 0.00 0.00 56.93 56.01 4kbp s PHE 206 Cb -0.08 -3.90 0.23 0.00 -0.34 0.00 0.00 43.02 38.94 4kbp s PHE 206 CO 0.88 -1.25 0.65 0.00 -1.46 0.00 0.00 175.22 174.04 4kbp n ALA 207 N 7.02 3.67 -0.35 11.12 0.00 0.53 -4.95 120.51 137.55 4kbp n ALA 207 Ca -0.01 -4.47 0.13 0.00 0.00 0.00 0.00 53.44 49.09 4kbp n ALA 207 Cb 0.47 -0.91 0.33 0.00 0.00 0.00 0.00 19.45 19.34 4kbp n ALA 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 4kbp h PRO 208 N 4.46 0.72 -0.96 0.00 0.11 -1.92 -1.56 132.00 132.85 4kbp h PRO 208 Ca 0.18 -0.04 0.15 0.00 0.11 0.00 0.00 66.00 66.39 4kbp h PRO 208 Cb 0.72 -0.16 -0.08 0.00 0.11 0.00 0.00 31.00 31.58 4kbp h PRO 208 CO 0.74 0.48 0.61 0.93 -0.21 0.00 0.00 178.00 180.55 4kbp h GLU 209 N 0.75 0.78 -0.47 1.05 3.07 -1.92 0.18 114.58 118.01 4kbp h GLU 209 Ca 0.59 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.36 59.33 4kbp h GLU 209 Cb 0.94 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 28.63 4kbp h GLU 209 CO -0.39 0.51 0.06 0.44 -1.40 0.00 0.00 179.01 178.23 4kbp n ILE 210 N -4.63 2.61 -1.87 3.13 -5.35 -0.67 -4.94 119.36 107.63 4kbp n ILE 210 Ca 0.20 -1.77 -0.20 0.00 -0.27 0.00 0.00 62.75 60.70 4kbp n ILE 210 Cb 0.47 -0.29 -0.06 0.00 -1.74 0.00 0.00 39.64 38.02 4kbp n ILE 210 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 4kbp n ASN 211 N -0.18 -5.60 -4.27 7.28 3.02 0.64 -4.91 115.26 111.24 4kbp n ASN 211 Ca 0.29 0.32 -0.41 0.00 -0.03 0.00 0.00 54.58 54.76 4kbp n ASN 211 Cb 1.12 -4.80 -0.09 0.00 -0.61 0.00 0.00 39.78 35.39 4kbp n ASN 211 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 4kbp s GLU 212 N -4.18 2.63 -0.09 3.52 0.41 -0.69 -4.92 118.70 115.38 4kbp s GLU 212 Ca 0.00 -1.51 0.13 0.00 -0.41 0.00 0.00 54.97 53.19 4kbp s GLU 212 Cb 0.00 -3.86 0.20 0.00 -1.78 0.00 0.00 34.13 28.70 4kbp s GLU 212 CO 0.00 -1.01 1.09 0.25 -0.49 0.00 0.00 175.26 175.10 4kbp n THR 213 N 4.95 1.42 -3.51 3.63 -2.24 -1.26 -0.34 114.28 116.93 4kbp n THR 213 Ca -0.10 -1.68 -0.42 0.00 -2.27 0.00 0.00 64.05 59.57 4kbp n THR 213 Cb 0.43 -0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.55 4kbp n THR 213 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 4kbp s GLU 214 N -2.11 2.86 0.48 -0.78 2.12 -1.26 -4.95 118.70 115.05 4kbp s GLU 214 Ca 0.22 -1.20 -0.22 0.00 0.36 0.00 0.00 54.97 54.13 4kbp s GLU 214 Cb 0.20 -3.90 -0.09 0.00 0.26 0.00 0.00 34.13 30.59 4kbp s GLU 214 CO 0.02 -0.84 0.99 -2.30 -0.54 0.00 0.00 175.26 172.59 4kbp n PRO 215 N 5.08 1.23 -1.77 4.30 -0.02 -1.26 -2.88 135.00 139.67 4kbp n PRO 215 Ca -0.11 0.45 -0.20 0.00 -2.02 0.00 0.00 63.50 61.61 4kbp n PRO 215 Cb 0.45 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.78 4kbp n PRO 215 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 4kbp n PHE 216 N -0.88 -0.23 0.35 6.00 3.72 0.09 -4.92 117.46 121.59 4kbp n PHE 216 Ca 0.10 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.37 4kbp n PHE 216 Cb 0.42 -3.47 -0.07 0.00 -0.94 0.00 0.00 39.48 35.43 4kbp n PHE 216 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 4kbp h LYS 217 N 0.00 -0.87 -0.83 -1.08 3.64 -1.75 0.15 116.57 115.83 4kbp h LYS 217 Ca -0.42 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.02 4kbp h LYS 217 Cb 1.31 0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 33.29 4kbp h LYS 217 CO 0.59 -0.58 0.55 -1.35 -2.27 0.00 0.00 179.45 176.38 4kbp h PRO 218 N -0.94 1.10 -0.03 1.90 0.11 -1.89 -1.37 132.00 130.88 4kbp h PRO 218 Ca -0.09 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.96 4kbp h PRO 218 Cb 0.69 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 4kbp h PRO 218 CO 0.15 0.73 -0.03 0.35 -0.21 0.00 0.00 178.00 178.99 4kbp h PHE 219 N 1.13 -0.07 0.00 0.65 3.57 -1.79 -2.15 116.94 118.28 4kbp h PHE 219 Ca 0.30 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.75 4kbp h PHE 219 Cb -0.12 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 4kbp h PHE 219 CO 0.00 -0.05 -0.26 0.66 -2.23 0.00 0.00 178.31 176.43 4kbp h SER 220 N -0.04 0.00 -0.26 0.41 4.64 -0.11 0.14 113.55 118.34 4kbp h SER 220 Ca 0.02 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.18 4kbp h SER 220 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 4kbp h SER 220 CO -0.06 0.26 -0.47 1.88 -0.87 0.00 0.00 176.83 177.57 4kbp h TYR 221 N 0.00 0.96 0.11 4.77 0.05 -0.89 -3.36 116.97 118.61 4kbp h TYR 221 Ca -0.00 -0.34 -0.27 0.00 0.05 0.00 0.00 58.73 58.16 4kbp h TYR 221 Cb 0.46 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 38.02 4kbp h TYR 221 CO 0.00 1.14 -1.28 0.00 -1.05 0.00 0.00 178.16 176.97 4kbp h ARG 222 N 0.51 0.23 -5.00 4.88 3.08 -1.00 -3.45 114.38 113.63 4kbp h ARG 222 Ca 0.01 -0.39 -0.67 0.00 0.07 0.00 0.00 59.98 59.01 4kbp h ARG 222 Cb 1.07 0.14 -0.34 0.00 0.08 0.00 0.00 29.97 30.92 4kbp h ARG 222 CO 0.11 1.15 -0.82 0.71 -1.07 0.00 0.00 179.97 180.05 4kbp s TYR 223 N -2.65 2.91 0.21 3.04 2.02 0.46 -4.98 117.35 118.36 4kbp s TYR 223 Ca -0.04 -1.66 0.07 0.00 -0.37 0.00 0.00 57.07 55.06 4kbp s TYR 223 Cb 0.07 -1.96 -0.04 0.00 -0.40 0.00 0.00 41.96 39.63 4kbp s TYR 223 CO 0.87 -0.78 0.11 -1.01 -1.57 0.00 0.00 175.55 173.16 4kbp s HIS 224 N 1.29 3.00 0.04 2.71 3.76 -1.26 -4.54 115.29 120.29 4kbp s HIS 224 Ca 0.02 -0.11 -0.04 0.00 -0.15 0.00 0.00 55.06 54.79 4kbp s HIS 224 Cb -0.15 -1.40 -0.02 0.00 1.11 0.00 0.00 32.58 32.13 4kbp s HIS 224 CO -0.10 0.54 0.05 0.14 -0.85 0.00 0.00 174.74 174.52 4kbp s VAL 225 N -1.97 0.16 0.00 -0.90 -7.23 -1.26 -4.95 120.40 104.25 4kbp s VAL 225 Ca 0.31 -1.29 -0.05 0.00 -1.81 0.00 0.00 61.98 59.14 4kbp s VAL 225 Cb -0.09 -1.03 -0.23 0.00 0.56 0.00 0.00 36.38 35.60 4kbp s VAL 225 CO 0.22 -0.71 3.37 -0.81 -0.31 0.00 0.00 175.10 176.86 4kbp n PRO 226 N 0.62 1.84 0.27 4.82 -0.04 -1.26 -4.62 135.00 136.63 4kbp n PRO 226 Ca -0.18 -0.84 0.11 0.00 -0.04 0.00 0.00 63.50 62.54 4kbp n PRO 226 Cb 0.59 -1.85 0.72 0.00 -0.04 0.00 0.00 33.50 32.92 4kbp n PRO 226 CO 0.00 0.00 0.00 0.10 -0.04 0.00 0.00 175.50 175.56 4kbp h TYR 227 N 2.70 0.00 0.00 0.54 -0.00 -1.91 0.14 116.97 118.44 4kbp h TYR 227 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.89 4kbp h TYR 227 Cb 1.44 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.17 4kbp h TYR 227 CO 1.55 0.06 0.00 0.39 -0.00 0.00 0.00 178.16 180.16 4kbp n GLU 228 N -4.12 0.15 -0.17 0.10 4.71 -1.26 -2.85 120.64 117.20 4kbp n GLU 228 Ca -0.03 0.22 -0.09 0.00 -0.01 0.00 0.00 57.16 57.25 4kbp n GLU 228 Cb 0.14 -1.71 0.01 0.00 -1.01 0.00 0.00 31.44 28.87 4kbp n GLU 228 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 4kbp h ALA 229 N 2.57 0.64 -2.11 0.62 0.00 -1.05 -3.39 119.26 116.53 4kbp h ALA 229 Ca 0.00 -0.20 -0.44 0.00 0.00 0.00 0.00 54.91 54.27 4kbp h ALA 229 Cb 0.53 -0.19 0.16 0.00 0.00 0.00 0.00 17.79 18.30 4kbp h ALA 229 CO 0.00 0.32 0.35 -1.12 0.00 0.00 0.00 179.25 178.80 4kbp s SER 230 N -6.10 2.77 -0.75 0.00 0.01 -1.13 -4.80 113.70 103.70 4kbp s SER 230 Ca -0.13 0.45 -0.02 0.00 1.31 0.00 0.00 55.95 57.57 4kbp s SER 230 Cb 0.11 -0.62 0.40 0.00 0.21 0.00 0.00 66.02 66.12 4kbp s SER 230 CO 0.79 -2.96 1.99 0.00 0.41 0.00 0.00 173.24 173.46 4kbp n GLN 231 N -3.95 2.77 -1.80 12.44 3.00 -1.26 -4.93 117.38 123.65 4kbp n GLN 231 Ca 0.13 -3.47 -0.32 0.00 -0.01 0.00 0.00 57.00 53.33 4kbp n GLN 231 Cb 0.60 -2.28 0.04 0.00 0.00 0.00 0.00 30.24 28.59 4kbp n GLN 231 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 4kbp s SER 232 N -1.54 5.34 -0.06 1.08 0.15 -1.13 -4.97 113.70 112.58 4kbp s SER 232 Ca 0.57 1.87 0.11 0.00 0.70 0.00 0.00 55.95 59.20 4kbp s SER 232 Cb 0.47 -2.53 0.29 0.00 -1.71 0.00 0.00 66.02 62.53 4kbp s SER 232 CO -0.23 -1.47 1.22 0.35 1.20 0.00 0.00 173.24 174.32 4kbp n THR 233 N -2.45 1.40 -3.71 6.45 -2.24 -1.26 -4.35 114.28 108.12 4kbp n THR 233 Ca 0.09 -1.35 -0.14 0.00 -2.27 0.00 0.00 64.05 60.39 4kbp n THR 233 Cb 0.53 0.24 -0.09 0.00 -2.10 0.00 0.00 70.33 68.91 4kbp n THR 233 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 4kbp s SER 234 N -1.43 -0.35 0.00 3.42 0.15 -1.26 -5.01 113.70 109.22 4kbp s SER 234 Ca 0.23 0.43 0.20 0.00 0.70 0.00 0.00 55.95 57.51 4kbp s SER 234 Cb 0.16 0.53 1.18 0.00 -1.71 0.00 0.00 66.02 66.18 4kbp s SER 234 CO 0.09 -0.38 1.62 -0.81 1.20 0.00 0.00 173.24 174.96 4kbp n PRO 235 N 1.70 0.77 0.00 5.44 -0.04 -1.26 -3.30 135.00 138.31 4kbp n PRO 235 Ca -0.19 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.40 4kbp n PRO 235 Cb 0.56 -1.40 0.35 0.00 -0.04 0.00 0.00 33.50 32.97 4kbp n PRO 235 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 4kbp n PHE 236 N -0.90 0.00 -3.70 0.54 3.72 -1.26 -4.85 117.46 111.01 4kbp n PHE 236 Ca 0.15 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.42 4kbp n PHE 236 Cb 0.07 -0.20 -0.09 0.00 -0.94 0.00 0.00 39.48 38.32 4kbp n PHE 236 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 176.76 178.38 4kbp s TRP 237 N -2.73 -0.59 0.00 1.38 -2.14 -1.21 -3.49 118.94 110.16 4kbp s TRP 237 Ca 0.19 1.39 -0.02 0.00 2.66 0.00 0.00 56.10 60.31 4kbp s TRP 237 Cb 0.19 0.22 0.01 0.00 -3.10 0.00 0.00 33.47 30.79 4kbp s TRP 237 CO 0.59 -0.29 0.11 2.48 -2.66 0.00 0.00 176.95 177.19 4kbp n TYR 238 N 3.06 -0.27 -3.60 1.66 4.11 -1.03 -4.60 117.16 116.49 4kbp n TYR 238 Ca -0.15 -0.08 -0.11 0.00 -0.00 0.00 0.00 57.90 57.57 4kbp n TYR 238 Cb 0.56 0.03 -0.03 0.00 -0.00 0.00 0.00 39.34 39.91 4kbp n TYR 238 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 4kbp s SER 239 N -1.25 -0.35 0.02 9.48 1.04 -1.26 -0.65 113.70 120.73 4kbp s SER 239 Ca 0.03 -0.28 -0.13 0.00 0.48 0.00 0.00 55.95 56.05 4kbp s SER 239 Cb -0.00 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.69 4kbp s SER 239 CO 0.00 -0.96 0.28 0.27 0.98 0.00 0.00 173.24 173.81 4kbp s ILE 240 N -3.81 0.08 -0.04 -1.02 -4.36 -0.88 -4.44 121.20 106.73 4kbp s ILE 240 Ca 0.04 -0.64 0.04 0.00 -0.26 0.00 0.00 60.65 59.83 4kbp s ILE 240 Cb -0.00 -0.79 -0.03 0.00 1.25 0.00 0.00 42.46 42.89 4kbp s ILE 240 CO -0.09 -0.35 -0.13 -0.54 0.24 0.00 0.00 174.94 174.07 4kbp s LYS 241 N -2.05 2.50 -0.22 0.37 1.02 0.14 -1.28 119.74 120.21 4kbp s LYS 241 Ca -0.09 -0.71 -0.10 0.00 0.02 0.00 0.00 55.97 55.10 4kbp s LYS 241 Cb -0.03 -2.40 0.08 0.00 -0.52 0.00 0.00 37.83 34.96 4kbp s LYS 241 CO -0.00 0.62 0.49 0.50 -0.92 0.00 0.00 175.35 176.04 4kbp s ARG 242 N -0.91 0.44 7.80 1.68 3.52 -0.46 -4.10 118.95 126.92 4kbp s ARG 242 Ca 0.13 1.05 0.00 0.00 -0.13 0.00 0.00 55.73 56.77 4kbp s ARG 242 Cb -0.11 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.55 4kbp s ARG 242 CO 0.02 -0.20 0.00 0.00 -0.81 0.00 0.00 175.30 174.31 4kbp n ALA 243 N 4.86 0.00 -0.09 6.12 0.00 -1.26 -1.45 120.51 128.69 4kbp n ALA 243 Ca -0.16 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.40 4kbp n ALA 243 Cb 0.53 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.27 4kbp n ALA 243 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 4kbp n SER 244 N 7.16 3.71 -4.69 0.00 3.41 -1.24 -2.52 113.62 119.46 4kbp n SER 244 Ca 0.00 -1.99 -0.27 0.00 -0.26 0.00 0.00 58.87 56.34 4kbp n SER 244 Cb 0.00 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 63.47 4kbp n SER 244 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4kbp s ALA 245 N -1.19 3.27 -0.25 7.33 0.00 -0.53 -1.98 121.76 128.41 4kbp s ALA 245 Ca 0.45 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 51.15 4kbp s ALA 245 Cb 0.24 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 22.33 4kbp s ALA 245 CO 0.32 0.54 -0.08 -1.58 0.00 0.00 0.00 175.76 174.96 4kbp s HIS 246 N -1.62 2.90 -0.14 0.00 2.46 0.57 -1.36 115.29 118.10 4kbp s HIS 246 Ca 0.27 -2.09 -0.05 0.00 0.47 0.00 0.00 55.06 53.66 4kbp s HIS 246 Cb -0.10 -1.79 -0.04 0.00 -0.13 0.00 0.00 32.58 30.53 4kbp s HIS 246 CO 0.19 -0.84 0.04 0.42 -2.47 0.00 0.00 174.74 172.08 4kbp s ILE 247 N 1.22 4.61 -0.12 0.89 1.01 -0.41 -1.43 121.20 126.98 4kbp s ILE 247 Ca -0.08 -0.11 0.03 0.00 0.00 0.00 0.00 60.65 60.49 4kbp s ILE 247 Cb -0.20 -3.02 0.01 0.00 0.01 0.00 0.00 42.46 39.26 4kbp s ILE 247 CO -0.06 0.53 -0.22 -0.63 0.00 0.00 0.00 174.94 174.57 4kbp s ILE 248 N -0.22 1.99 -0.09 2.92 1.01 0.13 -2.06 121.20 124.88 4kbp s ILE 248 Ca 0.07 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 4kbp s ILE 248 Cb -0.12 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 4kbp s ILE 248 CO 0.02 0.54 -0.04 -0.69 0.00 0.00 0.00 174.94 174.76 4kbp s VAL 249 N 0.61 3.90 0.35 2.92 1.01 0.18 -0.70 120.40 128.67 4kbp s VAL 249 Ca -0.13 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 61.52 4kbp s VAL 249 Cb -0.17 -2.63 -0.07 0.00 0.00 0.00 0.00 36.38 33.51 4kbp s VAL 249 CO 0.03 0.58 0.01 -0.76 0.00 0.00 0.00 175.10 174.96 4kbp s LEU 250 N -0.57 2.53 -0.32 3.92 1.43 -0.18 -2.46 118.68 123.04 4kbp s LEU 250 Ca 0.09 -1.34 0.02 0.00 -1.03 0.00 0.00 54.13 51.87 4kbp s LEU 250 Cb -0.12 -0.66 0.09 0.00 0.03 0.00 0.00 46.19 45.54 4kbp s LEU 250 CO 0.02 -0.48 0.05 -0.55 0.23 0.00 0.00 176.35 175.62 4kbp s SER 251 N -3.57 4.43 0.56 2.29 0.15 -1.23 -4.58 113.70 111.76 4kbp s SER 251 Ca 0.35 -1.87 0.25 0.00 0.70 0.00 0.00 55.95 55.38 4kbp s SER 251 Cb 0.08 -1.34 1.60 0.00 -1.71 0.00 0.00 66.02 64.66 4kbp s SER 251 CO 0.16 -0.37 2.19 0.28 1.20 0.00 0.00 173.24 176.70 4kbp h SER 252 N 7.80 0.00 -0.28 5.45 0.02 -1.92 -2.72 113.55 121.91 4kbp h SER 252 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 4kbp h SER 252 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 4kbp h SER 252 CO 0.49 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.96 4kbp n TYR 253 N -4.09 0.36 -2.35 3.45 4.01 -1.26 -4.90 117.16 112.37 4kbp n TYR 253 Ca -0.02 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 4kbp n TYR 253 Cb 0.14 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 4kbp n TYR 253 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 4kbp n SER 254 N 1.03 0.00 -4.86 7.72 7.64 -1.03 -5.10 113.62 119.03 4kbp n SER 254 Ca 0.14 -0.98 -0.35 0.00 1.01 0.00 0.00 58.87 58.69 4kbp n SER 254 Cb 0.48 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.62 4kbp n SER 254 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4kbp s ALA 255 N -2.63 3.81 -0.02 -0.43 0.00 -1.26 -5.00 121.76 116.22 4kbp s ALA 255 Ca 0.00 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.27 4kbp s ALA 255 Cb 0.00 -1.84 0.05 0.00 0.00 0.00 0.00 23.12 21.33 4kbp s ALA 255 CO 0.00 0.67 0.88 2.48 0.00 0.00 0.00 175.76 179.79 4kbp n TYR 256 N 1.56 0.00 -0.68 0.00 0.18 -1.26 -4.10 117.16 112.86 4kbp n TYR 256 Ca -0.16 -0.39 -0.32 0.00 1.88 0.00 0.00 57.90 58.92 4kbp n TYR 256 Cb 0.54 -0.05 0.17 0.00 -0.38 0.00 0.00 39.34 39.62 4kbp n TYR 256 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 4kbp n GLY 257 N -0.46 -1.98 3.71 -7.48 0.00 -1.26 -4.55 105.19 93.16 4kbp n GLY 257 Ca 0.03 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 4kbp n GLY 257 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 4kbp s ARG 258 N -3.83 4.41 0.00 1.61 3.52 -1.26 -2.39 118.95 121.01 4kbp s ARG 258 Ca 0.60 1.82 0.00 0.00 -0.13 0.00 0.00 55.73 58.02 4kbp s ARG 258 Cb -0.19 -3.35 0.00 0.00 -1.56 0.00 0.00 34.95 29.86 4kbp s ARG 258 CO 0.65 -0.30 0.00 0.41 -0.81 0.00 0.00 175.30 175.25 4kbp n GLY 259 N 3.28 3.39 3.65 8.12 0.00 -1.26 -5.06 105.19 117.30 4kbp n GLY 259 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 4kbp n GLY 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4kbp s THR 260 N -2.65 2.33 0.20 2.61 -4.23 -1.00 -4.73 115.64 108.17 4kbp s THR 260 Ca 0.00 0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 60.50 4kbp s THR 260 Cb 0.00 -2.29 0.13 0.00 1.34 0.00 0.00 72.50 71.68 4kbp s THR 260 CO 0.00 -0.14 1.86 -0.65 -0.54 0.00 0.00 174.62 175.15 4kbp h PRO 261 N -1.91 0.87 -0.22 3.99 0.11 -1.89 -0.39 132.00 132.56 4kbp h PRO 261 Ca -0.49 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.55 4kbp h PRO 261 Cb 1.28 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 4kbp h PRO 261 CO 0.48 0.58 0.08 0.37 -0.21 0.00 0.00 178.00 179.30 4kbp h GLN 262 N 0.90 0.34 0.22 1.05 4.15 -1.93 0.12 115.11 119.95 4kbp h GLN 262 Ca 0.25 -0.07 0.01 0.00 0.77 0.00 0.00 58.65 59.62 4kbp h GLN 262 Cb -0.08 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.54 4kbp h GLN 262 CO -0.07 0.40 -0.28 -0.92 -1.93 0.00 0.00 178.83 176.04 4kbp h TYR 263 N 0.20 -0.75 -0.51 3.99 5.03 -1.70 -1.44 116.97 121.78 4kbp h TYR 263 Ca 0.07 0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.47 4kbp h TYR 263 Cb 0.20 0.30 -0.06 0.00 1.55 0.00 0.00 36.73 38.72 4kbp h TYR 263 CO -0.00 -0.40 0.17 1.15 -1.32 0.00 0.00 178.16 177.76 4kbp h THR 264 N -0.55 0.81 0.48 1.81 2.02 -0.91 -2.32 112.91 114.26 4kbp h THR 264 Ca 0.01 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 4kbp h THR 264 Cb 0.53 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 4kbp h THR 264 CO -0.10 0.06 -0.43 -0.25 0.37 0.00 0.00 175.52 175.17 4kbp h TRP 265 N 0.34 -1.18 -0.93 3.16 7.01 -0.51 -2.90 115.95 120.94 4kbp h TRP 265 Ca 0.25 0.00 0.17 0.00 2.11 0.00 0.00 58.89 61.42 4kbp h TRP 265 Cb 0.28 0.45 -0.10 0.00 -2.10 0.00 0.00 29.16 27.69 4kbp h TRP 265 CO -0.17 -0.60 0.52 1.25 -2.79 0.00 0.00 178.44 176.64 4kbp h LEU 266 N -0.92 0.65 0.23 0.65 5.85 -1.09 0.17 115.31 120.85 4kbp h LEU 266 Ca -0.05 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 4kbp h LEU 266 Cb 0.79 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.81 4kbp h LEU 266 CO -0.03 0.24 -0.11 0.50 -0.34 0.00 0.00 178.44 178.70 4kbp h LYS 267 N 0.69 -0.30 -0.43 1.25 3.64 -1.32 0.08 116.57 120.18 4kbp h LYS 267 Ca 0.52 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.84 4kbp h LYS 267 Cb 0.78 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 4kbp h LYS 267 CO -0.38 -0.20 -0.08 0.87 -2.27 0.00 0.00 179.45 177.40 4kbp h LYS 268 N -0.31 0.75 -0.42 1.90 1.57 -1.20 -3.00 116.57 115.84 4kbp h LYS 268 Ca -0.03 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 4kbp h LYS 268 Cb 0.24 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 4kbp h LYS 268 CO 0.05 0.81 0.23 1.49 -0.57 0.00 0.00 179.45 181.46 4kbp h GLU 269 N 0.68 0.59 -0.40 3.15 4.57 -0.58 -1.16 114.58 121.44 4kbp h GLU 269 Ca 0.12 -0.07 0.09 0.00 -1.18 0.00 0.00 59.36 58.32 4kbp h GLU 269 Cb 0.53 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 4kbp h GLU 269 CO 0.03 0.47 0.27 -0.07 -1.18 0.00 0.00 179.01 178.54 4kbp h LEU 270 N 0.55 0.13 -0.75 1.64 3.38 -0.85 0.35 115.31 119.77 4kbp h LEU 270 Ca 0.15 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 4kbp h LEU 270 Cb 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 4kbp h LEU 270 CO -0.02 0.08 -0.26 0.03 0.09 0.00 0.00 178.44 178.35 4kbp h ARG 271 N 0.15 0.00 -0.00 1.13 3.08 -1.22 -3.07 114.38 114.45 4kbp h ARG 271 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 4kbp h ARG 271 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 4kbp h ARG 271 CO -0.03 0.26 -0.07 1.63 -1.07 0.00 0.00 179.97 180.70 4kbp n LYS 272 N -3.31 0.56 -2.31 0.04 5.02 0.12 -4.86 118.16 113.41 4kbp n LYS 272 Ca 0.01 -0.13 -0.42 0.00 -2.02 0.00 0.00 58.31 55.75 4kbp n LYS 272 Cb 0.51 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.99 4kbp n LYS 272 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 4kbp s VAL 273 N -2.53 3.74 -0.25 -0.18 1.01 -1.16 -5.01 120.40 116.03 4kbp s VAL 273 Ca 0.28 1.24 0.02 0.00 0.00 0.00 0.00 61.98 63.53 4kbp s VAL 273 Cb 0.20 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.84 4kbp s VAL 273 CO 0.48 0.09 -0.11 -0.54 0.00 0.00 0.00 175.10 175.02 4kbp s LYS 274 N 1.20 2.18 0.27 2.72 1.02 -1.26 -4.99 119.74 120.88 4kbp s LYS 274 Ca 0.61 -1.23 0.26 0.00 0.02 0.00 0.00 55.97 55.63 4kbp s LYS 274 Cb -0.32 -2.79 0.87 0.00 -0.52 0.00 0.00 37.83 35.07 4kbp s LYS 274 CO 0.29 -0.54 1.76 0.00 -0.92 0.00 0.00 175.35 175.94 4kbp h ARG 275 N 7.82 0.00 0.00 1.68 2.47 -1.92 0.36 114.38 124.79 4kbp h ARG 275 Ca -0.21 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.51 4kbp h ARG 275 Cb 1.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.38 4kbp h ARG 275 CO 0.47 0.00 0.00 0.66 0.56 0.00 0.00 179.97 181.66 4kbp h SER 276 N 0.00 0.00 0.00 7.04 4.64 -1.95 -3.02 113.55 120.26 4kbp h SER 276 Ca 0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 4kbp h SER 276 Cb 0.61 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.67 4kbp h SER 276 CO 0.00 0.00 -1.71 1.21 -0.87 0.00 0.00 176.83 175.46 4kbp n GLU 277 N -3.03 0.55 -3.91 4.77 2.13 -0.76 -4.55 120.64 115.84 4kbp n GLU 277 Ca 0.02 0.23 -0.31 0.00 0.66 0.00 0.00 57.16 57.76 4kbp n GLU 277 Cb 0.37 -1.45 -0.15 0.00 0.27 0.00 0.00 31.44 30.48 4kbp n GLU 277 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 4kbp s THR 278 N -2.72 1.72 0.29 6.31 -4.23 0.04 -3.44 115.64 113.61 4kbp s THR 278 Ca -0.33 -1.95 -0.01 0.00 -1.18 0.00 0.00 61.69 58.22 4kbp s THR 278 Cb 0.09 -2.27 0.27 0.00 1.34 0.00 0.00 72.50 71.94 4kbp s THR 278 CO 0.45 -0.61 1.92 1.55 -0.54 0.00 0.00 174.62 177.39 4kbp h PRO 279 N 7.81 1.05 -5.59 3.99 0.13 -1.36 -3.36 132.00 134.67 4kbp h PRO 279 Ca -0.08 -0.06 -0.60 0.00 -0.87 0.00 0.00 66.00 64.38 4kbp h PRO 279 Cb 1.02 -0.24 -0.10 0.00 0.13 0.00 0.00 31.00 31.81 4kbp h PRO 279 CO 0.50 0.70 0.14 -1.58 -0.23 0.00 0.00 178.00 177.52 4kbp s TRP 280 N -5.94 3.33 -0.28 1.56 0.52 -0.84 -4.82 118.94 112.47 4kbp s TRP 280 Ca -0.12 0.87 -0.04 0.00 0.02 0.00 0.00 56.10 56.84 4kbp s TRP 280 Cb 0.19 -2.81 0.03 0.00 -1.15 0.00 0.00 33.47 29.73 4kbp s TRP 280 CO 0.80 -0.24 0.01 -1.17 0.02 0.00 0.00 176.95 176.37 4kbp s LEU 281 N 2.17 3.65 -0.01 2.99 2.96 -1.26 -0.31 118.68 128.86 4kbp s LEU 281 Ca 0.27 -0.94 0.06 0.00 -0.22 0.00 0.00 54.13 53.30 4kbp s LEU 281 Cb -0.16 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 4kbp s LEU 281 CO 0.09 -0.20 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.10 4kbp s ILE 282 N 1.37 2.61 -0.03 6.68 1.01 -0.51 -1.32 121.20 131.00 4kbp s ILE 282 Ca -0.01 -0.99 0.05 0.00 0.00 0.00 0.00 60.65 59.70 4kbp s ILE 282 Cb -0.18 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.28 4kbp s ILE 282 CO -0.01 0.52 -0.17 -0.69 0.00 0.00 0.00 174.94 174.59 4kbp s VAL 283 N -0.74 1.40 0.04 2.92 1.01 -0.99 -0.69 120.40 123.35 4kbp s VAL 283 Ca 0.12 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.46 4kbp s VAL 283 Cb -0.10 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 4kbp s VAL 283 CO 0.01 0.40 -0.25 -0.76 0.00 0.00 0.00 175.10 174.49 4kbp s LEU 284 N -0.22 2.22 0.02 3.92 1.43 0.12 -1.25 118.68 124.92 4kbp s LEU 284 Ca 0.02 -0.57 -0.27 0.00 -1.03 0.00 0.00 54.13 52.28 4kbp s LEU 284 Cb -0.09 -1.31 0.09 0.00 0.03 0.00 0.00 46.19 44.91 4kbp s LEU 284 CO 0.00 0.26 0.80 0.00 0.23 0.00 0.00 176.35 177.64 4kbp s MET 285 N -1.26 0.95 -0.11 1.70 0.23 -1.04 -1.01 119.30 118.75 4kbp s MET 285 Ca 0.12 -0.26 -0.05 0.00 -1.03 0.00 0.00 55.69 54.47 4kbp s MET 285 Cb -0.10 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.61 4kbp s MET 285 CO 0.02 -0.40 0.03 1.25 -2.03 0.00 0.00 175.02 173.89 4kbp h HIS 286 N 2.13 0.00 -3.15 3.16 2.76 -1.82 -3.30 115.15 114.94 4kbp h HIS 286 Ca -0.26 0.00 -0.57 0.00 -2.20 0.00 0.00 60.37 57.34 4kbp h HIS 286 Cb 1.25 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.15 4kbp h HIS 286 CO 0.26 0.12 0.89 0.45 -1.30 0.00 0.00 177.93 178.35 4kbp s SER 287 N -5.68 6.88 0.19 3.26 0.15 -1.26 -0.44 113.70 116.81 4kbp s SER 287 Ca -0.05 1.27 -0.31 0.00 0.70 0.00 0.00 55.95 57.56 4kbp s SER 287 Cb 0.00 -2.54 -0.09 0.00 -1.71 0.00 0.00 66.02 61.68 4kbp s SER 287 CO 0.12 -0.89 1.44 -2.16 1.20 0.00 0.00 173.24 172.95 4kbp s PRO 288 N 3.71 4.29 0.17 5.44 0.04 -1.26 -4.80 135.00 142.59 4kbp s PRO 288 Ca 0.50 2.22 -0.03 0.00 0.04 0.00 0.00 61.00 63.74 4kbp s PRO 288 Cb -0.16 -3.17 0.05 0.00 0.04 0.00 0.00 34.50 31.26 4kbp s PRO 288 CO 0.16 -0.44 1.43 -0.07 0.04 0.00 0.00 177.00 178.12 4kbp h LEU 289 N 5.94 0.56 -8.10 -3.56 3.38 -1.96 -3.29 115.31 108.29 4kbp h LEU 289 Ca -0.44 -0.35 -0.67 0.00 0.09 0.00 0.00 57.88 56.51 4kbp h LEU 289 Cb 1.21 -0.17 -0.35 0.00 0.09 0.00 0.00 40.66 41.45 4kbp h LEU 289 CO 0.83 1.09 -0.86 -0.31 0.09 0.00 0.00 178.44 179.29 4kbp s TYR 290 N -3.71 2.76 -0.30 1.13 2.02 -1.26 -4.63 117.35 113.37 4kbp s TYR 290 Ca -0.07 -1.57 -0.12 0.00 -0.37 0.00 0.00 57.07 54.95 4kbp s TYR 290 Cb 0.10 -1.91 0.12 0.00 -0.40 0.00 0.00 41.96 39.88 4kbp s TYR 290 CO 0.85 -0.76 0.68 1.21 -1.57 0.00 0.00 175.55 175.96 4kbp s ASN 291 N 1.20 -1.06 -0.24 2.29 3.04 -1.26 -4.95 114.94 113.96 4kbp s ASN 291 Ca 0.03 1.51 0.14 0.00 0.04 0.00 0.00 52.86 54.57 4kbp s ASN 291 Cb -0.14 2.04 0.72 0.00 -1.54 0.00 0.00 41.25 42.34 4kbp s ASN 291 CO -0.10 -0.22 1.67 -1.54 -3.04 0.00 0.00 177.10 173.86 4kbp n SER 292 N 5.13 4.99 -4.94 -4.21 3.41 -1.26 -4.62 113.62 112.12 4kbp n SER 292 Ca -0.14 -3.04 -0.24 0.00 -0.26 0.00 0.00 58.87 55.19 4kbp n SER 292 Cb 0.52 -0.66 -0.00 0.00 -0.26 0.00 0.00 64.21 63.81 4kbp n SER 292 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 4kbp s TYR 293 N -2.85 3.43 0.12 7.33 1.51 -1.26 -1.13 117.35 124.50 4kbp s TYR 293 Ca 0.51 0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 56.87 4kbp s TYR 293 Cb 0.40 -2.08 -0.12 0.00 -0.11 0.00 0.00 41.96 40.05 4kbp s TYR 293 CO 0.13 -0.09 1.32 -0.91 -1.11 0.00 0.00 175.55 174.89 4kbp h ASN 294 N 0.56 0.82 -2.58 2.29 2.35 -1.45 -3.35 115.58 114.22 4kbp h ASN 294 Ca -0.48 -0.56 -0.55 0.00 -0.55 0.00 0.00 56.30 54.16 4kbp h ASN 294 Cb 1.23 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 4kbp h ASN 294 CO 0.60 1.35 1.12 -2.28 -1.65 0.00 0.00 177.43 176.58 4kbp s HIS 295 N -3.63 1.88 -1.15 1.19 2.46 -1.26 -2.27 115.29 112.51 4kbp s HIS 295 Ca -0.09 0.16 0.00 0.00 0.47 0.00 0.00 55.06 55.60 4kbp s HIS 295 Cb 0.09 -3.96 0.00 0.00 -0.13 0.00 0.00 32.58 28.57 4kbp s HIS 295 CO 0.89 -3.97 0.00 0.72 -2.47 0.00 0.00 174.74 169.91 4kbp n HIS 296 N 7.49 -0.56 -2.20 3.88 8.25 -1.26 -4.86 115.22 125.96 4kbp n HIS 296 Ca 0.18 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 4kbp n HIS 296 Cb 0.43 -2.82 -0.03 0.00 1.12 0.00 0.00 29.99 28.70 4kbp n HIS 296 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 4kbp s PHE 297 N -2.64 2.62 -0.46 4.41 5.36 -0.96 -3.19 117.98 123.12 4kbp s PHE 297 Ca 0.00 0.68 0.00 0.00 -0.96 0.00 0.00 56.93 56.65 4kbp s PHE 297 Cb 0.00 -3.71 0.00 0.00 -0.34 0.00 0.00 43.02 38.97 4kbp s PHE 297 CO 0.00 -2.71 0.00 -1.33 -1.46 0.00 0.00 175.22 169.72 4kbp n MET 298 N 6.04 -0.43 0.12 10.12 2.81 -1.26 -4.92 117.12 129.61 4kbp n MET 298 Ca 0.14 0.56 -0.01 0.00 -1.81 0.00 0.00 57.70 56.59 4kbp n MET 298 Cb 0.44 -4.22 0.08 0.00 -0.71 0.00 0.00 33.22 28.80 4kbp n MET 298 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 4kbp h GLU 299 N 0.17 0.00 0.00 0.03 5.08 -1.85 -2.95 114.58 115.06 4kbp h GLU 299 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 4kbp h GLU 299 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 4kbp h GLU 299 CO 0.13 0.67 0.00 0.41 -1.00 0.00 0.00 179.01 179.22 4kbp n GLY 300 N 0.82 -0.97 0.39 -3.84 0.00 -1.24 -4.02 105.19 96.33 4kbp n GLY 300 Ca 0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 4kbp n GLY 300 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 4kbp h GLU 301 N 0.00 -0.49 -0.32 1.61 4.39 -1.78 0.27 114.58 118.26 4kbp h GLU 301 Ca 0.00 0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.79 4kbp h GLU 301 Cb 0.16 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 28.84 4kbp h GLU 301 CO 0.00 -0.33 -0.47 0.00 -1.16 0.00 0.00 179.01 177.05 4kbp h ALA 302 N 0.10 -0.59 -0.33 3.43 0.00 -1.84 0.35 119.26 120.38 4kbp h ALA 302 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 4kbp h ALA 302 Cb 0.62 0.94 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 4kbp h ALA 302 CO -0.35 -0.94 0.16 1.98 0.00 0.00 0.00 179.25 180.09 4kbp h MET 303 N -0.40 0.46 -0.35 0.00 1.85 -1.80 -1.48 114.93 113.20 4kbp h MET 303 Ca 0.10 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.13 4kbp h MET 303 Cb 0.61 -0.09 -0.02 0.00 0.43 0.00 0.00 31.60 32.53 4kbp h MET 303 CO -0.53 0.36 0.17 -0.09 -0.40 0.00 0.00 176.91 176.42 4kbp h ARG 304 N 0.46 0.50 0.00 0.39 2.43 0.14 0.13 114.38 118.44 4kbp h ARG 304 Ca 0.12 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 4kbp h ARG 304 Cb 0.05 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 4kbp h ARG 304 CO -0.02 0.45 0.00 0.25 -1.51 0.00 0.00 179.97 179.14 4kbp n THR 305 N -4.74 1.37 -0.07 0.20 -2.24 0.97 -1.45 114.28 108.32 4kbp n THR 305 Ca -0.01 0.40 -0.10 0.00 -2.27 0.00 0.00 64.05 62.08 4kbp n THR 305 Cb 0.10 -1.30 -0.08 0.00 -2.10 0.00 0.00 70.33 66.95 4kbp n THR 305 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 4kbp n LYS 306 N -1.68 0.93 -0.00 -0.78 4.81 -0.39 -4.82 118.16 116.23 4kbp n LYS 306 Ca 0.01 0.06 0.06 0.00 -0.87 0.00 0.00 58.31 57.57 4kbp n LYS 306 Cb 0.10 -1.33 -0.08 0.00 0.02 0.00 0.00 35.03 33.74 4kbp n LYS 306 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 4kbp n PHE 307 N -2.80 0.00 -0.07 5.64 3.72 0.33 -4.75 117.46 119.54 4kbp n PHE 307 Ca -0.26 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.02 4kbp n PHE 307 Cb 0.84 -0.13 -0.06 0.00 -0.94 0.00 0.00 39.48 39.20 4kbp n PHE 307 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 4kbp h GLU 308 N 0.00 -0.40 -1.00 -1.08 4.81 -1.44 -1.26 114.58 114.20 4kbp h GLU 308 Ca 0.00 0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.42 4kbp h GLU 308 Cb 0.41 0.09 -0.10 0.00 0.63 0.00 0.00 28.75 29.78 4kbp h GLU 308 CO 0.00 -0.27 0.62 0.00 -0.73 0.00 0.00 179.01 178.63 4kbp h ALA 309 N 0.21 1.64 -0.40 2.92 0.00 -1.85 -0.67 119.26 121.11 4kbp h ALA 309 Ca 0.10 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 4kbp h ALA 309 Cb 0.61 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 4kbp h ALA 309 CO -0.49 0.03 0.24 -1.49 0.00 0.00 0.00 179.25 177.54 4kbp h TRP 310 N 0.83 0.53 -0.36 0.00 4.06 -1.55 0.42 115.95 119.89 4kbp h TRP 310 Ca 0.55 -0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.53 4kbp h TRP 310 Cb 0.77 -0.17 -0.03 0.00 -1.00 0.00 0.00 29.16 28.72 4kbp h TRP 310 CO -0.00 0.39 0.16 0.74 -3.56 0.00 0.00 178.44 176.16 4kbp h PHE 311 N 0.53 0.29 -0.12 0.49 0.04 -0.59 -0.18 116.94 117.40 4kbp h PHE 311 Ca 0.14 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 4kbp h PHE 311 Cb 0.01 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 4kbp h PHE 311 CO -0.03 0.15 0.03 0.28 -0.60 0.00 0.00 178.31 178.13 4kbp h VAL 312 N 0.34 1.20 -0.85 -0.55 2.07 -0.90 -0.46 116.25 117.11 4kbp h VAL 312 Ca 0.16 -0.63 0.13 0.00 0.82 0.00 0.00 66.70 67.17 4kbp h VAL 312 Cb 0.09 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.17 4kbp h VAL 312 CO -0.13 0.18 0.46 0.50 0.02 0.00 0.00 177.57 178.61 4kbp h LYS 313 N -0.02 0.68 -0.37 1.57 3.64 0.16 -1.10 116.57 121.13 4kbp h LYS 313 Ca 0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 4kbp h LYS 313 Cb 0.26 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 4kbp h LYS 313 CO 0.00 0.45 0.00 0.66 -2.27 0.00 0.00 179.45 178.29 4kbp n TYR 314 N -4.82 0.49 -3.80 1.91 4.01 -0.11 -4.96 117.16 109.89 4kbp n TYR 314 Ca 0.16 -0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.42 4kbp n TYR 314 Cb 0.38 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.42 4kbp n TYR 314 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 4kbp n LYS 315 N 0.83 -4.28 -2.08 -0.72 5.02 -0.28 -4.89 118.16 111.77 4kbp n LYS 315 Ca 0.17 0.53 -0.39 0.00 -2.02 0.00 0.00 58.31 56.60 4kbp n LYS 315 Cb 0.42 -4.93 -0.00 0.00 -0.02 0.00 0.00 35.03 30.50 4kbp n LYS 315 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 4kbp s VAL 316 N -3.78 2.68 -0.06 -0.18 -7.23 -0.62 -4.73 120.40 106.49 4kbp s VAL 316 Ca 0.01 0.58 -0.22 0.00 -1.81 0.00 0.00 61.98 60.53 4kbp s VAL 316 Cb -0.00 -3.32 -0.18 0.00 0.56 0.00 0.00 36.38 33.44 4kbp s VAL 316 CO 0.84 0.05 0.89 0.44 -0.31 0.00 0.00 175.10 177.01 4kbp h ASP 317 N 2.38 -0.11 -4.76 4.85 3.32 -1.55 -3.22 116.42 117.32 4kbp h ASP 317 Ca -0.50 -0.47 -0.21 0.00 0.02 0.00 0.00 57.03 55.87 4kbp h ASP 317 Cb 1.25 0.03 -0.16 0.00 0.22 0.00 0.00 39.33 40.67 4kbp h ASP 317 CO 0.61 0.50 -0.70 -0.69 -1.72 0.00 0.00 179.24 177.25 4kbp s VAL 318 N -3.28 0.56 -0.23 -1.35 1.01 -1.24 -2.12 120.40 113.76 4kbp s VAL 318 Ca -0.14 -1.75 -0.04 0.00 0.00 0.00 0.00 61.98 60.06 4kbp s VAL 318 Cb 0.00 -1.44 0.08 0.00 0.00 0.00 0.00 36.38 35.02 4kbp s VAL 318 CO 0.53 -0.81 0.09 -0.69 0.00 0.00 0.00 175.10 174.21 4kbp s VAL 319 N -3.27 0.17 0.03 2.92 1.01 -0.69 -2.36 120.40 118.22 4kbp s VAL 319 Ca 0.07 -0.57 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 4kbp s VAL 319 Cb 0.03 -0.93 -0.06 0.00 0.00 0.00 0.00 36.38 35.42 4kbp s VAL 319 CO -0.05 -0.44 0.49 -0.36 0.00 0.00 0.00 175.10 174.74 4kbp s PHE 320 N 2.00 3.76 0.22 5.22 0.08 -0.38 -2.15 117.98 126.74 4kbp s PHE 320 Ca 0.04 1.13 -0.03 0.00 0.12 0.00 0.00 56.93 58.19 4kbp s PHE 320 Cb -0.16 -2.40 -0.03 0.00 -0.57 0.00 0.00 43.02 39.85 4kbp s PHE 320 CO -0.19 0.60 0.22 0.00 -0.10 0.00 0.00 175.22 175.75 4kbp s ALA 321 N -1.05 0.89 0.00 5.36 0.00 -0.87 -2.51 121.76 123.59 4kbp s ALA 321 Ca 0.26 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.68 4kbp s ALA 321 Cb -0.18 1.32 0.00 0.00 0.00 0.00 0.00 23.12 24.26 4kbp s ALA 321 CO 0.16 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.68 4kbp n GLY 322 N -0.32 3.80 4.40 0.00 0.00 0.42 -0.72 105.19 112.77 4kbp n GLY 322 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.48 4kbp n GLY 322 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 4kbp n HIS 323 N 0.00 0.00 -3.50 1.61 -0.00 -1.23 -4.33 115.22 107.77 4kbp n HIS 323 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.34 4kbp n HIS 323 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 29.89 4kbp n HIS 323 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 4kbp s VAL 324 N 0.00 5.25 -1.08 3.57 1.01 -1.26 -4.97 120.40 122.92 4kbp s VAL 324 Ca 0.00 0.36 -0.19 0.00 0.00 0.00 0.00 61.98 62.15 4kbp s VAL 324 Cb 0.00 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.70 4kbp s VAL 324 CO 0.00 0.21 2.03 1.41 0.00 0.00 0.00 175.10 178.75 4kbp n HIS 325 N 5.17 2.69 -3.85 5.22 -0.00 -1.25 -3.34 115.22 119.86 4kbp n HIS 325 Ca -0.11 -2.27 0.00 0.00 -0.00 0.00 0.00 57.72 55.34 4kbp n HIS 325 Cb 0.51 -2.13 0.01 0.00 -0.00 0.00 0.00 29.99 28.39 4kbp n HIS 325 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 4kbp n ALA 326 N 7.47 -2.01 -2.38 -1.41 0.00 -1.26 -0.49 120.51 120.42 4kbp n ALA 326 Ca 0.50 -0.57 -0.29 0.00 0.00 0.00 0.00 53.44 53.08 4kbp n ALA 326 Cb 0.41 0.22 -0.13 0.00 0.00 0.00 0.00 19.45 19.94 4kbp n ALA 326 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 4kbp s TYR 327 N -2.93 2.33 -0.17 0.00 5.04 0.85 -3.43 117.35 119.04 4kbp s TYR 327 Ca 0.17 -0.38 -0.28 0.00 -2.44 0.00 0.00 57.07 54.14 4kbp s TYR 327 Cb -0.01 -1.30 0.08 0.00 0.35 0.00 0.00 41.96 41.08 4kbp s TYR 327 CO 0.01 0.28 0.73 -2.00 -1.34 0.00 0.00 175.55 173.24 4kbp s GLU 328 N -1.82 0.91 0.02 4.97 2.12 -1.12 -1.02 118.70 122.76 4kbp s GLU 328 Ca 0.14 0.61 0.03 0.00 0.36 0.00 0.00 54.97 56.10 4kbp s GLU 328 Cb -0.10 0.43 -0.02 0.00 0.26 0.00 0.00 34.13 34.71 4kbp s GLU 328 CO 0.05 -0.20 -0.08 0.50 -0.54 0.00 0.00 175.26 174.98 4kbp s ARG 329 N -0.40 0.59 0.42 4.30 3.52 0.77 -1.34 118.95 126.81 4kbp s ARG 329 Ca -0.05 -0.55 0.02 0.00 -0.13 0.00 0.00 55.73 55.02 4kbp s ARG 329 Cb -0.03 -0.49 0.02 0.00 -1.56 0.00 0.00 34.95 32.89 4kbp s ARG 329 CO 0.05 0.12 0.13 0.43 -0.81 0.00 0.00 175.30 175.21 4kbp n SER 330 N 2.11 2.84 -4.92 -2.12 7.64 -0.90 -0.68 113.62 117.60 4kbp n SER 330 Ca -0.18 -2.68 -0.30 0.00 1.01 0.00 0.00 58.87 56.72 4kbp n SER 330 Cb 0.56 0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.88 4kbp n SER 330 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 4kbp s GLU 331 N -3.61 3.52 -0.33 1.43 0.41 0.20 -4.50 118.70 115.81 4kbp s GLU 331 Ca 0.10 -0.31 -0.28 0.00 -0.41 0.00 0.00 54.97 54.07 4kbp s GLU 331 Cb -0.01 -2.91 -0.03 0.00 -1.78 0.00 0.00 34.13 29.40 4kbp s GLU 331 CO 0.06 0.49 1.94 1.03 -0.49 0.00 0.00 175.26 178.30 4kbp s ARG 332 N -2.86 3.16 0.02 1.61 0.52 -1.26 -4.64 118.95 115.50 4kbp s ARG 332 Ca 0.38 1.52 0.01 0.00 -0.52 0.00 0.00 55.73 57.12 4kbp s ARG 332 Cb -0.12 -4.28 -0.02 0.00 0.52 0.00 0.00 34.95 31.06 4kbp s ARG 332 CO 0.27 -2.07 -0.05 0.08 0.02 0.00 0.00 175.30 173.55 4kbp s VAL 333 N 7.72 0.37 0.18 3.52 1.01 -1.25 -1.37 120.40 130.58 4kbp s VAL 333 Ca 0.85 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 62.17 4kbp s VAL 333 Cb -0.24 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.68 4kbp s VAL 333 CO 0.33 -0.23 -0.06 -0.94 0.00 0.00 0.00 175.10 174.20 4kbp s SER 334 N -0.99 1.80 -0.40 3.32 1.04 -0.94 -4.67 113.70 112.85 4kbp s SER 334 Ca -0.07 -1.09 0.10 0.00 0.48 0.00 0.00 55.95 55.37 4kbp s SER 334 Cb -0.07 -0.00 0.36 0.00 0.10 0.00 0.00 66.02 66.42 4kbp s SER 334 CO -0.00 -0.40 1.06 -3.20 0.98 0.00 0.00 173.24 171.68 4kbp n ASN 335 N -0.28 -0.95 -1.49 7.02 2.85 -1.26 -1.58 115.26 119.57 4kbp n ASN 335 Ca -0.08 -3.10 -0.12 0.00 -0.11 0.00 0.00 54.58 51.17 4kbp n ASN 335 Cb 0.62 0.76 0.16 0.00 1.24 0.00 0.00 39.78 42.57 4kbp n ASN 335 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 4kbp n ILE 336 N 0.05 2.72 0.38 -1.44 -5.35 -1.26 -4.57 119.36 109.89 4kbp n ILE 336 Ca 0.09 -2.89 0.04 0.00 -0.27 0.00 0.00 62.75 59.72 4kbp n ILE 336 Cb 0.74 -0.52 -0.01 0.00 -1.74 0.00 0.00 39.64 38.12 4kbp n ILE 336 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 4kbp n ALA 337 N -1.06 2.79 -1.76 -1.28 0.00 -1.26 -5.03 120.51 112.91 4kbp n ALA 337 Ca 0.40 -0.38 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 4kbp n ALA 337 Cb 1.06 -0.30 -0.01 0.00 0.00 0.00 0.00 19.45 20.20 4kbp n ALA 337 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 4kbp n TYR 338 N -0.42 2.94 -2.52 0.00 9.36 -1.03 -4.77 117.16 120.73 4kbp n TYR 338 Ca 0.03 0.38 0.03 0.00 3.32 0.00 0.00 57.90 61.66 4kbp n TYR 338 Cb 0.17 -2.55 0.04 0.00 -0.63 0.00 0.00 39.34 36.37 4kbp n TYR 338 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 4kbp n LYS 339 N 1.02 0.58 0.00 2.98 4.76 -1.26 -5.04 118.16 121.19 4kbp n LYS 339 Ca 0.04 -2.48 0.00 0.00 -2.87 0.00 0.00 58.31 53.00 4kbp n LYS 339 Cb 0.38 -0.52 0.00 0.00 -1.84 0.00 0.00 35.03 33.05 4kbp n LYS 339 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 4kbp n ILE 340 N 0.12 0.00 0.35 -0.18 2.08 -1.26 -4.00 119.36 116.47 4kbp n ILE 340 Ca 0.08 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.50 4kbp n ILE 340 Cb 1.04 0.00 0.05 0.00 -0.75 0.00 0.00 39.64 39.98 4kbp n ILE 340 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 4kbp n THR 341 N 0.00 0.42 1.62 1.39 -2.24 -1.26 -4.27 114.28 109.93 4kbp n THR 341 Ca 0.00 -0.39 0.07 0.00 -2.27 0.00 0.00 64.05 61.46 4kbp n THR 341 Cb 0.00 -0.14 0.43 0.00 -2.10 0.00 0.00 70.33 68.52 4kbp n THR 341 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 4kbp n ASP 342 N -2.33 0.00 0.00 3.42 5.75 -1.26 -4.90 116.55 117.23 4kbp n ASP 342 Ca 0.01 -1.17 0.00 0.00 -0.01 0.00 0.00 54.79 53.63 4kbp n ASP 342 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 4kbp n ASP 342 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4kbp n GLY 343 N 0.48 0.03 2.78 6.12 0.00 -1.26 -4.88 105.19 108.46 4kbp n GLY 343 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 4kbp n GLY 343 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 4kbp n LEU 344 N 0.00 6.87 -2.54 0.99 4.77 -1.26 -4.71 117.00 121.12 4kbp n LEU 344 Ca 0.00 -4.50 -0.25 0.00 -0.03 0.00 0.00 56.01 51.23 4kbp n LEU 344 Cb 0.18 -1.53 -0.00 0.00 -2.33 0.00 0.00 43.42 39.74 4kbp n LEU 344 CO 0.00 1.36 0.16 0.00 -1.33 0.00 0.00 177.39 177.57 4kbp s THR 346 N -5.20 0.28 -0.05 0.00 2.01 -1.26 -5.10 115.64 106.31 4kbp s THR 346 Ca 0.46 0.11 -0.36 0.00 0.31 0.00 0.00 61.69 62.21 4kbp s THR 346 Cb 0.39 -0.41 -0.14 0.00 0.01 0.00 0.00 72.50 72.36 4kbp s THR 346 CO -0.16 0.21 1.69 -2.65 -0.69 0.00 0.00 174.62 173.01 4kbp n PRO 347 N 4.67 1.73 -4.31 4.92 -0.02 -1.26 -4.83 135.00 135.90 4kbp n PRO 347 Ca -0.15 0.63 -0.29 0.00 -2.02 0.00 0.00 63.50 61.67 4kbp n PRO 347 Cb 0.50 -2.38 -0.11 0.00 -0.02 0.00 0.00 33.50 31.48 4kbp n PRO 347 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 4kbp s VAL 348 N 2.62 2.81 0.41 -1.45 -7.23 -0.61 -4.89 120.40 112.05 4kbp s VAL 348 Ca 0.90 -1.54 -0.27 0.00 -1.81 0.00 0.00 61.98 59.26 4kbp s VAL 348 Cb -0.83 -2.29 -0.09 0.00 0.56 0.00 0.00 36.38 33.72 4kbp s VAL 348 CO 0.51 0.08 1.41 -0.75 -0.31 0.00 0.00 175.10 176.05 4kbp s LYS 349 N -2.18 3.94 -0.15 4.82 2.20 -1.26 -2.22 119.74 124.89 4kbp s LYS 349 Ca 0.18 2.39 -0.06 0.00 -0.36 0.00 0.00 55.97 58.13 4kbp s LYS 349 Cb -0.10 -2.81 0.07 0.00 -1.51 0.00 0.00 37.83 33.48 4kbp s LYS 349 CO 0.10 -0.60 0.32 0.34 -0.36 0.00 0.00 175.35 175.14 4kbp s ASP 350 N -0.44 0.11 -0.00 1.43 -1.08 -0.47 -4.79 116.67 111.44 4kbp s ASP 350 Ca 0.56 0.73 0.04 0.00 -0.52 0.00 0.00 52.55 53.36 4kbp s ASP 350 Cb -0.43 0.90 0.11 0.00 -1.46 0.00 0.00 42.92 42.04 4kbp s ASP 350 CO 0.57 -0.23 1.08 0.00 0.52 0.00 0.00 175.17 177.11 4kbp n GLN 351 N 5.30 1.29 -0.00 4.34 1.13 -1.26 -2.83 117.38 125.35 4kbp n GLN 351 Ca -0.08 -0.44 0.06 0.00 -1.94 0.00 0.00 57.00 54.60 4kbp n GLN 351 Cb 0.50 -1.10 -0.09 0.00 0.11 0.00 0.00 30.24 29.66 4kbp n GLN 351 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 4kbp n SER 352 N -0.14 1.21 -4.83 1.08 7.64 -1.26 -4.96 113.62 112.36 4kbp n SER 352 Ca 0.04 -0.44 -0.32 0.00 1.01 0.00 0.00 58.87 59.15 4kbp n SER 352 Cb 0.11 1.27 -0.05 0.00 -1.01 0.00 0.00 64.21 64.53 4kbp n SER 352 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4kbp s ALA 353 N -2.53 3.04 0.91 -0.43 0.00 -1.13 -4.15 121.76 117.48 4kbp s ALA 353 Ca 0.01 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 52.10 4kbp s ALA 353 Cb 0.09 -3.14 0.16 0.00 0.00 0.00 0.00 23.12 20.23 4kbp s ALA 353 CO 0.54 -0.11 1.25 -1.25 0.00 0.00 0.00 175.76 176.18 4kbp s PRO 354 N -3.72 1.08 -0.18 0.00 0.04 -1.22 -4.61 135.00 126.38 4kbp s PRO 354 Ca 0.60 -0.15 -0.14 0.00 0.04 0.00 0.00 61.00 61.35 4kbp s PRO 354 Cb -0.10 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 4kbp s PRO 354 CO 0.24 -2.16 0.33 0.08 0.04 0.00 0.00 177.00 175.53 4kbp s VAL 355 N -3.69 5.27 -0.38 -0.36 1.01 -0.90 -3.97 120.40 117.38 4kbp s VAL 355 Ca 0.69 0.58 -0.15 0.00 0.00 0.00 0.00 61.98 63.10 4kbp s VAL 355 Cb -0.08 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.64 4kbp s VAL 355 CO 0.52 0.33 0.32 -0.31 0.00 0.00 0.00 175.10 175.95 4kbp s TYR 356 N 0.88 3.22 0.09 5.22 1.51 -1.26 -1.71 117.35 125.30 4kbp s TYR 356 Ca 0.17 -0.32 0.05 0.00 -1.01 0.00 0.00 57.07 55.95 4kbp s TYR 356 Cb -0.14 -2.62 -0.04 0.00 -0.11 0.00 0.00 41.96 39.05 4kbp s TYR 356 CO 0.06 -0.50 -0.00 0.42 -1.11 0.00 0.00 175.55 174.41 4kbp s ILE 357 N 1.83 4.00 -0.14 2.71 1.01 -0.91 -2.11 121.20 127.60 4kbp s ILE 357 Ca 0.08 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 4kbp s ILE 357 Cb -0.18 -2.90 0.04 0.00 0.01 0.00 0.00 42.46 39.43 4kbp s ILE 357 CO 0.11 0.14 -0.04 0.42 0.00 0.00 0.00 174.94 175.57 4kbp s THR 358 N -1.29 0.89 -0.47 2.92 -4.23 -0.45 -2.05 115.64 110.95 4kbp s THR 358 Ca 0.25 -0.39 0.06 0.00 -1.18 0.00 0.00 61.69 60.43 4kbp s THR 358 Cb -0.12 -1.06 0.40 0.00 1.34 0.00 0.00 72.50 73.06 4kbp s THR 358 CO 0.18 0.18 1.04 2.30 -0.54 0.00 0.00 174.62 177.78 4kbp n ILE 359 N 4.96 2.44 -0.18 2.99 -0.00 0.10 -2.80 119.36 126.88 4kbp n ILE 359 Ca -0.11 -5.02 -0.13 0.00 -0.00 0.00 0.00 62.75 57.49 4kbp n ILE 359 Cb 0.49 -1.17 0.09 0.00 -0.00 0.00 0.00 39.64 39.05 4kbp n ILE 359 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 4kbp n GLY 360 N -0.36 3.32 1.57 3.28 0.00 -1.21 -2.82 105.19 108.96 4kbp n GLY 360 Ca 0.34 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 4kbp n GLY 360 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4kbp n ASP 361 N -0.33 3.13 0.07 1.61 5.75 -1.25 -3.89 116.55 121.65 4kbp n ASP 361 Ca 0.31 -3.65 0.12 0.00 -0.01 0.00 0.00 54.79 51.56 4kbp n ASP 361 Cb 1.09 -0.71 0.46 0.00 -1.03 0.00 0.00 41.12 40.93 4kbp n ASP 361 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 4kbp n ALA 362 N -1.03 2.02 0.00 2.12 0.00 -1.09 -1.05 120.51 121.47 4kbp n ALA 362 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.85 4kbp n ALA 362 Cb 1.27 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 19.31 4kbp n ALA 362 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4kbp n GLY 363 N 0.77 3.21 7.00 0.00 0.00 -1.24 -3.99 105.19 110.94 4kbp n GLY 363 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.63 4kbp n GLY 363 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 4kbp n ASN 364 N 0.00 0.00 -1.89 1.61 6.94 -0.27 -0.48 115.26 121.17 4kbp n ASN 364 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 54.58 54.38 4kbp n ASN 364 Cb 0.00 0.00 0.07 0.00 -2.36 0.00 0.00 39.78 37.49 4kbp n ASN 364 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 4kbp n TYR 365 N 13.09 1.91 -1.73 -2.53 4.11 -1.26 -3.20 117.16 127.55 4kbp n TYR 365 Ca 0.00 -1.83 0.00 0.00 -0.00 0.00 0.00 57.90 56.07 4kbp n TYR 365 Cb 0.00 -0.90 0.00 0.00 -0.00 0.00 0.00 39.34 38.44 4kbp n TYR 365 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 4kbp n GLY 366 N -0.19 0.57 3.04 -7.48 0.00 0.37 -3.93 105.19 97.58 4kbp n GLY 366 Ca 0.37 -0.78 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 4kbp n GLY 366 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4kbp s VAL 367 N -2.00 0.86 0.03 1.61 1.01 -1.22 -4.97 120.40 115.73 4kbp s VAL 367 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.57 4kbp s VAL 367 Cb 0.00 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 4kbp s VAL 367 CO 0.00 0.25 -0.02 -0.63 0.00 0.00 0.00 175.10 174.70 4kbp s ILE 368 N -0.11 3.95 -0.43 2.22 -1.09 -1.26 -4.83 121.20 119.65 4kbp s ILE 368 Ca 0.02 -0.80 -0.17 0.00 -2.23 0.00 0.00 60.65 57.47 4kbp s ILE 368 Cb -0.06 -2.80 0.03 0.00 -1.58 0.00 0.00 42.46 38.05 4kbp s ILE 368 CO -0.00 0.28 0.43 -1.81 -1.23 0.00 0.00 174.94 172.62 4kbp s ASP 369 N -1.80 6.18 -0.14 3.58 1.01 0.36 -4.89 116.67 120.96 4kbp s ASP 369 Ca 0.21 -0.77 0.16 0.00 0.71 0.00 0.00 52.55 52.86 4kbp s ASP 369 Cb -0.11 -2.22 -0.22 0.00 1.01 0.00 0.00 42.92 41.38 4kbp s ASP 369 CO 0.12 -0.59 0.11 -1.54 0.21 0.00 0.00 175.17 173.48 4kbp n SER 370 N 5.56 0.84 -4.69 0.27 3.41 -1.26 -4.66 113.62 113.09 4kbp n SER 370 Ca -0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.11 4kbp n SER 370 Cb 0.47 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 65.45 4kbp n SER 370 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 4kbp s ASN 371 N -4.92 6.63 0.11 4.04 0.02 -1.26 -4.96 114.94 114.60 4kbp s ASN 371 Ca -0.08 2.43 0.07 0.00 -1.02 0.00 0.00 52.86 54.26 4kbp s ASN 371 Cb 0.06 -2.56 -0.04 0.00 0.02 0.00 0.00 41.25 38.74 4kbp s ASN 371 CO 0.70 -0.88 -0.18 -0.04 0.02 0.00 0.00 177.10 176.73 4kbp s MET 372 N 2.78 1.07 -0.42 -0.60 -1.94 -1.26 -1.18 119.30 117.75 4kbp s MET 372 Ca 0.73 -1.18 -0.28 0.00 -1.71 0.00 0.00 55.69 53.25 4kbp s MET 372 Cb -0.38 -1.17 -0.01 0.00 2.01 0.00 0.00 34.83 35.28 4kbp s MET 372 CO 0.32 0.25 1.71 0.42 -0.01 0.00 0.00 175.02 177.71 4kbp s ILE 373 N -1.56 3.56 -0.23 2.53 -1.09 -0.28 -4.77 121.20 119.36 4kbp s ILE 373 Ca 0.07 0.53 -0.16 0.00 -2.23 0.00 0.00 60.65 58.86 4kbp s ILE 373 Cb -0.08 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 4kbp s ILE 373 CO 0.04 -0.63 0.40 -1.10 -1.23 0.00 0.00 174.94 172.42 4kbp s GLN 374 N 5.78 4.12 0.40 2.79 -1.52 -1.26 -3.36 119.66 126.60 4kbp s GLN 374 Ca 0.72 0.16 -0.04 0.00 -1.95 0.00 0.00 55.36 54.25 4kbp s GLN 374 Cb -0.18 -3.58 -0.04 0.00 -0.22 0.00 0.00 33.01 28.99 4kbp s GLN 374 CO 0.30 -0.14 0.67 -1.25 -0.25 0.00 0.00 175.29 174.63 4kbp s PRO 375 N 1.62 3.57 -0.26 2.91 0.04 -1.26 -5.09 135.00 136.53 4kbp s PRO 375 Ca 0.18 0.03 -0.35 0.00 0.04 0.00 0.00 61.00 60.90 4kbp s PRO 375 Cb -0.15 -2.52 -0.11 0.00 0.04 0.00 0.00 34.50 31.76 4kbp s PRO 375 CO 0.08 -0.00 2.06 0.94 0.04 0.00 0.00 177.00 180.13 4kbp n GLN 376 N -1.77 1.48 -0.86 4.56 7.27 -1.21 -4.87 117.38 121.98 4kbp n GLN 376 Ca -0.01 0.47 -0.31 0.00 0.07 0.00 0.00 57.00 57.21 4kbp n GLN 376 Cb 0.55 -2.57 0.15 0.00 2.41 0.00 0.00 30.24 30.78 4kbp n GLN 376 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 4kbp s PRO 377 N 5.38 1.37 0.22 3.69 0.04 -1.26 -4.93 135.00 139.51 4kbp s PRO 377 Ca 1.03 1.45 -0.08 0.00 0.04 0.00 0.00 61.00 63.44 4kbp s PRO 377 Cb -0.77 -1.78 0.34 0.00 0.04 0.00 0.00 34.50 32.33 4kbp s PRO 377 CO 0.50 -2.35 1.73 0.93 0.04 0.00 0.00 177.00 177.85 4kbp h GLU 378 N -1.65 0.37 0.00 4.56 3.07 -1.98 -2.14 114.58 116.81 4kbp h GLU 378 Ca -0.43 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 4kbp h GLU 378 Cb 1.26 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 4kbp h GLU 378 CO 0.44 0.25 0.00 0.10 -1.40 0.00 0.00 179.01 178.40 4kbp h TYR 379 N 0.38 0.00 -3.34 4.33 -0.00 -1.91 -3.41 116.97 113.01 4kbp h TYR 379 Ca 0.35 0.00 -0.59 0.00 0.00 0.00 0.00 58.73 58.48 4kbp h TYR 379 Cb 0.48 0.00 -0.09 0.00 0.00 0.00 0.00 36.73 37.13 4kbp h TYR 379 CO -0.19 0.00 0.55 0.45 -0.00 0.00 0.00 178.16 178.97 4kbp s SER 380 N -5.27 6.80 -0.00 0.10 0.15 -0.81 -0.63 113.70 114.04 4kbp s SER 380 Ca -0.02 0.89 0.08 0.00 0.70 0.00 0.00 55.95 57.60 4kbp s SER 380 Cb 0.11 -2.45 -0.23 0.00 -1.71 0.00 0.00 66.02 61.73 4kbp s SER 380 CO 0.45 -0.66 0.81 0.00 1.20 0.00 0.00 173.24 175.05 4kbp h ALA 381 N 7.96 0.60 -1.72 5.45 0.00 -1.13 -3.46 119.26 126.95 4kbp h ALA 381 Ca -0.23 -1.29 0.05 0.00 0.00 0.00 0.00 54.91 53.44 4kbp h ALA 381 Cb 1.08 0.33 -0.25 0.00 0.00 0.00 0.00 17.79 18.96 4kbp h ALA 381 CO 0.92 1.44 0.30 0.12 0.00 0.00 0.00 179.25 182.03 4kbp s PHE 382 N -2.62 -0.67 -0.06 0.00 2.19 -0.98 -4.98 117.98 110.86 4kbp s PHE 382 Ca -0.05 1.47 -0.09 0.00 0.33 0.00 0.00 56.93 58.58 4kbp s PHE 382 Cb 0.08 0.39 0.02 0.00 -1.31 0.00 0.00 43.02 42.21 4kbp s PHE 382 CO 0.82 -0.33 0.24 -0.98 1.83 0.00 0.00 175.22 176.80 4kbp s ARG 383 N 0.83 0.37 -0.16 10.12 1.70 -1.26 -0.16 118.95 130.39 4kbp s ARG 383 Ca -0.03 0.14 -0.19 0.00 -0.47 0.00 0.00 55.73 55.18 4kbp s ARG 383 Cb -0.05 0.17 0.05 0.00 -0.57 0.00 0.00 34.95 34.56 4kbp s ARG 383 CO -0.10 -0.07 0.51 -2.00 -1.08 0.00 0.00 175.30 172.56 4kbp s GLU 384 N -0.34 0.65 -1.16 3.89 2.12 -0.19 -4.97 118.70 118.70 4kbp s GLU 384 Ca -0.04 0.58 -0.08 0.00 0.36 0.00 0.00 54.97 55.79 4kbp s GLU 384 Cb -0.03 0.31 0.25 0.00 0.26 0.00 0.00 34.13 34.92 4kbp s GLU 384 CO 0.01 -0.11 1.48 0.00 -0.54 0.00 0.00 175.26 176.11 4kbp n ALA 385 N 2.48 4.78 -2.61 6.30 0.00 -1.26 -0.10 120.51 130.09 4kbp n ALA 385 Ca -0.15 -4.56 -0.12 0.00 0.00 0.00 0.00 53.44 48.61 4kbp n ALA 385 Cb 0.56 -2.65 -0.11 0.00 0.00 0.00 0.00 19.45 17.26 4kbp n ALA 385 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 4kbp s SER 386 N 0.37 0.89 0.43 0.00 0.01 -1.26 -4.95 113.70 109.18 4kbp s SER 386 Ca 0.35 -0.72 -0.20 0.00 1.31 0.00 0.00 55.95 56.69 4kbp s SER 386 Cb 0.01 0.07 -0.11 0.00 0.21 0.00 0.00 66.02 66.20 4kbp s SER 386 CO 0.02 -0.32 0.93 -0.36 0.41 0.00 0.00 173.24 173.93 4kbp s PHE 387 N -2.24 3.33 -3.12 2.43 0.08 -1.26 -4.56 117.98 112.64 4kbp s PHE 387 Ca -0.03 1.56 0.00 0.00 0.12 0.00 0.00 56.93 58.59 4kbp s PHE 387 Cb -0.04 -2.82 0.00 0.00 -0.57 0.00 0.00 43.02 39.59 4kbp s PHE 387 CO -0.02 -0.11 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 4kbp n GLY 388 N -0.70 -1.73 3.35 4.36 0.00 -0.22 -1.02 105.19 109.24 4kbp n GLY 388 Ca 0.07 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 4kbp n GLY 388 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 4kbp s HIS 389 N -2.57 1.67 0.31 1.61 -3.43 -1.20 -3.50 115.29 108.19 4kbp s HIS 389 Ca 0.00 -1.45 0.03 0.00 -0.80 0.00 0.00 55.06 52.84 4kbp s HIS 389 Cb 0.00 -0.86 -0.06 0.00 -1.43 0.00 0.00 32.58 30.23 4kbp s HIS 389 CO 0.00 -0.59 0.07 0.20 -2.00 0.00 0.00 174.74 172.41 4kbp s GLY 390 N -3.41 2.02 -0.01 -1.38 0.00 0.07 -2.13 107.32 102.48 4kbp s GLY 390 Ca 0.35 -2.03 -0.00 0.00 0.00 0.00 0.00 44.72 43.04 4kbp s GLY 390 CO 0.20 -1.78 0.01 1.06 0.00 0.00 0.00 173.10 172.59 4kbp s MET 391 N -3.92 -0.00 -0.26 2.90 -1.94 -0.88 -0.52 119.30 114.69 4kbp s MET 391 Ca 0.37 0.05 0.02 0.00 -1.71 0.00 0.00 55.69 54.42 4kbp s MET 391 Cb 0.09 -0.05 0.07 0.00 2.01 0.00 0.00 34.83 36.94 4kbp s MET 391 CO 0.15 -0.04 -0.05 0.12 -0.01 0.00 0.00 175.02 175.20 4kbp s PHE 392 N 0.25 2.75 -0.50 -0.03 5.36 -0.04 -1.43 117.98 124.34 4kbp s PHE 392 Ca -0.02 -2.05 -0.13 0.00 -0.96 0.00 0.00 56.93 53.76 4kbp s PHE 392 Cb -0.03 -1.84 0.11 0.00 -0.34 0.00 0.00 43.02 40.93 4kbp s PHE 392 CO -0.01 -0.83 0.42 0.34 -1.46 0.00 0.00 175.22 173.68 4kbp s ASP 393 N 1.27 6.00 -0.07 6.13 -1.08 -0.25 -1.12 116.67 127.56 4kbp s ASP 393 Ca -0.04 -1.70 -0.30 0.00 -0.52 0.00 0.00 52.55 49.99 4kbp s ASP 393 Cb -0.19 -2.13 -0.02 0.00 -1.46 0.00 0.00 42.92 39.11 4kbp s ASP 393 CO -0.07 -0.75 1.10 -0.63 0.52 0.00 0.00 175.17 175.35 4kbp s ILE 394 N 1.53 4.51 -0.18 4.11 1.01 -0.34 -0.38 121.20 131.48 4kbp s ILE 394 Ca 0.04 1.81 -0.08 0.00 0.00 0.00 0.00 60.65 62.42 4kbp s ILE 394 Cb -0.27 -4.16 -0.08 0.00 0.01 0.00 0.00 42.46 37.96 4kbp s ILE 394 CO 0.03 0.02 -0.22 0.29 0.00 0.00 0.00 174.94 175.06 4kbp n LYS 395 N 4.97 0.38 -2.50 2.79 4.76 0.04 -2.37 118.16 126.23 4kbp n LYS 395 Ca 0.10 0.16 -0.05 0.00 -2.87 0.00 0.00 58.31 55.64 4kbp n LYS 395 Cb 0.48 -1.15 -0.02 0.00 -1.84 0.00 0.00 35.03 32.50 4kbp n LYS 395 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 4kbp n ASN 396 N -3.68 0.95 0.05 4.39 3.02 -0.15 -4.36 115.26 115.48 4kbp n ASN 396 Ca -0.34 -1.46 0.13 0.00 -0.03 0.00 0.00 54.58 52.88 4kbp n ASN 396 Cb 0.75 0.22 0.36 0.00 -0.61 0.00 0.00 39.78 40.51 4kbp n ASN 396 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 4kbp n ARG 397 N -0.19 0.16 -0.03 3.52 1.85 -1.25 -3.90 116.66 116.82 4kbp n ARG 397 Ca -0.01 0.09 -0.02 0.00 -1.00 0.00 0.00 57.85 56.91 4kbp n ARG 397 Cb 0.13 -1.65 -0.07 0.00 -1.05 0.00 0.00 32.46 29.83 4kbp n ARG 397 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 4kbp n THR 398 N -1.91 0.42 -5.25 8.89 -2.24 -1.26 -4.61 114.28 108.32 4kbp n THR 398 Ca 0.05 -0.31 -0.31 0.00 -2.27 0.00 0.00 64.05 61.21 4kbp n THR 398 Cb 0.40 -0.52 -0.16 0.00 -2.10 0.00 0.00 70.33 67.95 4kbp n THR 398 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 4kbp s HIS 399 N -2.30 2.39 -0.08 4.78 3.76 -1.25 -1.57 115.29 121.03 4kbp s HIS 399 Ca -0.04 -0.48 -0.08 0.00 -0.15 0.00 0.00 55.06 54.31 4kbp s HIS 399 Cb 0.03 -1.54 0.02 0.00 1.11 0.00 0.00 32.58 32.21 4kbp s HIS 399 CO 0.34 -0.06 0.23 0.00 -0.85 0.00 0.00 174.74 174.41 4kbp s ALA 400 N -0.51 -0.58 -0.16 -1.40 0.00 -1.10 -0.78 121.76 117.22 4kbp s ALA 400 Ca 0.07 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.65 4kbp s ALA 400 Cb -0.11 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.69 4kbp s ALA 400 CO 0.00 -0.12 -0.19 -1.58 0.00 0.00 0.00 175.76 173.87 4kbp s HIS 401 N -0.01 2.57 -0.07 0.00 2.46 0.49 -0.01 115.29 120.73 4kbp s HIS 401 Ca -0.01 -1.45 -0.08 0.00 0.47 0.00 0.00 55.06 53.99 4kbp s HIS 401 Cb -0.02 -1.80 -0.04 0.00 -0.13 0.00 0.00 32.58 30.59 4kbp s HIS 401 CO 0.01 -0.72 0.21 0.12 -2.47 0.00 0.00 174.74 171.89 4kbp s PHE 402 N 1.22 3.62 0.07 3.88 5.36 -0.01 -1.09 117.98 131.03 4kbp s PHE 402 Ca 0.02 0.61 0.02 0.00 -0.96 0.00 0.00 56.93 56.61 4kbp s PHE 402 Cb -0.14 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.51 4kbp s PHE 402 CO -0.10 0.69 -0.07 -1.12 -1.46 0.00 0.00 175.22 173.17 4kbp s SER 403 N -1.23 0.96 -0.12 6.13 0.01 -0.52 -1.42 113.70 117.52 4kbp s SER 403 Ca 0.20 -0.85 -0.02 0.00 1.31 0.00 0.00 55.95 56.59 4kbp s SER 403 Cb -0.13 0.09 0.04 0.00 0.21 0.00 0.00 66.02 66.22 4kbp s SER 403 CO 0.09 -0.39 -0.00 0.86 0.41 0.00 0.00 173.24 174.21 4kbp s TRP 404 N -2.89 0.95 -0.29 2.43 -0.00 -0.50 -2.06 118.94 116.57 4kbp s TRP 404 Ca 0.04 -0.51 -0.10 0.00 -0.00 0.00 0.00 56.10 55.54 4kbp s TRP 404 Cb 0.00 -0.96 -0.02 0.00 -0.00 0.00 0.00 33.47 32.49 4kbp s TRP 404 CO -0.04 -0.46 0.15 1.21 -0.00 0.00 0.00 176.95 177.82 4kbp s ASN 405 N 1.88 5.58 0.53 5.86 3.84 -0.91 -1.41 114.94 130.32 4kbp s ASN 405 Ca 0.03 -0.34 -0.18 0.00 0.21 0.00 0.00 52.86 52.58 4kbp s ASN 405 Cb -0.14 -2.02 -0.07 0.00 -0.55 0.00 0.00 41.25 38.48 4kbp s ASN 405 CO -0.07 -0.13 1.02 -0.13 -2.79 0.00 0.00 177.10 175.01 4kbp s ARG 406 N 1.65 3.70 0.31 0.43 0.52 -1.26 -3.21 118.95 121.09 4kbp s ARG 406 Ca 0.06 1.17 0.08 0.00 -0.52 0.00 0.00 55.73 56.52 4kbp s ARG 406 Cb -0.16 -2.09 0.50 0.00 0.52 0.00 0.00 34.95 33.72 4kbp s ARG 406 CO 0.07 -0.49 1.72 -0.91 0.02 0.00 0.00 175.30 175.70 4kbp h ASN 407 N 0.99 0.16 0.80 0.23 4.21 -1.44 -2.72 115.58 117.81 4kbp h ASN 407 Ca -0.48 -0.07 -0.07 0.00 1.21 0.00 0.00 56.30 56.90 4kbp h ASN 407 Cb 1.21 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 38.35 4kbp h ASN 407 CO 0.59 0.58 -0.33 1.56 -1.29 0.00 0.00 177.43 178.54 4kbp h GLN 408 N 0.13 0.00 -7.61 0.81 7.50 -1.92 -3.44 115.11 110.58 4kbp h GLN 408 Ca 0.01 0.00 -0.46 0.00 0.50 0.00 0.00 58.65 58.70 4kbp h GLN 408 Cb 0.82 0.00 0.11 0.00 0.05 0.00 0.00 27.48 28.46 4kbp h GLN 408 CO 0.06 0.33 0.37 -0.51 -1.50 0.00 0.00 178.83 177.58 4kbp s ASP 409 N -6.40 4.14 0.70 1.46 1.01 -1.03 -5.04 116.67 111.52 4kbp s ASP 409 Ca -0.00 0.53 -0.11 0.00 0.71 0.00 0.00 52.55 53.68 4kbp s ASP 409 Cb 0.11 -0.91 0.02 0.00 1.01 0.00 0.00 42.92 43.14 4kbp s ASP 409 CO 0.67 -2.10 1.09 -0.83 0.21 0.00 0.00 175.17 174.21 4kbp s GLY 410 N -4.67 1.63 0.53 0.21 0.00 -1.26 -4.90 107.32 98.86 4kbp s GLY 410 Ca 0.65 -0.37 0.36 0.00 0.00 0.00 0.00 44.72 45.36 4kbp s GLY 410 CO 0.49 -0.01 1.79 -2.08 0.00 0.00 0.00 173.10 173.29 4kbp h VAL 411 N -0.64 0.39 -0.37 1.40 2.07 -1.93 -0.99 116.25 116.18 4kbp h VAL 411 Ca -0.45 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.06 4kbp h VAL 411 Cb 1.26 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 4kbp h VAL 411 CO 0.64 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.23 4kbp n ALA 412 N -2.76 2.40 -2.72 1.67 0.00 -1.26 -4.67 120.51 113.17 4kbp n ALA 412 Ca 0.27 -0.99 -0.43 0.00 0.00 0.00 0.00 53.44 52.28 4kbp n ALA 412 Cb 1.27 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 4kbp n ALA 412 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 4kbp s VAL 413 N -1.37 4.54 -0.80 0.00 1.01 -0.38 -4.99 120.40 118.41 4kbp s VAL 413 Ca 0.36 -0.06 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 4kbp s VAL 413 Cb 0.21 -4.48 0.04 0.00 0.00 0.00 0.00 36.38 32.15 4kbp s VAL 413 CO 0.29 -1.05 1.31 -1.61 0.00 0.00 0.00 175.10 174.04 4kbp s GLU 414 N 3.52 3.28 0.00 2.72 2.02 -1.26 -4.18 118.70 124.79 4kbp s GLU 414 Ca 0.24 -0.45 0.10 0.00 0.02 0.00 0.00 54.97 54.88 4kbp s GLU 414 Cb -0.15 -4.44 0.50 0.00 0.10 0.00 0.00 34.13 30.14 4kbp s GLU 414 CO 0.16 -2.15 1.23 0.00 0.02 0.00 0.00 175.26 174.51 4kbp n ALA 415 N 9.22 1.62 -3.56 5.21 0.00 -0.50 -4.64 120.51 127.86 4kbp n ALA 415 Ca 0.09 -0.05 -0.16 0.00 0.00 0.00 0.00 53.44 53.33 4kbp n ALA 415 Cb 0.49 -1.17 -0.07 0.00 0.00 0.00 0.00 19.45 18.71 4kbp n ALA 415 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 4kbp s ASP 416 N -2.63 -0.69 -0.16 0.00 -1.08 -1.16 -4.96 116.67 106.00 4kbp s ASP 416 Ca 0.09 1.07 -0.22 0.00 -0.52 0.00 0.00 52.55 52.97 4kbp s ASP 416 Cb 0.07 1.00 0.06 0.00 -1.46 0.00 0.00 42.92 42.59 4kbp s ASP 416 CO 0.16 -0.41 0.57 -0.55 0.52 0.00 0.00 175.17 175.46 4kbp s SER 417 N -0.37 -0.57 -0.16 -0.34 0.15 -1.26 -1.41 113.70 109.74 4kbp s SER 417 Ca -0.05 0.95 -0.25 0.00 0.70 0.00 0.00 55.95 57.29 4kbp s SER 417 Cb -0.03 0.95 0.06 0.00 -1.71 0.00 0.00 66.02 65.29 4kbp s SER 417 CO 0.05 -0.32 0.64 -0.69 1.20 0.00 0.00 173.24 174.12 4kbp s VAL 418 N -0.21 0.00 -0.11 4.45 1.01 -0.51 -5.01 120.40 120.03 4kbp s VAL 418 Ca -0.04 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 4kbp s VAL 418 Cb -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 4kbp s VAL 418 CO 0.03 -0.02 0.07 0.26 0.00 0.00 0.00 175.10 175.44 4kbp s TRP 419 N -0.36 3.37 -0.17 5.22 0.52 -1.26 -0.83 118.94 125.43 4kbp s TRP 419 Ca -0.05 0.34 -0.06 0.00 0.02 0.00 0.00 56.10 56.34 4kbp s TRP 419 Cb -0.03 -1.88 -0.04 0.00 -1.15 0.00 0.00 33.47 30.37 4kbp s TRP 419 CO 0.05 0.57 0.05 -0.06 0.02 0.00 0.00 176.95 177.57 4kbp s PHE 420 N -0.85 3.23 -0.22 -1.98 0.40 0.98 -4.88 117.98 114.68 4kbp s PHE 420 Ca 0.13 0.07 -0.08 0.00 -0.60 0.00 0.00 56.93 56.45 4kbp s PHE 420 Cb -0.12 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.35 4kbp s PHE 420 CO 0.03 0.20 0.08 -0.06 0.70 0.00 0.00 175.22 176.16 4kbp s PHE 421 N 0.16 3.19 -0.25 0.36 0.08 -1.26 -2.72 117.98 117.54 4kbp s PHE 421 Ca 0.04 -0.09 -0.34 0.00 0.12 0.00 0.00 56.93 56.67 4kbp s PHE 421 Cb -0.12 -2.16 -0.10 0.00 -0.57 0.00 0.00 43.02 40.06 4kbp s PHE 421 CO 0.01 -0.05 2.10 -1.71 -0.10 0.00 0.00 175.22 175.47 4kbp n ASN 422 N 4.17 2.72 0.28 1.36 2.85 -0.61 -4.70 115.26 121.33 4kbp n ASN 422 Ca -0.16 0.53 0.12 0.00 -0.11 0.00 0.00 54.58 54.96 4kbp n ASN 422 Cb 0.52 -1.35 0.66 0.00 1.24 0.00 0.00 39.78 40.84 4kbp n ASN 422 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 4kbp h ARG 423 N 12.01 0.00 0.00 1.20 2.47 -1.84 0.12 114.38 128.33 4kbp h ARG 423 Ca -0.36 0.00 -0.24 0.00 -1.26 0.00 0.00 59.98 58.12 4kbp h ARG 423 Cb 1.29 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.57 4kbp h ARG 423 CO 0.99 0.00 -2.01 1.58 0.56 0.00 0.00 179.97 181.09 4kbp n HIS 424 N -2.61 0.00 0.23 3.04 -0.00 -1.26 -4.52 115.22 110.10 4kbp n HIS 424 Ca -0.02 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.22 4kbp n HIS 424 Cb 0.36 -0.70 -0.07 0.00 -0.12 0.00 0.00 29.99 29.46 4kbp n HIS 424 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 4kbp n TRP 425 N -2.49 0.00 -2.72 1.57 7.02 -0.54 -4.80 117.44 115.47 4kbp n TRP 425 Ca -0.22 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.18 4kbp n TRP 425 Cb 0.92 -0.14 0.09 0.00 -2.42 0.00 0.00 31.31 29.76 4kbp n TRP 425 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 4kbp n TYR 426 N -1.60 -2.61 -0.42 -5.99 9.36 0.30 -4.96 117.16 111.24 4kbp n TYR 426 Ca -0.00 -1.98 -0.09 0.00 3.32 0.00 0.00 57.90 59.15 4kbp n TYR 426 Cb 0.23 1.59 -0.04 0.00 -0.63 0.00 0.00 39.34 40.50 4kbp n TYR 426 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 4kbp n PRO 427 N 0.32 1.02 -3.98 2.98 -0.04 -1.03 -3.83 135.00 130.45 4kbp n PRO 427 Ca 0.04 -0.71 -0.29 0.00 -0.04 0.00 0.00 63.50 62.51 4kbp n PRO 427 Cb 0.71 -1.96 -0.04 0.00 -0.04 0.00 0.00 33.50 32.17 4kbp n PRO 427 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 4kbp s VAL 428 N 3.02 5.05 -0.53 0.52 1.01 -1.26 -4.97 120.40 123.23 4kbp s VAL 428 Ca 0.25 -0.67 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 4kbp s VAL 428 Cb 0.09 -3.52 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 4kbp s VAL 428 CO -0.01 0.02 2.42 -0.67 0.00 0.00 0.00 175.10 176.86 4kbp n ASP 429 N -0.04 2.05 0.02 3.32 -0.08 -1.26 -4.74 116.55 115.82 4kbp n ASP 429 Ca -0.07 -0.19 0.12 0.00 -1.51 0.00 0.00 54.79 53.14 4kbp n ASP 429 Cb 0.53 -1.42 0.20 0.00 2.34 0.00 0.00 41.12 42.77 4kbp n ASP 429 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 4kbp n ASP 430 N 13.71 0.56 -4.74 1.67 5.68 -1.26 -4.96 116.55 127.22 4kbp n ASP 430 Ca 0.42 -0.18 -0.42 0.00 -0.50 0.00 0.00 54.79 54.12 4kbp n ASP 430 Cb 0.40 0.30 -0.03 0.00 -1.14 0.00 0.00 41.12 40.66 4kbp n ASP 430 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 4kbp s SER 431 N -3.36 6.68 0.00 -1.12 0.01 -1.26 -4.85 113.70 109.79 4kbp s SER 431 Ca 0.09 2.60 0.21 0.00 1.31 0.00 0.00 55.95 60.16 4kbp s SER 431 Cb 0.16 -2.61 1.24 0.00 0.21 0.00 0.00 66.02 65.02 4kbp s SER 431 CO 0.72 -0.70 1.63 0.35 0.41 0.00 0.00 173.24 175.64