#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gkb s ASP 2 N 0.00 1.46 -0.21 0.00 1.01 -1.26 -5.04 116.67 112.63 1gkb s ASP 2 Ca 0.00 1.53 -0.01 0.00 0.71 0.00 0.00 52.55 54.78 1gkb s ASP 2 Cb 0.00 -2.26 0.02 0.00 1.01 0.00 0.00 42.92 41.69 1gkb s ASP 2 CO 0.00 -3.91 -0.12 -0.89 0.21 0.00 0.00 175.17 170.46 1gkb s THR 3 N -2.57 2.56 -0.08 -1.27 2.01 -1.26 -5.02 115.64 110.00 1gkb s THR 3 Ca 0.68 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.79 1gkb s THR 3 Cb -0.24 -2.19 0.01 0.00 0.01 0.00 0.00 72.50 70.09 1gkb s THR 3 CO 0.63 0.39 -0.18 -0.63 -0.69 0.00 0.00 174.62 174.13 1gkb s ILE 4 N 1.33 1.62 -0.08 1.82 -1.09 -1.26 -3.10 121.20 120.43 1gkb s ILE 4 Ca 0.03 -0.77 0.04 0.00 -2.23 0.00 0.00 60.65 57.73 1gkb s ILE 4 Cb -0.15 -1.43 -0.01 0.00 -1.58 0.00 0.00 42.46 39.30 1gkb s ILE 4 CO -0.08 0.46 -0.23 -0.69 -1.23 0.00 0.00 174.94 173.17 1gkb s VAL 5 N 0.48 2.19 0.09 2.92 1.01 -0.55 -0.77 120.40 125.77 1gkb s VAL 5 Ca -0.17 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 60.71 1gkb s VAL 5 Cb -0.17 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.39 1gkb s VAL 5 CO 0.06 0.56 0.25 0.00 0.00 0.00 0.00 175.10 175.98 1gkb s ALA 6 N 0.11 -0.45 -0.21 5.51 0.00 0.49 -0.25 121.76 126.96 1gkb s ALA 6 Ca -0.11 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.40 1gkb s ALA 6 Cb -0.16 0.53 -0.01 0.00 0.00 0.00 0.00 23.12 23.48 1gkb s ALA 6 CO 0.06 -0.53 -0.06 0.08 0.00 0.00 0.00 175.76 175.31 1gkb s VAL 7 N -3.72 3.32 -0.05 0.00 1.01 0.03 -0.27 120.40 120.71 1gkb s VAL 7 Ca 0.03 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1gkb s VAL 7 Cb 0.04 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1gkb s VAL 7 CO -0.11 0.44 0.03 -1.83 0.00 0.00 0.00 175.10 173.63 1gkb s GLU 8 N 1.30 2.98 -0.54 2.72 -1.05 -0.29 -1.65 118.70 122.17 1gkb s GLU 8 Ca 0.04 -0.45 -0.05 0.00 -0.15 0.00 0.00 54.97 54.35 1gkb s GLU 8 Cb -0.14 -2.80 0.14 0.00 -0.44 0.00 0.00 34.13 30.89 1gkb s GLU 8 CO -0.02 0.68 0.38 -0.51 0.95 0.00 0.00 175.26 176.73 1gkb s LEU 9 N -1.22 5.50 -0.39 1.83 1.02 0.86 -1.09 118.68 125.19 1gkb s LEU 9 Ca 0.17 -2.36 -0.14 0.00 0.02 0.00 0.00 54.13 51.82 1gkb s LEU 9 Cb -0.12 -1.92 0.01 0.00 0.02 0.00 0.00 46.19 44.19 1gkb s LEU 9 CO 0.07 -0.52 0.28 -0.62 0.02 0.00 0.00 176.35 175.57 1gkb s ASP 10 N 1.66 6.08 0.00 2.29 -1.08 0.31 -1.93 116.67 124.00 1gkb s ASP 10 Ca 0.12 -0.79 0.26 0.00 -0.52 0.00 0.00 52.55 51.62 1gkb s ASP 10 Cb -0.22 -2.15 0.70 0.00 -1.46 0.00 0.00 42.92 39.79 1gkb s ASP 10 CO -0.03 -0.40 1.54 0.35 0.52 0.00 0.00 175.17 177.15 1gkb n THR 11 N 5.14 0.00 -3.87 1.71 -2.24 -1.01 -1.71 114.28 112.30 1gkb n THR 11 Ca -0.11 -0.03 -0.27 0.00 -2.27 0.00 0.00 64.05 61.37 1gkb n THR 11 Cb 0.48 0.17 -0.17 0.00 -2.10 0.00 0.00 70.33 68.71 1gkb n THR 11 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1gkb s TYR 12 N -2.85 1.37 -0.47 4.78 5.04 -1.25 -4.68 117.35 119.30 1gkb s TYR 12 Ca 0.16 -0.75 -0.28 0.00 -2.44 0.00 0.00 57.07 53.76 1gkb s TYR 12 Cb 0.18 -1.17 0.01 0.00 0.35 0.00 0.00 41.96 41.33 1gkb s TYR 12 CO 0.62 -0.52 1.49 -2.14 -1.34 0.00 0.00 175.55 173.67 1gkb s PRO 13 N 1.74 3.38 -0.93 4.97 0.02 -1.26 -4.94 135.00 137.99 1gkb s PRO 13 Ca 0.03 0.81 -0.14 0.00 0.02 0.00 0.00 61.00 61.72 1gkb s PRO 13 Cb -0.14 -4.11 0.21 0.00 0.02 0.00 0.00 34.50 30.49 1gkb s PRO 13 CO -0.08 -1.81 0.95 -0.80 -0.33 0.00 0.00 177.00 174.93 1gkb s ASN 14 N 4.67 6.86 0.49 2.53 -0.87 -1.26 -4.90 114.94 122.46 1gkb s ASN 14 Ca 0.61 -2.74 0.28 0.00 -1.57 0.00 0.00 52.86 49.44 1gkb s ASN 14 Cb -0.14 -2.26 0.92 0.00 -0.02 0.00 0.00 41.25 39.75 1gkb s ASN 14 CO 0.29 -0.63 1.82 0.71 -2.57 0.00 0.00 177.10 176.72 1gkb h THR 15 N 4.79 0.11 0.00 1.60 1.35 -1.87 -2.11 112.91 116.78 1gkb h THR 15 Ca 0.15 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1gkb h THR 15 Cb 1.00 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1gkb h THR 15 CO 0.91 0.05 0.00 -2.24 -0.25 0.00 0.00 175.52 173.99 1gkb h ASP 16 N 0.00 0.00 -0.13 5.36 2.03 -1.90 -2.78 116.42 119.00 1gkb h ASP 16 Ca -0.00 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.24 1gkb h ASP 16 Cb 0.74 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.20 1gkb h ASP 16 CO 0.01 0.00 -0.27 2.30 -1.03 0.00 0.00 179.24 180.24 1gkb n ILE 17 N -2.48 2.29 -0.49 4.15 -5.35 -0.84 -4.99 119.36 111.65 1gkb n ILE 17 Ca 0.02 -2.89 0.00 0.00 -0.27 0.00 0.00 62.75 59.61 1gkb n ILE 17 Cb 0.27 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 37.90 1gkb n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gkb n GLY 18 N -1.13 0.75 3.76 3.28 0.00 -1.05 -4.76 105.19 106.04 1gkb n GLY 18 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1gkb n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gkb s ASP 19 N -2.83 5.26 0.87 1.61 1.01 -0.94 -4.92 116.67 116.73 1gkb s ASP 19 Ca 0.00 2.19 -0.12 0.00 0.71 0.00 0.00 52.55 55.34 1gkb s ASP 19 Cb 0.00 -2.58 0.11 0.00 1.01 0.00 0.00 42.92 41.46 1gkb s ASP 19 CO 0.00 -1.53 1.10 -2.16 0.21 0.00 0.00 175.17 172.78 1gkb s PRO 20 N -3.59 1.52 -0.05 8.23 0.04 -1.26 -4.32 135.00 135.56 1gkb s PRO 20 Ca 0.72 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1gkb s PRO 20 Cb -0.25 -1.85 0.05 0.00 0.04 0.00 0.00 34.50 32.49 1gkb s PRO 20 CO 0.34 -2.02 1.60 -1.13 0.04 0.00 0.00 177.00 175.84 1gkb n SER 21 N -3.71 4.48 -3.46 6.66 3.41 -1.26 -4.66 113.62 115.08 1gkb n SER 21 Ca 0.07 -2.37 -0.12 0.00 -0.26 0.00 0.00 58.87 56.19 1gkb n SER 21 Cb 0.56 -0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 63.63 1gkb n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1gkb s TYR 22 N -0.34 -0.48 0.40 7.33 -0.85 -1.26 -4.97 117.35 117.18 1gkb s TYR 22 Ca 0.06 0.28 -0.26 0.00 -0.52 0.00 0.00 57.07 56.62 1gkb s TYR 22 Cb 0.05 0.50 -0.10 0.00 0.38 0.00 0.00 41.96 42.78 1gkb s TYR 22 CO 0.00 -0.81 1.29 -2.30 -1.52 0.00 0.00 175.55 172.21 1gkb n PRO 23 N -0.30 2.02 -3.78 -3.49 -0.02 -1.26 -4.66 135.00 123.51 1gkb n PRO 23 Ca -0.17 0.72 -0.10 0.00 -2.02 0.00 0.00 63.50 61.93 1gkb n PRO 23 Cb 0.64 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 1gkb n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1gkb s HIS 24 N -1.17 -0.01 0.07 6.00 -3.43 -0.70 -1.41 115.29 114.65 1gkb s HIS 24 Ca 0.59 -0.33 0.04 0.00 -0.80 0.00 0.00 55.06 54.56 1gkb s HIS 24 Cb -0.52 0.28 -0.04 0.00 -1.43 0.00 0.00 32.58 30.87 1gkb s HIS 24 CO 0.59 -0.85 0.02 0.96 -2.00 0.00 0.00 174.74 173.46 1gkb s ILE 25 N -3.89 4.16 0.10 -5.38 -4.36 -0.26 -0.53 121.20 111.04 1gkb s ILE 25 Ca 0.10 -0.87 -0.11 0.00 -0.26 0.00 0.00 60.65 59.51 1gkb s ILE 25 Cb 0.00 -2.97 0.01 0.00 1.25 0.00 0.00 42.46 40.76 1gkb s ILE 25 CO -0.03 0.16 0.26 -0.83 0.24 0.00 0.00 174.94 174.74 1gkb s GLY 26 N -2.20 -0.01 -0.23 6.27 0.00 -0.25 -0.79 107.32 110.11 1gkb s GLY 26 Ca 0.26 -0.44 -0.07 0.00 0.00 0.00 0.00 44.72 44.46 1gkb s GLY 26 CO 0.18 -0.64 0.05 -0.42 0.00 0.00 0.00 173.10 172.27 1gkb s ILE 27 N -3.85 4.33 -0.22 0.90 -1.09 -0.44 -1.14 121.20 119.68 1gkb s ILE 27 Ca 0.05 -0.18 -0.03 0.00 -2.23 0.00 0.00 60.65 58.26 1gkb s ILE 27 Cb 0.04 -3.00 0.00 0.00 -1.58 0.00 0.00 42.46 37.93 1gkb s ILE 27 CO -0.11 0.38 -0.06 -1.81 -1.23 0.00 0.00 174.94 172.10 1gkb s ASP 28 N 1.27 4.16 -0.42 3.58 1.01 0.62 -0.52 116.67 126.38 1gkb s ASP 28 Ca 0.05 -0.55 0.01 0.00 0.71 0.00 0.00 52.55 52.77 1gkb s ASP 28 Cb -0.15 -1.69 0.11 0.00 1.01 0.00 0.00 42.92 42.21 1gkb s ASP 28 CO 0.03 -0.05 0.18 -0.63 0.21 0.00 0.00 175.17 174.91 1gkb s ILE 29 N 1.42 2.86 -1.39 0.77 -1.09 -1.26 -0.38 121.20 122.13 1gkb s ILE 29 Ca 0.04 -2.44 0.00 0.00 -2.23 0.00 0.00 60.65 56.03 1gkb s ILE 29 Cb -0.15 -3.00 0.00 0.00 -1.58 0.00 0.00 42.46 37.73 1gkb s ILE 29 CO -0.05 -0.69 0.00 0.29 -1.23 0.00 0.00 174.94 173.26 1gkb n LYS 30 N 4.14 -1.37 -3.56 2.79 5.02 0.05 -4.93 118.16 120.30 1gkb n LYS 30 Ca 0.02 0.94 -0.16 0.00 -2.02 0.00 0.00 58.31 57.10 1gkb n LYS 30 Cb 0.40 -5.21 -0.06 0.00 -0.02 0.00 0.00 35.03 30.14 1gkb n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1gkb s SER 31 N -2.59 -0.63 0.20 4.39 0.15 -1.26 -4.95 113.70 109.01 1gkb s SER 31 Ca 0.00 0.85 0.24 0.00 0.70 0.00 0.00 55.95 57.74 1gkb s SER 31 Cb 0.00 0.73 0.91 0.00 -1.71 0.00 0.00 66.02 65.95 1gkb s SER 31 CO 0.00 -0.47 1.73 0.55 1.20 0.00 0.00 173.24 176.24 1gkb n VAL 32 N 1.35 0.71 -2.67 4.45 3.14 -1.26 -4.42 118.33 119.63 1gkb n VAL 32 Ca -0.16 0.05 -0.42 0.00 -2.96 0.00 0.00 64.34 60.84 1gkb n VAL 32 Cb 0.57 -0.92 -0.03 0.00 -1.06 0.00 0.00 33.84 32.40 1gkb n VAL 32 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1gkb s ARG 33 N -3.20 3.36 0.38 1.45 0.52 -1.26 -4.96 118.95 115.23 1gkb s ARG 33 Ca 0.07 -0.86 -0.27 0.00 -0.52 0.00 0.00 55.73 54.16 1gkb s ARG 33 Cb 0.11 -4.66 -0.11 0.00 0.52 0.00 0.00 34.95 30.80 1gkb s ARG 33 CO 0.46 -2.04 1.23 0.43 0.02 0.00 0.00 175.30 175.39 1gkb n SER 34 N 8.46 2.38 0.20 0.23 7.64 -1.26 -4.82 113.62 126.45 1gkb n SER 34 Ca 0.14 1.15 0.07 0.00 1.01 0.00 0.00 58.87 61.24 1gkb n SER 34 Cb 0.49 -1.46 0.39 0.00 -1.01 0.00 0.00 64.21 62.61 1gkb n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1gkb h LYS 35 N 2.20 0.00 -2.61 1.43 1.79 -1.15 -3.45 116.57 114.79 1gkb h LYS 35 Ca -0.46 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.90 1gkb h LYS 35 Cb 1.30 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 31.71 1gkb h LYS 35 CO 0.61 0.31 -0.17 0.21 -1.08 0.00 0.00 179.45 179.33 1gkb s LYS 36 N -3.63 0.55 0.26 3.15 2.47 -1.24 -5.01 119.74 116.29 1gkb s LYS 36 Ca 0.00 0.65 0.04 0.00 -1.56 0.00 0.00 55.97 55.10 1gkb s LYS 36 Cb 0.11 0.27 -0.06 0.00 -1.46 0.00 0.00 37.83 36.69 1gkb s LYS 36 CO 0.67 -0.07 -0.00 0.95 0.16 0.00 0.00 175.35 177.06 1gkb s THR 37 N 0.24 1.21 -0.00 3.43 -4.23 -1.26 -1.33 115.64 113.69 1gkb s THR 37 Ca -0.00 -2.05 -0.02 0.00 -1.18 0.00 0.00 61.69 58.44 1gkb s THR 37 Cb -0.03 -2.46 -0.00 0.00 1.34 0.00 0.00 72.50 71.35 1gkb s THR 37 CO 0.01 -0.25 0.03 0.00 -0.54 0.00 0.00 174.62 173.86 1gkb s ALA 38 N -3.30 -0.06 0.39 3.99 0.00 0.03 -4.97 121.76 117.84 1gkb s ALA 38 Ca 0.30 -0.10 -0.27 0.00 0.00 0.00 0.00 51.96 51.89 1gkb s ALA 38 Cb 0.06 0.01 -0.10 0.00 0.00 0.00 0.00 23.12 23.08 1gkb s ALA 38 CO 0.11 -0.08 1.46 0.21 0.00 0.00 0.00 175.76 177.46 1gkb s LYS 39 N -0.53 4.02 -0.20 0.00 2.20 -1.26 -1.10 119.74 122.87 1gkb s LYS 39 Ca -0.06 2.52 -0.00 0.00 -0.36 0.00 0.00 55.97 58.06 1gkb s LYS 39 Cb -0.04 -2.90 0.05 0.00 -1.51 0.00 0.00 37.83 33.44 1gkb s LYS 39 CO -0.00 -0.58 -0.04 -0.46 -0.36 0.00 0.00 175.35 173.90 1gkb s TRP 40 N -1.14 1.93 -1.27 4.03 -0.00 -0.50 -4.74 118.94 117.25 1gkb s TRP 40 Ca 0.55 -1.36 -0.17 0.00 -0.00 0.00 0.00 56.10 55.12 1gkb s TRP 40 Cb -0.45 -1.40 0.10 0.00 -0.00 0.00 0.00 33.47 31.72 1gkb s TRP 40 CO 0.61 -0.69 1.64 -0.80 -0.00 0.00 0.00 176.95 177.71 1gkb s ASN 41 N 1.55 6.91 0.43 5.86 0.01 -1.26 -4.47 114.94 123.98 1gkb s ASN 41 Ca -0.02 -2.61 -0.24 0.00 -0.71 0.00 0.00 52.86 49.28 1gkb s ASN 41 Cb -0.17 -2.52 -0.08 0.00 0.41 0.00 0.00 41.25 38.89 1gkb s ASN 41 CO -0.07 -1.04 1.15 0.00 -1.51 0.00 0.00 177.10 175.63 1gkb s MET 42 N 3.38 3.90 -0.42 -0.60 0.23 -1.26 -5.00 119.30 119.54 1gkb s MET 42 Ca 0.50 1.76 0.03 0.00 -1.03 0.00 0.00 55.69 56.95 1gkb s MET 42 Cb 0.02 -2.50 0.11 0.00 -1.53 0.00 0.00 34.83 30.93 1gkb s MET 42 CO 0.05 -0.43 0.15 -0.65 -2.03 0.00 0.00 175.02 172.11 1gkb s GLN 43 N -2.56 1.75 0.31 3.16 -0.21 -1.26 -5.09 119.66 115.76 1gkb s GLN 43 Ca 0.61 -2.12 -0.29 0.00 0.02 0.00 0.00 55.36 53.57 1gkb s GLN 43 Cb -0.28 -3.32 -0.12 0.00 1.00 0.00 0.00 33.01 30.29 1gkb s GLN 43 CO 0.35 -1.02 1.53 -1.71 -2.12 0.00 0.00 175.29 172.32 1gkb n ASN 44 N 3.92 3.66 0.00 5.90 5.15 -1.26 -2.17 115.26 130.46 1gkb n ASN 44 Ca 0.04 1.17 0.00 0.00 -0.60 0.00 0.00 54.58 55.19 1gkb n ASN 44 Cb 0.39 -1.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.06 1gkb n ASN 44 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gkb n GLY 45 N 1.64 0.61 3.65 8.20 0.00 0.38 -4.95 105.19 114.72 1gkb n GLY 45 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1gkb n GLY 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gkb s LYS 46 N -0.31 2.70 -0.13 1.61 2.20 -0.92 -4.97 119.74 119.92 1gkb s LYS 46 Ca 0.00 -0.65 -0.29 0.00 -0.36 0.00 0.00 55.97 54.67 1gkb s LYS 46 Cb 0.00 -2.61 -0.01 0.00 -1.51 0.00 0.00 37.83 33.70 1gkb s LYS 46 CO 0.00 0.62 1.12 0.08 -0.36 0.00 0.00 175.35 176.81 1gkb s VAL 47 N -1.04 4.50 0.41 4.02 1.01 -1.26 -4.47 120.40 123.57 1gkb s VAL 47 Ca 0.18 1.80 0.07 0.00 0.00 0.00 0.00 61.98 64.04 1gkb s VAL 47 Cb -0.11 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1gkb s VAL 47 CO 0.09 -0.06 0.21 -0.83 0.00 0.00 0.00 175.10 174.51 1gkb s GLY 48 N 1.40 2.31 -0.03 4.51 0.00 -0.23 -4.47 107.32 110.81 1gkb s GLY 48 Ca 0.51 -2.08 0.05 0.00 0.00 0.00 0.00 44.72 43.20 1gkb s GLY 48 CO 0.16 -1.88 -0.16 -1.59 0.00 0.00 0.00 173.10 169.63 1gkb s THR 49 N -2.58 1.34 -0.03 0.90 2.01 -0.16 -0.72 115.64 116.40 1gkb s THR 49 Ca 0.42 -0.69 0.06 0.00 0.31 0.00 0.00 61.69 61.79 1gkb s THR 49 Cb 0.03 -1.13 -0.01 0.00 0.01 0.00 0.00 72.50 71.39 1gkb s THR 49 CO 0.23 0.38 -0.21 0.00 -0.69 0.00 0.00 174.62 174.34 1gkb s ALA 50 N -0.16 1.75 -0.09 7.40 0.00 -0.28 -1.08 121.76 129.29 1gkb s ALA 50 Ca 0.01 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.10 1gkb s ALA 50 Cb -0.09 -0.49 0.02 0.00 0.00 0.00 0.00 23.12 22.56 1gkb s ALA 50 CO 0.01 0.39 -0.06 -1.58 0.00 0.00 0.00 175.76 174.51 1gkb s HIS 51 N -0.31 1.18 -0.08 0.00 5.04 0.51 -1.74 115.29 119.88 1gkb s HIS 51 Ca 0.03 -0.50 0.04 0.00 -1.54 0.00 0.00 55.06 53.09 1gkb s HIS 51 Cb -0.10 -1.02 0.00 0.00 0.04 0.00 0.00 32.58 31.50 1gkb s HIS 51 CO 0.01 -0.39 -0.20 0.42 -2.34 0.00 0.00 174.74 172.24 1gkb s ILE 52 N 1.50 1.69 0.03 0.89 1.01 0.22 -0.51 121.20 126.02 1gkb s ILE 52 Ca -0.00 -0.82 -0.00 0.00 0.00 0.00 0.00 60.65 59.82 1gkb s ILE 52 Cb -0.13 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 1gkb s ILE 52 CO -0.05 0.48 -0.03 0.27 0.00 0.00 0.00 174.94 175.62 1gkb s ILE 53 N 0.34 0.14 -0.17 2.92 -4.36 -0.07 -0.58 121.20 119.42 1gkb s ILE 53 Ca -0.14 -1.16 -0.27 0.00 -0.26 0.00 0.00 60.65 58.83 1gkb s ILE 53 Cb -0.16 -0.61 0.07 0.00 1.25 0.00 0.00 42.46 43.01 1gkb s ILE 53 CO 0.06 -0.64 0.68 -0.47 0.24 0.00 0.00 174.94 174.81 1gkb s TYR 54 N -2.14 -0.71 0.05 1.37 5.04 -0.87 -1.40 117.35 118.69 1gkb s TYR 54 Ca -0.10 1.53 -0.05 0.00 -2.44 0.00 0.00 57.07 56.01 1gkb s TYR 54 Cb -0.05 0.32 -0.01 0.00 0.35 0.00 0.00 41.96 42.57 1gkb s TYR 54 CO -0.03 -0.47 0.09 0.54 -1.34 0.00 0.00 175.55 174.34 1gkb s ASN 55 N -0.33 0.22 0.00 4.32 2.20 -1.26 -1.34 114.94 118.76 1gkb s ASN 55 Ca -0.05 -0.65 0.28 0.00 -0.94 0.00 0.00 52.86 51.50 1gkb s ASN 55 Cb -0.03 0.25 1.42 0.00 -2.00 0.00 0.00 41.25 40.89 1gkb s ASN 55 CO 0.05 -0.58 1.98 -1.54 -2.94 0.00 0.00 177.10 174.06 1gkb n SER 56 N 0.44 0.00 -0.03 3.54 3.41 0.09 -0.42 113.62 120.65 1gkb n SER 56 Ca -0.17 -0.06 -0.18 0.00 -0.26 0.00 0.00 58.87 58.20 1gkb n SER 56 Cb 0.60 -0.31 -0.13 0.00 -0.26 0.00 0.00 64.21 64.11 1gkb n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1gkb h VAL 57 N 0.00 1.49 0.00 -3.33 2.07 -1.92 -3.38 116.25 111.17 1gkb h VAL 57 Ca 0.00 -2.39 -0.22 0.00 0.82 0.00 0.00 66.70 64.91 1gkb h VAL 57 Cb 0.29 3.09 -0.04 0.00 -1.52 0.00 0.00 31.29 33.11 1gkb h VAL 57 CO 0.00 0.62 -1.64 0.47 0.02 0.00 0.00 177.57 177.04 1gkb n ASP 58 N -4.35 0.72 -3.80 0.57 8.00 -1.22 -4.99 116.55 111.49 1gkb n ASP 58 Ca -0.16 0.32 -0.25 0.00 0.71 0.00 0.00 54.79 55.41 1gkb n ASP 58 Cb 0.67 0.29 0.02 0.00 -0.02 0.00 0.00 41.12 42.08 1gkb n ASP 58 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gkb n LYS 59 N -2.88 -4.97 -4.06 -1.24 5.02 0.44 -4.90 118.16 105.56 1gkb n LYS 59 Ca -0.14 0.59 -0.30 0.00 -2.02 0.00 0.00 58.31 56.44 1gkb n LYS 59 Cb 0.92 -5.23 -0.16 0.00 -0.02 0.00 0.00 35.03 30.54 1gkb n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1gkb s ARG 60 N -6.26 2.25 -0.23 1.97 3.52 -1.26 -1.28 118.95 117.66 1gkb s ARG 60 Ca 0.24 -0.54 -0.16 0.00 -0.13 0.00 0.00 55.73 55.14 1gkb s ARG 60 Cb -0.12 -2.06 -0.04 0.00 -1.56 0.00 0.00 34.95 31.18 1gkb s ARG 60 CO 0.83 -0.22 0.43 -1.17 -0.81 0.00 0.00 175.30 174.35 1gkb s LEU 61 N 1.45 4.10 0.07 -0.88 2.96 -0.30 -4.30 118.68 121.77 1gkb s LEU 61 Ca 0.04 0.46 0.06 0.00 -0.22 0.00 0.00 54.13 54.47 1gkb s LEU 61 Cb -0.13 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.99 1gkb s LEU 61 CO -0.10 -0.16 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.18 1gkb s SER 62 N 1.34 1.82 0.01 3.68 0.01 -0.49 -0.93 113.70 119.14 1gkb s SER 62 Ca 0.19 -0.61 -0.01 0.00 1.31 0.00 0.00 55.95 56.83 1gkb s SER 62 Cb -0.15 -0.07 -0.01 0.00 0.21 0.00 0.00 66.02 66.00 1gkb s SER 62 CO 0.09 -0.04 -0.00 0.00 0.41 0.00 0.00 173.24 173.69 1gkb s ALA 63 N -1.21 0.03 -0.05 1.44 0.00 -0.16 -0.89 121.76 120.92 1gkb s ALA 63 Ca -0.00 -0.32 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1gkb s ALA 63 Cb -0.10 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.12 1gkb s ALA 63 CO 0.02 -0.10 -0.10 0.08 0.00 0.00 0.00 175.76 175.66 1gkb s VAL 64 N -0.90 0.93 -0.06 0.00 1.01 0.33 -1.40 120.40 120.31 1gkb s VAL 64 Ca -0.10 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.55 1gkb s VAL 64 Cb -0.06 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1gkb s VAL 64 CO -0.00 0.30 -0.17 -0.69 0.00 0.00 0.00 175.10 174.54 1gkb s VAL 65 N 0.64 1.46 0.18 2.92 1.01 0.21 -0.37 120.40 126.46 1gkb s VAL 65 Ca -0.12 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 60.92 1gkb s VAL 65 Cb -0.14 -1.28 0.07 0.00 0.00 0.00 0.00 36.38 35.03 1gkb s VAL 65 CO 0.02 0.42 0.97 -0.94 0.00 0.00 0.00 175.10 175.57 1gkb s SER 66 N 0.27 -0.12 0.16 3.32 1.04 -0.24 -0.91 113.70 117.21 1gkb s SER 66 Ca -0.10 -0.51 0.10 0.00 0.48 0.00 0.00 55.95 55.93 1gkb s SER 66 Cb -0.14 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 1gkb s SER 66 CO 0.04 -0.97 -0.23 -0.31 0.98 0.00 0.00 173.24 172.74 1gkb s TYR 67 N -2.98 2.13 0.30 5.02 2.02 -1.26 -0.99 117.35 121.60 1gkb s TYR 67 Ca 0.15 -0.39 -0.29 0.00 -0.37 0.00 0.00 57.07 56.16 1gkb s TYR 67 Cb -0.02 -1.09 -0.13 0.00 -0.40 0.00 0.00 41.96 40.32 1gkb s TYR 67 CO 0.04 0.39 1.25 -2.30 -1.57 0.00 0.00 175.55 173.36 1gkb n PRO 68 N 0.53 1.91 -1.47 -1.71 -0.02 -1.26 -2.00 135.00 130.97 1gkb n PRO 68 Ca -0.15 0.67 -0.16 0.00 -2.02 0.00 0.00 63.50 61.84 1gkb n PRO 68 Cb 0.55 -2.22 -0.07 0.00 -0.02 0.00 0.00 33.50 31.74 1gkb n PRO 68 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1gkb n ASN 69 N 1.21 -4.97 -4.41 2.55 3.02 -1.26 -4.99 115.26 106.41 1gkb n ASN 69 Ca 0.08 0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 54.82 1gkb n ASN 69 Cb 0.34 -3.90 -0.10 0.00 -0.61 0.00 0.00 39.78 35.50 1gkb n ASN 69 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gkb s ALA 70 N -2.60 2.25 0.24 5.41 0.00 -0.85 -5.12 121.76 121.09 1gkb s ALA 70 Ca 0.00 -1.88 -0.30 0.00 0.00 0.00 0.00 51.96 49.78 1gkb s ALA 70 Cb 0.00 0.26 -0.09 0.00 0.00 0.00 0.00 23.12 23.29 1gkb s ALA 70 CO 0.00 -0.11 1.03 -0.51 0.00 0.00 0.00 175.76 176.17 1gkb s ASP 71 N -3.42 7.43 0.66 0.00 1.01 -1.26 -4.70 116.67 116.39 1gkb s ASP 71 Ca 0.29 2.09 -0.11 0.00 0.71 0.00 0.00 52.55 55.53 1gkb s ASP 71 Cb 0.04 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 1gkb s ASP 71 CO 0.11 -0.03 1.06 -0.94 0.21 0.00 0.00 175.17 175.57 1gkb s SER 72 N -0.81 5.84 -0.08 0.27 1.04 -1.26 -4.79 113.70 113.90 1gkb s SER 72 Ca 0.44 1.35 0.01 0.00 0.48 0.00 0.00 55.95 58.24 1gkb s SER 72 Cb -0.29 -2.30 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 1gkb s SER 72 CO 0.36 -1.11 -0.12 0.00 0.98 0.00 0.00 173.24 173.35 1gkb s ALA 73 N -3.21 2.74 0.01 5.32 0.00 -0.09 -4.99 121.76 121.54 1gkb s ALA 73 Ca 0.56 -0.92 0.04 0.00 0.00 0.00 0.00 51.96 51.65 1gkb s ALA 73 Cb -0.11 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.86 1gkb s ALA 73 CO 0.53 0.45 -0.14 0.99 0.00 0.00 0.00 175.76 177.60 1gkb s THR 74 N -0.36 1.08 0.00 0.00 2.01 -1.26 -0.62 115.64 116.49 1gkb s THR 74 Ca 0.04 -0.75 -0.00 0.00 0.31 0.00 0.00 61.69 61.28 1gkb s THR 74 Cb -0.12 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.44 1gkb s THR 74 CO 0.02 0.17 -0.00 0.54 -0.69 0.00 0.00 174.62 174.66 1gkb s VAL 75 N -0.54 0.04 0.01 3.82 0.11 -0.49 -4.73 120.40 118.62 1gkb s VAL 75 Ca 0.04 -0.32 -0.05 0.00 -2.93 0.00 0.00 61.98 58.71 1gkb s VAL 75 Cb -0.06 -0.11 -0.01 0.00 -1.53 0.00 0.00 36.38 34.67 1gkb s VAL 75 CO 0.00 -0.18 0.08 -0.44 -3.33 0.00 0.00 175.10 171.23 1gkb s SER 76 N -0.52 0.11 -0.17 3.54 0.01 -1.26 -0.99 113.70 114.42 1gkb s SER 76 Ca -0.06 -0.32 -0.10 0.00 1.31 0.00 0.00 55.95 56.78 1gkb s SER 76 Cb -0.04 0.17 0.06 0.00 0.21 0.00 0.00 66.02 66.42 1gkb s SER 76 CO -0.00 -0.35 0.42 -0.47 0.41 0.00 0.00 173.24 173.24 1gkb s TYR 77 N -1.47 -0.60 -0.12 2.43 5.04 -0.11 -4.91 117.35 117.61 1gkb s TYR 77 Ca -0.15 1.30 -0.29 0.00 -2.44 0.00 0.00 57.07 55.49 1gkb s TYR 77 Cb -0.08 0.27 -0.01 0.00 0.35 0.00 0.00 41.96 42.48 1gkb s TYR 77 CO 0.00 -0.34 1.06 -0.51 -1.34 0.00 0.00 175.55 174.43 1gkb s ASP 78 N 1.32 7.17 -0.25 4.32 1.01 -1.26 -1.15 116.67 127.83 1gkb s ASP 78 Ca -0.09 1.57 -0.16 0.00 0.71 0.00 0.00 52.55 54.58 1gkb s ASP 78 Cb -0.08 -2.55 0.07 0.00 1.01 0.00 0.00 42.92 41.37 1gkb s ASP 78 CO -0.12 -0.53 0.62 0.54 0.21 0.00 0.00 175.17 175.89 1gkb s VAL 79 N 2.35 -0.01 -0.63 -1.27 0.11 -0.40 -4.98 120.40 115.57 1gkb s VAL 79 Ca 0.49 0.02 -0.22 0.00 -2.93 0.00 0.00 61.98 59.34 1gkb s VAL 79 Cb -0.19 -0.89 0.07 0.00 -1.53 0.00 0.00 36.38 33.84 1gkb s VAL 79 CO 0.16 0.01 0.92 -0.62 -3.33 0.00 0.00 175.10 172.24 1gkb s ASP 80 N 1.27 6.20 0.64 3.54 -1.08 -1.26 -4.43 116.67 121.55 1gkb s ASP 80 Ca -0.07 -0.93 0.42 0.00 -0.52 0.00 0.00 52.55 51.45 1gkb s ASP 80 Cb -0.06 -2.40 2.18 0.00 -1.46 0.00 0.00 42.92 41.18 1gkb s ASP 80 CO -0.13 -1.35 2.28 -0.07 0.52 0.00 0.00 175.17 176.42 1gkb h LEU 81 N 11.08 0.00 -2.00 -1.34 3.38 -1.98 -1.96 115.31 122.50 1gkb h LEU 81 Ca -0.28 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1gkb h LEU 81 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1gkb h LEU 81 CO 1.15 0.00 -0.08 0.44 0.09 0.00 0.00 178.44 180.04 1gkb h ASP 82 N 0.00 0.00 -0.10 -0.43 5.19 -1.91 -0.78 116.42 118.40 1gkb h ASP 82 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1gkb h ASP 82 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 1gkb h ASP 82 CO 0.00 0.08 0.00 0.59 -3.12 0.00 0.00 179.24 176.79 1gkb n ASN 83 N -4.11 2.18 -0.01 6.45 5.03 -0.74 -4.63 115.26 119.43 1gkb n ASN 83 Ca -0.03 -1.74 -0.05 0.00 0.87 0.00 0.00 54.58 53.64 1gkb n ASN 83 Cb 0.16 -0.05 -0.02 0.00 -1.02 0.00 0.00 39.78 38.85 1gkb n ASN 83 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1gkb n VAL 84 N 0.68 0.78 -3.27 2.41 0.31 -0.41 -5.08 118.33 113.75 1gkb n VAL 84 Ca 0.17 0.11 -0.24 0.00 -0.01 0.00 0.00 64.34 64.37 1gkb n VAL 84 Cb 0.45 -1.67 -0.01 0.00 -0.91 0.00 0.00 33.84 31.70 1gkb n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1gkb s LEU 85 N -6.74 3.94 0.73 7.52 1.43 -0.52 -4.99 118.68 120.05 1gkb s LEU 85 Ca -0.08 0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 53.38 1gkb s LEU 85 Cb 0.02 -3.35 0.03 0.00 0.03 0.00 0.00 46.19 42.93 1gkb s LEU 85 CO 0.11 -0.36 1.08 -2.16 0.23 0.00 0.00 176.35 175.25 1gkb s PRO 86 N -4.38 2.55 0.23 1.29 0.04 -1.26 -4.79 135.00 128.68 1gkb s PRO 86 Ca 0.42 1.15 -0.06 0.00 0.04 0.00 0.00 61.00 62.54 1gkb s PRO 86 Cb -0.10 -1.93 0.32 0.00 0.04 0.00 0.00 34.50 32.83 1gkb s PRO 86 CO 0.37 -1.41 1.83 0.93 0.04 0.00 0.00 177.00 178.76 1gkb h GLU 87 N -0.78 0.83 -5.54 4.56 5.08 -1.95 -3.41 114.58 113.38 1gkb h GLU 87 Ca -0.44 -0.05 -0.65 0.00 -1.00 0.00 0.00 59.36 57.22 1gkb h GLU 87 Cb 1.23 -0.19 -0.18 0.00 0.50 0.00 0.00 28.75 30.11 1gkb h GLU 87 CO 0.53 0.55 -0.63 -1.58 -1.00 0.00 0.00 179.01 176.88 1gkb s TRP 88 N -6.07 3.11 0.28 4.33 0.52 -1.26 -1.28 118.94 118.57 1gkb s TRP 88 Ca -0.13 -0.05 0.03 0.00 0.02 0.00 0.00 56.10 55.97 1gkb s TRP 88 Cb 0.18 -1.92 -0.04 0.00 -1.15 0.00 0.00 33.47 30.54 1gkb s TRP 88 CO 0.78 0.18 0.20 0.14 0.02 0.00 0.00 176.95 178.26 1gkb s VAL 89 N -0.07 0.08 0.23 4.03 -7.23 -0.49 -4.36 120.40 112.59 1gkb s VAL 89 Ca 0.03 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.30 1gkb s VAL 89 Cb -0.13 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1gkb s VAL 89 CO 0.02 0.00 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.63 1gkb s ARG 90 N -3.79 2.18 0.13 4.82 0.52 -0.47 -0.49 118.95 121.86 1gkb s ARG 90 Ca 0.39 -1.38 0.08 0.00 -0.52 0.00 0.00 55.73 54.30 1gkb s ARG 90 Cb 0.05 -2.14 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 1gkb s ARG 90 CO 0.20 0.39 -0.12 0.14 0.02 0.00 0.00 175.30 175.92 1gkb s VAL 91 N -2.11 3.15 0.28 3.52 -7.23 -1.26 -1.11 120.40 115.65 1gkb s VAL 91 Ca 0.29 -1.45 -0.16 0.00 -1.81 0.00 0.00 61.98 58.85 1gkb s VAL 91 Cb -0.07 -2.49 0.06 0.00 0.56 0.00 0.00 36.38 34.44 1gkb s VAL 91 CO 0.18 0.05 0.80 0.61 -0.31 0.00 0.00 175.10 176.43 1gkb n GLY 92 N 0.55 0.92 3.29 2.32 0.00 -0.38 -1.02 105.19 110.87 1gkb n GLY 92 Ca -0.13 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1gkb n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gkb s LEU 93 N 0.00 2.08 0.08 0.99 1.43 -0.22 -1.23 118.68 121.81 1gkb s LEU 93 Ca 0.17 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1gkb s LEU 93 Cb -0.04 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 1gkb s LEU 93 CO 0.09 0.28 -0.07 -0.55 0.23 0.00 0.00 176.35 176.32 1gkb s SER 94 N -0.75 1.11 0.18 2.29 0.15 0.06 -0.95 113.70 115.78 1gkb s SER 94 Ca 0.10 -0.88 -0.23 0.00 0.70 0.00 0.00 55.95 55.64 1gkb s SER 94 Cb -0.09 0.07 0.06 0.00 -1.71 0.00 0.00 66.02 64.35 1gkb s SER 94 CO -0.00 -0.38 0.65 0.00 1.20 0.00 0.00 173.24 174.71 1gkb s ALA 95 N -2.97 -1.53 0.13 5.45 0.00 -0.57 -0.45 121.76 121.82 1gkb s ALA 95 Ca 0.06 0.34 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 1gkb s ALA 95 Cb 0.01 0.85 0.02 0.00 0.00 0.00 0.00 23.12 23.99 1gkb s ALA 95 CO -0.03 -0.83 0.35 -1.54 0.00 0.00 0.00 175.76 173.71 1gkb s SER 96 N -2.78 -0.11 0.37 0.00 1.04 -1.07 -2.17 113.70 108.98 1gkb s SER 96 Ca 0.04 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.02 1gkb s SER 96 Cb -0.02 0.45 -0.06 0.00 0.10 0.00 0.00 66.02 66.48 1gkb s SER 96 CO -0.08 -0.85 0.05 0.42 0.98 0.00 0.00 173.24 173.76 1gkb s THR 97 N -3.85 1.36 0.00 2.02 -4.23 0.03 -0.67 115.64 110.31 1gkb s THR 97 Ca 0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1gkb s THR 97 Cb 0.02 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 71.10 1gkb s THR 97 CO -0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 1gkb n GLY 98 N -0.82 3.92 0.37 3.99 0.00 -1.26 -1.45 105.19 109.93 1gkb n GLY 98 Ca -0.04 -0.37 0.01 0.00 0.00 0.00 0.00 46.02 45.61 1gkb n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1gkb h LEU 99 N 0.00 1.09-10.10 0.99 5.85 -1.97 0.25 115.31 111.41 1gkb h LEU 99 Ca 0.00 -0.01 -0.50 0.00 0.84 0.00 0.00 57.88 58.21 1gkb h LEU 99 Cb 0.00 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 1gkb h LEU 99 CO 0.00 0.74 -0.41 -0.31 -0.34 0.00 0.00 178.44 178.12 1gkb s TYR 100 N -6.06 2.74 0.30 1.25 2.02 -1.26 -4.89 117.35 111.45 1gkb s TYR 100 Ca -0.13 -0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 56.04 1gkb s TYR 100 Cb 0.19 -2.04 0.00 0.00 -0.40 0.00 0.00 41.96 39.71 1gkb s TYR 100 CO 0.82 -0.00 0.48 -1.59 -1.57 0.00 0.00 175.55 173.68 1gkb s LYS 101 N -4.07 1.74 -0.12 -0.62 0.00 -1.24 -4.43 119.74 111.01 1gkb s LYS 101 Ca 0.45 -1.51 -0.31 0.00 0.00 0.00 0.00 55.97 54.60 1gkb s LYS 101 Cb -0.03 0.46 0.12 0.00 0.00 0.00 0.00 37.83 38.38 1gkb s LYS 101 CO 0.27 -0.72 1.04 -1.83 0.00 0.00 0.00 175.35 174.11 1gkb s GLU 102 N -3.47 0.56 0.45 1.78 -1.05 -1.16 -3.32 118.70 112.48 1gkb s GLU 102 Ca 0.26 -0.12 -0.23 0.00 -0.15 0.00 0.00 54.97 54.73 1gkb s GLU 102 Cb -0.00 0.26 -0.08 0.00 -0.44 0.00 0.00 34.13 33.87 1gkb s GLU 102 CO 0.14 -0.23 1.11 0.95 0.95 0.00 0.00 175.26 178.19 1gkb s THR 103 N -2.32 3.37 -0.56 1.83 -4.23 -0.27 -4.76 115.64 108.69 1gkb s THR 103 Ca 0.05 1.00 0.06 0.00 -1.18 0.00 0.00 61.69 61.62 1gkb s THR 103 Cb -0.01 -3.49 0.22 0.00 1.34 0.00 0.00 72.50 70.56 1gkb s THR 103 CO -0.05 -0.04 0.59 0.59 -0.54 0.00 0.00 174.62 175.17 1gkb n ASN 104 N -0.48 2.19 -4.76 3.99 3.02 -1.26 -3.75 115.26 114.21 1gkb n ASN 104 Ca 0.07 -3.08 -0.36 0.00 -0.03 0.00 0.00 54.58 51.18 1gkb n ASN 104 Cb 0.49 -0.67 -0.07 0.00 -0.61 0.00 0.00 39.78 38.93 1gkb n ASN 104 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1gkb s THR 105 N -1.64 5.32 -0.19 3.41 2.01 -0.93 -1.89 115.64 121.73 1gkb s THR 105 Ca 0.35 0.47 -0.04 0.00 0.31 0.00 0.00 61.69 62.78 1gkb s THR 105 Cb 0.10 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 1gkb s THR 105 CO -0.09 0.45 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.62 1gkb s ILE 106 N 0.11 3.72 -0.08 1.82 -1.09 0.59 -0.55 121.20 125.71 1gkb s ILE 106 Ca 0.16 -0.40 0.21 0.00 -2.23 0.00 0.00 60.65 58.39 1gkb s ILE 106 Cb -0.13 -2.66 -0.28 0.00 -1.58 0.00 0.00 42.46 37.81 1gkb s ILE 106 CO 0.04 0.45 0.51 0.18 -1.23 0.00 0.00 174.94 174.89 1gkb n LEU 107 N 4.13 0.14 -3.53 2.97 4.32 0.44 -1.87 117.00 123.61 1gkb n LEU 107 Ca -0.17 0.06 -0.16 0.00 -0.02 0.00 0.00 56.01 55.71 1gkb n LEU 107 Cb 0.52 0.07 -0.06 0.00 -1.62 0.00 0.00 43.42 42.33 1gkb n LEU 107 CO 0.31 0.05 0.52 -0.94 -1.22 0.00 0.00 177.39 176.11 1gkb s SER 108 N -4.82 -0.59 -0.16 -1.43 1.04 -1.21 -4.50 113.70 102.04 1gkb s SER 108 Ca -0.07 0.62 -0.07 0.00 0.48 0.00 0.00 55.95 56.91 1gkb s SER 108 Cb 0.12 0.48 0.07 0.00 0.10 0.00 0.00 66.02 66.79 1gkb s SER 108 CO 0.88 -0.55 0.37 0.86 0.98 0.00 0.00 173.24 175.78 1gkb s TRP 109 N -1.24 -0.59 0.14 5.02 -0.00 -0.18 -1.40 118.94 120.68 1gkb s TRP 109 Ca -0.08 1.24 0.06 0.00 -0.00 0.00 0.00 56.10 57.32 1gkb s TRP 109 Cb -0.00 0.21 -0.04 0.00 -0.00 0.00 0.00 33.47 33.64 1gkb s TRP 109 CO 0.07 -0.37 -0.14 -1.54 -0.00 0.00 0.00 176.95 174.98 1gkb s SER 110 N 1.83 2.07 -0.12 5.86 1.04 0.65 -0.41 113.70 124.63 1gkb s SER 110 Ca -0.06 -0.87 -0.15 0.00 0.48 0.00 0.00 55.95 55.35 1gkb s SER 110 Cb -0.10 -0.07 0.04 0.00 0.10 0.00 0.00 66.02 65.98 1gkb s SER 110 CO -0.12 -0.17 0.40 0.12 0.98 0.00 0.00 173.24 174.45 1gkb s PHE 111 N -2.41 -0.40 -0.02 5.02 5.36 -0.28 -1.26 117.98 123.99 1gkb s PHE 111 Ca 0.12 0.91 -0.00 0.00 -0.96 0.00 0.00 56.93 57.00 1gkb s PHE 111 Cb -0.03 0.15 0.03 0.00 -0.34 0.00 0.00 43.02 42.83 1gkb s PHE 111 CO 0.03 -0.27 0.03 0.99 -1.46 0.00 0.00 175.22 174.54 1gkb s THR 112 N -0.18 -0.03 0.03 0.12 2.01 -0.65 -1.35 115.64 115.60 1gkb s THR 112 Ca -0.03 0.22 0.06 0.00 0.31 0.00 0.00 61.69 62.24 1gkb s THR 112 Cb -0.03 -0.12 -0.02 0.00 0.01 0.00 0.00 72.50 72.34 1gkb s THR 112 CO 0.02 0.11 -0.16 -0.94 -0.69 0.00 0.00 174.62 172.95 1gkb s SER 113 N 1.20 1.95 -0.01 3.53 1.04 -0.36 -0.79 113.70 120.26 1gkb s SER 113 Ca -0.07 -0.43 -0.02 0.00 0.48 0.00 0.00 55.95 55.90 1gkb s SER 113 Cb -0.13 -0.16 -0.00 0.00 0.10 0.00 0.00 66.02 65.83 1gkb s SER 113 CO -0.03 0.11 0.05 -0.54 0.98 0.00 0.00 173.24 173.81 1gkb s LYS 114 N -0.96 0.20 -0.08 4.02 1.02 -0.58 -1.21 119.74 122.15 1gkb s LYS 114 Ca 0.04 -0.18 -0.01 0.00 0.02 0.00 0.00 55.97 55.85 1gkb s LYS 114 Cb -0.08 0.08 0.03 0.00 -0.52 0.00 0.00 37.83 37.34 1gkb s LYS 114 CO 0.01 -0.04 -0.02 -0.51 -0.92 0.00 0.00 175.35 173.87 1gkb s LEU 115 N -0.59 0.81 -0.22 3.17 1.43 0.02 -1.87 118.68 121.43 1gkb s LEU 115 Ca -0.07 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.82 1gkb s LEU 115 Cb -0.04 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.62 1gkb s LEU 115 CO 0.00 -0.16 0.10 -0.75 0.23 0.00 0.00 176.35 175.77 1gkb s LYS 116 N 1.77 3.89 0.26 1.70 2.20 -0.01 -0.87 119.74 128.67 1gkb s LYS 116 Ca 0.03 -0.37 -0.30 0.00 -0.36 0.00 0.00 55.97 54.97 1gkb s LYS 116 Cb -0.13 -3.36 -0.10 0.00 -1.51 0.00 0.00 37.83 32.73 1gkb s LYS 116 CO -0.05 0.04 1.41 0.45 -0.36 0.00 0.00 175.35 176.84 1gkb s SER 117 N 1.04 6.68 0.29 1.43 0.15 -0.36 -0.03 113.70 122.90 1gkb s SER 117 Ca 0.05 2.66 0.10 0.00 0.70 0.00 0.00 55.95 59.46 1gkb s SER 117 Cb -0.14 -2.63 0.43 0.00 -1.71 0.00 0.00 66.02 61.98 1gkb s SER 117 CO 0.04 -0.67 1.66 -1.13 1.20 0.00 0.00 173.24 174.33 1gkb h ASN 118 N 4.81 0.03 0.66 5.45 -0.73 -0.83 0.12 115.58 125.09 1gkb h ASN 118 Ca -0.46 -0.01 -0.27 0.00 1.87 0.00 0.00 56.30 57.43 1gkb h ASN 118 Cb 1.22 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 39.77 1gkb h ASN 118 CO 0.76 0.58 -1.40 0.77 -0.37 0.00 0.00 177.43 177.77 1gkb h SER 119 N 0.02 0.11 0.00 1.15 4.64 -1.93 -3.40 113.55 114.14 1gkb h SER 119 Ca -0.00 -0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.11 1gkb h SER 119 Cb 0.99 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 1gkb h SER 119 CO 0.07 1.13 -1.47 0.35 -0.87 0.00 0.00 176.83 176.05 1gkb n THR 120 N -3.28 0.18 -1.15 2.95 -2.24 -1.23 -5.01 114.28 104.50 1gkb n THR 120 Ca -0.11 -0.25 -0.05 0.00 -2.27 0.00 0.00 64.05 61.37 1gkb n THR 120 Cb 1.01 -0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 1gkb n THR 120 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1gkb n HIS 121 N -1.97 0.00 -3.25 4.78 8.25 0.41 -5.00 115.22 118.44 1gkb n HIS 121 Ca -0.05 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.16 1gkb n HIS 121 Cb 0.40 -1.85 -0.01 0.00 1.12 0.00 0.00 29.99 29.66 1gkb n HIS 121 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1gkb s GLU 122 N -2.06 3.49 0.05 -0.41 2.02 -1.26 -4.74 118.70 115.79 1gkb s GLU 122 Ca 0.00 -0.25 0.07 0.00 0.02 0.00 0.00 54.97 54.81 1gkb s GLU 122 Cb 0.00 -2.61 -0.03 0.00 0.10 0.00 0.00 34.13 31.58 1gkb s GLU 122 CO 0.00 0.09 -0.17 0.99 0.02 0.00 0.00 175.26 176.19 1gkb s THR 123 N -2.39 2.90 -0.10 3.63 2.01 -1.26 -1.23 115.64 119.21 1gkb s THR 123 Ca 0.41 -1.18 -0.03 0.00 0.31 0.00 0.00 61.69 61.20 1gkb s THR 123 Cb -0.10 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1gkb s THR 123 CO 0.38 0.31 0.04 0.20 -0.69 0.00 0.00 174.62 174.85 1gkb s ASN 124 N -1.54 5.55 0.01 3.53 -0.87 -0.05 -4.96 114.94 116.60 1gkb s ASN 124 Ca 0.15 0.22 -0.05 0.00 -1.57 0.00 0.00 52.86 51.62 1gkb s ASN 124 Cb -0.11 -1.66 -0.00 0.00 -0.02 0.00 0.00 41.25 39.46 1gkb s ASN 124 CO 0.06 0.37 0.09 0.00 -2.57 0.00 0.00 177.10 175.06 1gkb s ALA 125 N -0.84 -0.20 -0.03 0.60 0.00 -1.26 -0.80 121.76 119.22 1gkb s ALA 125 Ca 0.13 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1gkb s ALA 125 Cb -0.12 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1gkb s ALA 125 CO 0.03 -0.19 -0.11 -1.17 0.00 0.00 0.00 175.76 174.31 1gkb s LEU 126 N -1.40 1.81 -0.05 0.00 2.96 -0.35 -5.00 118.68 116.64 1gkb s LEU 126 Ca -0.15 -0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 53.49 1gkb s LEU 126 Cb -0.08 -0.68 0.03 0.00 0.50 0.00 0.00 46.19 45.95 1gkb s LEU 126 CO 0.01 0.09 0.12 -2.28 -1.32 0.00 0.00 176.35 172.97 1gkb s HIS 127 N 0.18 -0.13 0.03 5.38 5.65 -1.26 -1.22 115.29 123.92 1gkb s HIS 127 Ca -0.04 0.38 0.02 0.00 0.25 0.00 0.00 55.06 55.67 1gkb s HIS 127 Cb -0.10 -0.04 -0.02 0.00 -1.18 0.00 0.00 32.58 31.24 1gkb s HIS 127 CO 0.01 -0.12 -0.07 -0.59 -0.65 0.00 0.00 174.74 173.32 1gkb s PHE 128 N 0.69 0.61 -0.06 3.88 -0.12 -0.46 -5.00 117.98 117.52 1gkb s PHE 128 Ca -0.05 -0.43 -0.02 0.00 -0.05 0.00 0.00 56.93 56.37 1gkb s PHE 128 Cb -0.07 -0.37 0.03 0.00 -0.63 0.00 0.00 43.02 41.98 1gkb s PHE 128 CO -0.03 -0.08 0.04 1.41 -0.05 0.00 0.00 175.22 176.51 1gkb s MET 129 N -1.33 0.14 -0.23 1.99 1.75 -1.26 -1.12 119.30 119.24 1gkb s MET 129 Ca -0.08 0.26 -0.06 0.00 -1.25 0.00 0.00 55.69 54.56 1gkb s MET 129 Cb -0.09 -0.75 -0.02 0.00 2.84 0.00 0.00 34.83 36.81 1gkb s MET 129 CO 0.00 -0.35 0.02 -0.06 -0.65 0.00 0.00 175.02 173.99 1gkb s PHE 130 N 2.10 3.04 -0.27 4.11 0.40 0.46 -4.91 117.98 122.91 1gkb s PHE 130 Ca 0.05 -0.56 0.08 0.00 -0.60 0.00 0.00 56.93 55.89 1gkb s PHE 130 Cb -0.12 -2.17 -0.09 0.00 0.51 0.00 0.00 43.02 41.15 1gkb s PHE 130 CO -0.04 -0.38 0.29 0.09 0.70 0.00 0.00 175.22 175.88 1gkb n ASN 131 N 4.72 1.06 -3.87 1.36 3.02 -1.26 -1.01 115.26 119.28 1gkb n ASN 131 Ca -0.17 -0.51 -0.11 0.00 -0.03 0.00 0.00 54.58 53.76 1gkb n ASN 131 Cb 0.51 1.09 -0.11 0.00 -0.61 0.00 0.00 39.78 40.66 1gkb n ASN 131 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gkb s GLN 132 N -1.92 0.33 -0.22 3.52 -2.07 -1.26 -4.73 119.66 113.30 1gkb s GLN 132 Ca 0.01 -0.20 -0.02 0.00 -1.82 0.00 0.00 55.36 53.33 1gkb s GLN 132 Cb 0.06 0.14 0.01 0.00 -1.09 0.00 0.00 33.01 32.12 1gkb s GLN 132 CO 0.32 -0.07 -0.09 -0.06 -1.32 0.00 0.00 175.29 174.07 1gkb s PHE 133 N -0.82 2.94 0.71 9.60 0.40 0.36 -5.02 117.98 126.15 1gkb s PHE 133 Ca -0.09 -1.33 -0.06 0.00 -0.60 0.00 0.00 56.93 54.86 1gkb s PHE 133 Cb -0.05 -2.04 0.08 0.00 0.51 0.00 0.00 43.02 41.52 1gkb s PHE 133 CO 0.01 -0.68 1.01 -1.54 0.70 0.00 0.00 175.22 174.72 1gkb s SER 134 N 1.38 4.65 0.47 1.36 1.04 -1.26 -2.88 113.70 118.46 1gkb s SER 134 Ca 0.04 0.26 0.21 0.00 0.48 0.00 0.00 55.95 56.94 1gkb s SER 134 Cb -0.15 -0.85 1.16 0.00 0.10 0.00 0.00 66.02 66.28 1gkb s SER 134 CO -0.06 -1.68 1.98 0.50 0.98 0.00 0.00 173.24 174.96 1gkb h LYS 135 N -0.60 0.00 -2.99 4.02 3.11 -1.86 -3.24 116.57 115.00 1gkb h LYS 135 Ca -0.43 0.00 -0.62 0.00 -2.81 0.00 0.00 60.65 56.79 1gkb h LYS 135 Cb 1.30 0.00 -0.41 0.00 -1.00 0.00 0.00 32.23 32.12 1gkb h LYS 135 CO 0.54 0.20 -0.69 0.34 -2.81 0.00 0.00 179.45 177.03 1gkb s ASP 136 N -6.51 3.86 -0.94 4.20 2.15 -1.26 -4.82 116.67 113.35 1gkb s ASP 136 Ca -0.03 -3.25 -0.13 0.00 0.43 0.00 0.00 52.55 49.57 1gkb s ASP 136 Cb 0.14 -1.28 0.22 0.00 -0.30 0.00 0.00 42.92 41.70 1gkb s ASP 136 CO 0.64 -0.17 0.95 -1.58 -0.17 0.00 0.00 175.17 174.84 1gkb s GLN 137 N -0.52 3.79 0.43 4.34 2.00 -1.22 -4.89 119.66 123.59 1gkb s GLN 137 Ca 0.23 -2.57 0.30 0.00 -2.00 0.00 0.00 55.36 51.32 1gkb s GLN 137 Cb -0.12 -4.57 1.31 0.00 0.80 0.00 0.00 33.01 30.42 1gkb s GLN 137 CO -0.10 -1.38 1.89 0.87 -0.50 0.00 0.00 175.29 176.08 1gkb h LYS 138 N 7.60 0.00 -0.50 1.67 1.57 -1.95 -2.16 116.57 122.79 1gkb h LYS 138 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1gkb h LYS 138 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1gkb h LYS 138 CO 0.90 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.38 1gkb n ASP 139 N -2.69 2.32 -4.25 0.86 5.75 -1.26 -4.81 116.55 112.46 1gkb n ASP 139 Ca 0.01 -2.15 -0.28 0.00 -0.01 0.00 0.00 54.79 52.36 1gkb n ASP 139 Cb 0.23 -0.35 -0.16 0.00 -1.03 0.00 0.00 41.12 39.81 1gkb n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1gkb s LEU 140 N -1.10 2.05 -0.38 -2.12 1.43 -0.81 -1.06 118.68 116.68 1gkb s LEU 140 Ca 0.24 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.79 1gkb s LEU 140 Cb 0.15 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 45.22 1gkb s LEU 140 CO 0.13 0.27 0.28 -0.63 0.23 0.00 0.00 176.35 176.63 1gkb s ILE 141 N -0.54 5.26 -0.07 -0.59 1.01 0.29 -4.89 121.20 121.67 1gkb s ILE 141 Ca 0.09 -0.45 -0.18 0.00 0.00 0.00 0.00 60.65 60.10 1gkb s ILE 141 Cb -0.09 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.49 1gkb s ILE 141 CO -0.01 -0.19 0.50 -0.76 0.00 0.00 0.00 174.94 174.48 1gkb s LEU 142 N 1.72 4.35 0.06 2.97 1.43 -1.26 -0.80 118.68 127.14 1gkb s LEU 142 Ca 0.06 0.93 0.08 0.00 -1.03 0.00 0.00 54.13 54.17 1gkb s LEU 142 Cb -0.18 -2.74 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 1gkb s LEU 142 CO 0.10 0.08 -0.21 -1.10 0.23 0.00 0.00 176.35 175.46 1gkb s GLN 143 N 0.12 1.31 6.85 1.70 -0.21 0.26 -4.99 119.66 124.70 1gkb s GLN 143 Ca 0.27 -1.01 0.00 0.00 0.02 0.00 0.00 55.36 54.64 1gkb s GLN 143 Cb -0.16 -1.48 0.00 0.00 1.00 0.00 0.00 33.01 32.37 1gkb s GLN 143 CO 0.13 0.37 0.00 0.41 -2.12 0.00 0.00 175.29 174.07 1gkb n GLY 144 N 1.62 2.68 0.35 3.09 0.00 -1.26 -1.77 105.19 109.89 1gkb n GLY 144 Ca -0.18 -0.33 0.11 0.00 0.00 0.00 0.00 46.02 45.62 1gkb n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gkb n ASP 145 N 4.20 1.05 -4.77 1.61 8.00 0.35 -4.94 116.55 122.05 1gkb n ASP 145 Ca 0.00 -1.55 -0.41 0.00 0.71 0.00 0.00 54.79 53.54 1gkb n ASP 145 Cb 0.00 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.03 1gkb n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gkb s ALA 146 N -1.89 3.60 0.04 2.24 0.00 -1.14 -4.39 121.76 120.22 1gkb s ALA 146 Ca 0.33 1.46 -0.01 0.00 0.00 0.00 0.00 51.96 53.74 1gkb s ALA 146 Cb 0.17 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1gkb s ALA 146 CO 0.27 -0.89 -0.03 0.95 0.00 0.00 0.00 175.76 176.05 1gkb s THR 147 N -0.71 0.21 0.20 0.00 -4.23 -0.40 -4.72 115.64 105.97 1gkb s THR 147 Ca 0.55 -1.63 0.09 0.00 -1.18 0.00 0.00 61.69 59.52 1gkb s THR 147 Cb -0.44 -1.27 -0.04 0.00 1.34 0.00 0.00 72.50 72.08 1gkb s THR 147 CO 0.54 -0.90 -0.18 0.42 -0.54 0.00 0.00 174.62 173.96 1gkb s THR 148 N -3.43 1.96 0.00 3.99 -4.23 -1.26 -1.03 115.64 111.64 1gkb s THR 148 Ca 0.03 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1gkb s THR 148 Cb 0.04 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.89 1gkb s THR 148 CO -0.08 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.22 1gkb n GLY 149 N -0.04 2.57 3.64 3.99 0.00 -0.75 -4.19 105.19 110.40 1gkb n GLY 149 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1gkb n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gkb s THR 150 N -2.44 3.81 -1.84 2.61 2.01 -1.25 -1.77 115.64 116.76 1gkb s THR 150 Ca 0.00 0.92 0.00 0.00 0.31 0.00 0.00 61.69 62.92 1gkb s THR 150 Cb 0.00 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.73 1gkb s THR 150 CO 0.00 -0.29 0.00 0.47 -0.69 0.00 0.00 174.62 174.11 1gkb n ASP 151 N 8.02 -4.94 -0.08 3.53 8.00 -1.26 -1.74 116.55 128.09 1gkb n ASP 151 Ca 0.18 0.35 -0.01 0.00 0.71 0.00 0.00 54.79 56.01 1gkb n ASP 151 Cb 0.45 -4.34 -0.00 0.00 -0.02 0.00 0.00 41.12 37.21 1gkb n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gkb n GLY 152 N -0.50 0.49 3.76 0.44 0.00 -0.73 -4.98 105.19 103.66 1gkb n GLY 152 Ca -0.19 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 1gkb n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gkb s ASN 153 N -2.28 4.90 -0.31 1.61 0.01 -0.71 -0.49 114.94 117.68 1gkb s ASN 153 Ca 0.00 -0.62 -0.13 0.00 -0.71 0.00 0.00 52.86 51.39 1gkb s ASN 153 Cb 0.00 -0.89 -0.03 0.00 0.41 0.00 0.00 41.25 40.74 1gkb s ASN 153 CO 0.00 -0.23 0.29 -0.22 -1.51 0.00 0.00 177.10 175.43 1gkb s LEU 154 N -3.85 4.28 -0.49 0.60 2.96 -0.78 -1.82 118.68 119.58 1gkb s LEU 154 Ca 0.37 -0.14 -0.14 0.00 -0.22 0.00 0.00 54.13 54.00 1gkb s LEU 154 Cb -0.05 -2.24 0.10 0.00 0.50 0.00 0.00 46.19 44.50 1gkb s LEU 154 CO 0.23 -0.21 0.40 -1.61 -1.32 0.00 0.00 176.35 173.85 1gkb s GLU 155 N 1.88 2.84 0.32 1.98 0.41 -0.19 -0.30 118.70 125.64 1gkb s GLU 155 Ca 0.10 -1.55 0.02 0.00 -0.41 0.00 0.00 54.97 53.13 1gkb s GLU 155 Cb -0.16 -4.10 0.54 0.00 -1.78 0.00 0.00 34.13 28.62 1gkb s GLU 155 CO 0.11 -1.14 1.86 -0.07 -0.49 0.00 0.00 175.26 175.53 1gkb h LEU 156 N 8.70 0.59 -9.45 1.80 3.38 -1.64 -1.06 115.31 117.63 1gkb h LEU 156 Ca -0.27 -0.11 -0.62 0.00 0.09 0.00 0.00 57.88 56.98 1gkb h LEU 156 Cb 1.10 -0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.56 1gkb h LEU 156 CO 0.91 0.63 -0.68 0.42 0.09 0.00 0.00 178.44 179.81 1gkb s THR 157 N -5.07 2.24 0.09 0.22 -4.23 -1.26 -2.89 115.64 104.75 1gkb s THR 157 Ca -0.08 -2.19 -0.31 0.00 -1.18 0.00 0.00 61.69 57.93 1gkb s THR 157 Cb 0.16 -2.67 -0.08 0.00 1.34 0.00 0.00 72.50 71.25 1gkb s THR 157 CO 0.78 -0.19 1.42 -0.60 -0.54 0.00 0.00 174.62 175.49 1gkb s ARG 158 N -3.62 4.30 -0.04 3.99 6.06 -1.26 -4.80 118.95 123.57 1gkb s ARG 158 Ca 0.33 2.10 0.05 0.00 -2.50 0.00 0.00 55.73 55.70 1gkb s ARG 158 Cb 0.03 -3.33 -0.01 0.00 0.06 0.00 0.00 34.95 31.70 1gkb s ARG 158 CO 0.17 -0.50 -0.20 0.08 -2.50 0.00 0.00 175.30 172.35 1gkb s VAL 159 N 1.45 1.65 0.96 7.11 1.01 -1.26 -1.23 120.40 130.10 1gkb s VAL 159 Ca 0.66 -0.85 -0.15 0.00 0.00 0.00 0.00 61.98 61.64 1gkb s VAL 159 Cb -0.37 -1.40 0.17 0.00 0.00 0.00 0.00 36.38 34.78 1gkb s VAL 159 CO 0.30 0.47 1.20 -0.94 0.00 0.00 0.00 175.10 176.12 1gkb s SER 160 N -0.09 3.11 0.34 3.32 1.04 -0.64 -4.89 113.70 115.90 1gkb s SER 160 Ca -0.02 0.66 0.03 0.00 0.48 0.00 0.00 55.95 57.10 1gkb s SER 160 Cb -0.12 -1.00 0.62 0.00 0.10 0.00 0.00 66.02 65.62 1gkb s SER 160 CO 0.02 -2.77 1.96 0.77 0.98 0.00 0.00 173.24 174.21 1gkb h SER 161 N -1.65 0.67 0.07 7.02 4.64 -2.01 -0.95 113.55 121.33 1gkb h SER 161 Ca -0.47 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1gkb h SER 161 Cb 1.29 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1gkb h SER 161 CO 0.51 0.55 0.00 -0.46 -0.87 0.00 0.00 176.83 176.56 1gkb n ASN 162 N -4.39 0.00 0.00 4.97 0.23 -1.26 -4.87 115.26 109.95 1gkb n ASN 162 Ca 0.05 -0.67 0.00 0.00 -0.53 0.00 0.00 54.58 53.43 1gkb n ASN 162 Cb 0.11 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 37.76 1gkb n ASN 162 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gkb n GLY 163 N 0.59 0.76 3.65 4.83 0.00 -0.36 -5.06 105.19 109.60 1gkb n GLY 163 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1gkb n GLY 163 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gkb s SER 164 N -2.33 6.68 0.49 1.61 0.15 -1.26 -4.72 113.70 114.31 1gkb s SER 164 Ca 0.00 0.83 -0.23 0.00 0.70 0.00 0.00 55.95 57.24 1gkb s SER 164 Cb 0.00 -2.36 -0.07 0.00 -1.71 0.00 0.00 66.02 61.89 1gkb s SER 164 CO 0.00 -0.33 1.30 -2.16 1.20 0.00 0.00 173.24 173.26 1gkb s PRO 165 N 2.18 3.52 0.09 5.44 0.04 -1.26 -1.61 135.00 143.39 1gkb s PRO 165 Ca 0.29 2.12 0.02 0.00 0.04 0.00 0.00 61.00 63.47 1gkb s PRO 165 Cb -0.16 -2.44 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1gkb s PRO 165 CO 0.10 -0.85 0.13 -0.65 0.04 0.00 0.00 177.00 175.77 1gkb s GLN 166 N -2.67 3.06 0.91 4.56 -0.21 -0.36 -4.79 119.66 120.16 1gkb s GLN 166 Ca 0.65 -0.63 -0.14 0.00 0.02 0.00 0.00 55.36 55.26 1gkb s GLN 166 Cb -0.37 -2.82 0.16 0.00 1.00 0.00 0.00 33.01 30.99 1gkb s GLN 166 CO 0.45 0.57 1.27 0.20 -2.12 0.00 0.00 175.29 175.66 1gkb s GLY 167 N -2.54 1.73 -1.52 3.09 0.00 -1.26 -4.38 107.32 102.44 1gkb s GLY 167 Ca 0.31 -1.09 -0.03 0.00 0.00 0.00 0.00 44.72 43.91 1gkb s GLY 167 CO 0.24 -0.41 0.29 1.44 0.00 0.00 0.00 173.10 174.66 1gkb n SER 168 N -3.59 -0.16 -4.30 1.64 7.64 0.08 -4.83 113.62 110.10 1gkb n SER 168 Ca 0.13 -1.13 -0.27 0.00 1.01 0.00 0.00 58.87 58.60 1gkb n SER 168 Cb 0.60 -2.34 -0.14 0.00 -1.01 0.00 0.00 64.21 61.32 1gkb n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1gkb s SER 169 N -4.21 2.82 -0.08 6.43 0.15 -1.16 -4.96 113.70 112.68 1gkb s SER 169 Ca 0.12 -0.58 -0.07 0.00 0.70 0.00 0.00 55.95 56.12 1gkb s SER 169 Cb -0.07 -0.23 0.02 0.00 -1.71 0.00 0.00 66.02 64.03 1gkb s SER 169 CO 0.95 0.19 0.21 0.54 1.20 0.00 0.00 173.24 176.32 1gkb s VAL 170 N -0.86 -0.00 -0.06 4.45 0.11 -1.26 -0.79 120.40 121.99 1gkb s VAL 170 Ca 0.10 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.88 1gkb s VAL 170 Cb -0.09 -0.30 0.06 0.00 -1.53 0.00 0.00 36.38 34.52 1gkb s VAL 170 CO 0.03 0.00 0.61 -0.83 -3.33 0.00 0.00 175.10 171.57 1gkb s GLY 171 N 0.14 -0.49 0.04 6.54 0.00 -0.92 -0.50 107.32 112.14 1gkb s GLY 171 Ca -0.00 1.19 -0.03 0.00 0.00 0.00 0.00 44.72 45.87 1gkb s GLY 171 CO 0.00 0.87 0.03 0.50 0.00 0.00 0.00 173.10 174.49 1gkb s ARG 172 N -1.05 0.55 -0.08 2.90 0.52 -0.73 -1.51 118.95 119.56 1gkb s ARG 172 Ca -0.10 -0.90 0.01 0.00 -0.52 0.00 0.00 55.73 54.21 1gkb s ARG 172 Cb -0.01 0.20 0.02 0.00 0.52 0.00 0.00 34.95 35.68 1gkb s ARG 172 CO 0.08 -0.12 -0.10 0.00 0.02 0.00 0.00 175.30 175.18 1gkb s ALA 173 N -2.91 1.20 0.03 2.13 0.00 -0.12 -0.58 121.76 121.50 1gkb s ALA 173 Ca -0.02 -0.41 0.09 0.00 0.00 0.00 0.00 51.96 51.61 1gkb s ALA 173 Cb 0.01 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 1gkb s ALA 173 CO -0.06 -0.08 -0.25 -0.51 0.00 0.00 0.00 175.76 174.86 1gkb s LEU 174 N 1.04 2.21 0.34 0.00 1.02 0.02 -1.06 118.68 122.24 1gkb s LEU 174 Ca -0.08 -0.53 -0.28 0.00 0.02 0.00 0.00 54.13 53.26 1gkb s LEU 174 Cb -0.15 -1.33 -0.10 0.00 0.02 0.00 0.00 46.19 44.63 1gkb s LEU 174 CO -0.01 0.28 1.25 0.12 0.02 0.00 0.00 176.35 178.01 1gkb s PHE 175 N -0.77 3.12 0.17 0.29 5.36 -0.19 -0.55 117.98 125.42 1gkb s PHE 175 Ca 0.12 1.48 -0.12 0.00 -0.96 0.00 0.00 56.93 57.45 1gkb s PHE 175 Cb -0.10 -3.58 0.08 0.00 -0.34 0.00 0.00 43.02 39.08 1gkb s PHE 175 CO 0.02 -1.59 1.73 -0.92 -1.46 0.00 0.00 175.22 173.00 1gkb h TYR 176 N 3.28 0.92 -3.73 10.12 5.03 -1.44 -3.43 116.97 127.72 1gkb h TYR 176 Ca -0.49 -0.07 -0.50 0.00 2.58 0.00 0.00 58.73 60.25 1gkb h TYR 176 Cb 1.23 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 39.23 1gkb h TYR 176 CO 0.56 0.73 0.43 0.00 -1.32 0.00 0.00 178.16 178.56 1gkb s ALA 177 N -5.55 3.37 0.67 1.82 0.00 -1.26 -5.02 121.76 115.78 1gkb s ALA 177 Ca -0.13 0.77 -0.17 0.00 0.00 0.00 0.00 51.96 52.44 1gkb s ALA 177 Cb 0.13 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1gkb s ALA 177 CO 0.80 -0.04 1.21 -2.14 0.00 0.00 0.00 175.76 175.58 1gkb s PRO 178 N -1.07 2.54 -0.06 0.00 0.02 -1.26 -4.80 135.00 130.37 1gkb s PRO 178 Ca 0.44 1.78 0.05 0.00 0.02 0.00 0.00 61.00 63.30 1gkb s PRO 178 Cb -0.29 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.34 1gkb s PRO 178 CO 0.36 -1.54 -0.21 0.08 -0.33 0.00 0.00 177.00 175.36 1gkb s VAL 179 N -1.82 1.77 -0.64 3.83 1.01 0.36 -4.96 120.40 119.96 1gkb s VAL 179 Ca 0.76 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 1gkb s VAL 179 Cb -0.30 -1.51 0.08 0.00 0.00 0.00 0.00 36.38 34.65 1gkb s VAL 179 CO 0.40 0.50 0.89 -2.28 0.00 0.00 0.00 175.10 174.60 1gkb s HIS 180 N -0.02 2.79 -0.12 5.22 2.46 -1.26 -1.40 115.29 122.96 1gkb s HIS 180 Ca -0.05 -0.70 0.17 0.00 0.47 0.00 0.00 55.06 54.94 1gkb s HIS 180 Cb -0.13 -4.21 -0.13 0.00 -0.13 0.00 0.00 32.58 27.98 1gkb s HIS 180 CO 0.03 -1.53 0.85 0.97 -2.47 0.00 0.00 174.74 172.59 1gkb h ILE 181 N 5.95 0.51 -3.65 0.89 6.09 -1.50 -3.47 117.51 122.33 1gkb h ILE 181 Ca -0.28 -2.00 -0.07 0.00 -1.37 0.00 0.00 64.86 61.14 1gkb h ILE 181 Cb 1.07 2.05 -0.13 0.00 0.47 0.00 0.00 36.82 40.28 1gkb h ILE 181 CO 1.16 0.29 -0.24 -1.66 -3.07 0.00 0.00 178.15 174.62 1gkb s TRP 182 N -2.92 0.05 -0.23 2.19 1.48 -1.23 -4.86 118.94 113.42 1gkb s TRP 182 Ca -0.03 -0.43 -0.15 0.00 -1.06 0.00 0.00 56.10 54.43 1gkb s TRP 182 Cb 0.09 0.07 0.07 0.00 -1.16 0.00 0.00 33.47 32.53 1gkb s TRP 182 CO 0.81 -0.64 0.57 -2.00 -4.06 0.00 0.00 176.95 171.63 1gkb s GLU 183 N -3.86 0.60 0.23 3.25 2.12 -1.26 -4.75 118.70 115.03 1gkb s GLU 183 Ca 0.06 0.96 -0.08 0.00 0.36 0.00 0.00 54.97 56.27 1gkb s GLU 183 Cb 0.03 0.15 0.25 0.00 0.26 0.00 0.00 34.13 34.82 1gkb s GLU 183 CO -0.09 -0.13 1.87 0.77 -0.54 0.00 0.00 175.26 177.14 1gkb h SER 184 N 6.44 0.88 -0.15 -1.70 0.02 -2.02 -2.17 113.55 114.85 1gkb h SER 184 Ca -0.31 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1gkb h SER 184 Cb 1.20 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1gkb h SER 184 CO 0.19 0.60 0.00 -1.54 -1.14 0.00 0.00 176.83 174.95 1gkb n SER 185 N -4.57 1.72 -4.65 3.07 3.41 -1.26 -4.80 113.62 106.53 1gkb n SER 185 Ca 0.10 -2.15 -0.37 0.00 -0.26 0.00 0.00 58.87 56.19 1gkb n SER 185 Cb 0.09 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 1gkb n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gkb s ALA 186 N -1.54 3.59 0.18 7.33 0.00 -0.82 -0.11 121.76 130.39 1gkb s ALA 186 Ca 0.12 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1gkb s ALA 186 Cb 0.09 -2.44 0.04 0.00 0.00 0.00 0.00 23.12 20.81 1gkb s ALA 186 CO 0.05 -0.29 1.41 -0.24 0.00 0.00 0.00 175.76 176.69 1gkb h VAL 187 N 5.08 1.49 -3.24 0.00 3.04 -0.69 -3.45 116.25 118.48 1gkb h VAL 187 Ca -0.37 -2.54 -0.19 0.00 -1.01 0.00 0.00 66.70 62.58 1gkb h VAL 187 Cb 1.17 2.40 -0.28 0.00 -2.01 0.00 0.00 31.29 32.58 1gkb h VAL 187 CO 0.66 0.74 -0.52 -0.69 -1.01 0.00 0.00 177.57 176.75 1gkb s VAL 188 N -3.28 -0.02 0.02 1.51 1.01 -1.22 -4.94 120.40 113.48 1gkb s VAL 188 Ca -0.03 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.99 1gkb s VAL 188 Cb 0.10 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.19 1gkb s VAL 188 CO 0.82 0.02 0.01 0.00 0.00 0.00 0.00 175.10 175.95 1gkb s ALA 189 N 0.48 0.06 0.04 5.51 0.00 -1.26 -0.83 121.76 125.77 1gkb s ALA 189 Ca -0.03 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.14 1gkb s ALA 189 Cb -0.05 0.16 0.05 0.00 0.00 0.00 0.00 23.12 23.29 1gkb s ALA 189 CO -0.02 -0.20 0.51 -1.54 0.00 0.00 0.00 175.76 174.50 1gkb s SER 190 N -1.65 -0.42 0.09 0.00 1.04 -0.78 -0.73 113.70 111.25 1gkb s SER 190 Ca -0.13 0.16 -0.00 0.00 0.48 0.00 0.00 55.95 56.47 1gkb s SER 190 Cb -0.07 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.49 1gkb s SER 190 CO -0.02 -0.70 -0.01 0.72 0.98 0.00 0.00 173.24 174.21 1gkb s PHE 191 N -2.39 0.73 -0.07 5.02 -0.12 -0.45 -1.52 117.98 119.18 1gkb s PHE 191 Ca -0.06 -1.08 -0.09 0.00 -0.05 0.00 0.00 56.93 55.66 1gkb s PHE 191 Cb -0.01 -0.46 0.02 0.00 -0.63 0.00 0.00 43.02 41.94 1gkb s PHE 191 CO -0.01 -0.36 0.22 -2.00 -0.05 0.00 0.00 175.22 173.02 1gkb s GLU 192 N -3.94 0.35 0.03 1.99 2.12 0.03 -2.04 118.70 117.24 1gkb s GLU 192 Ca 0.14 0.15 0.03 0.00 0.36 0.00 0.00 54.97 55.65 1gkb s GLU 192 Cb 0.07 0.16 -0.02 0.00 0.26 0.00 0.00 34.13 34.60 1gkb s GLU 192 CO -0.05 -0.06 -0.10 0.00 -0.54 0.00 0.00 175.26 174.51 1gkb s ALA 193 N -0.27 0.83 0.01 6.30 0.00 0.25 -1.64 121.76 127.24 1gkb s ALA 193 Ca -0.04 -0.71 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 1gkb s ALA 193 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.00 1gkb s ALA 193 CO 0.01 0.11 -0.01 0.99 0.00 0.00 0.00 175.76 176.86 1gkb s THR 194 N -0.93 0.07 0.04 0.00 2.01 -0.39 -0.61 115.64 115.82 1gkb s THR 194 Ca -0.03 -0.56 -0.15 0.00 0.31 0.00 0.00 61.69 61.27 1gkb s THR 194 Cb -0.08 -0.18 0.02 0.00 0.01 0.00 0.00 72.50 72.28 1gkb s THR 194 CO 0.01 -0.31 0.33 0.72 -0.69 0.00 0.00 174.62 174.68 1gkb s PHE 195 N -0.90 -0.15 -0.01 4.92 -0.71 -0.71 -0.25 117.98 120.16 1gkb s PHE 195 Ca -0.10 0.06 0.05 0.00 -1.04 0.00 0.00 56.93 55.90 1gkb s PHE 195 Cb -0.06 0.12 -0.03 0.00 -1.21 0.00 0.00 43.02 41.84 1gkb s PHE 195 CO -0.01 -0.51 -0.15 0.95 -1.34 0.00 0.00 175.22 174.17 1gkb s THR 196 N -2.41 3.02 0.04 -4.49 -4.23 -0.49 -1.13 115.64 105.94 1gkb s THR 196 Ca -0.06 -0.90 -0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1gkb s THR 196 Cb -0.01 -2.23 -0.03 0.00 1.34 0.00 0.00 72.50 71.57 1gkb s THR 196 CO -0.02 0.48 -0.03 0.72 -0.54 0.00 0.00 174.62 175.22 1gkb s PHE 197 N -0.83 0.40 -0.21 3.99 -0.12 0.10 -0.42 117.98 120.90 1gkb s PHE 197 Ca 0.13 -0.75 -0.03 0.00 -0.05 0.00 0.00 56.93 56.24 1gkb s PHE 197 Cb -0.11 -0.29 0.06 0.00 -0.63 0.00 0.00 43.02 42.06 1gkb s PHE 197 CO 0.03 -0.26 0.04 -1.17 -0.05 0.00 0.00 175.22 173.81 1gkb s LEU 198 N -2.09 1.28 -0.34 -1.99 0.20 0.28 -1.06 118.68 114.96 1gkb s LEU 198 Ca -0.06 -0.90 -0.10 0.00 0.69 0.00 0.00 54.13 53.77 1gkb s LEU 198 Cb -0.03 -0.62 0.01 0.00 -0.43 0.00 0.00 46.19 45.12 1gkb s LEU 198 CO -0.05 -0.31 0.17 -0.63 -0.29 0.00 0.00 176.35 175.24 1gkb s ILE 199 N 1.83 4.50 -0.09 6.68 1.01 -1.26 -2.20 121.20 131.67 1gkb s ILE 199 Ca -0.00 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1gkb s ILE 199 Cb -0.17 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 1gkb s ILE 199 CO -0.10 -0.08 -0.08 -0.54 0.00 0.00 0.00 174.94 174.15 1gkb s LYS 200 N 1.57 2.99 -0.38 2.79 1.02 -1.25 -0.47 119.74 126.02 1gkb s LYS 200 Ca 0.03 -0.57 0.01 0.00 0.02 0.00 0.00 55.97 55.46 1gkb s LYS 200 Cb -0.18 -2.64 0.11 0.00 -0.52 0.00 0.00 37.83 34.61 1gkb s LYS 200 CO 0.06 0.52 0.15 0.45 -0.92 0.00 0.00 175.35 175.61 1gkb s SER 201 N -0.42 4.05 0.36 2.83 0.15 -1.26 -1.11 113.70 118.30 1gkb s SER 201 Ca 0.06 -2.17 0.27 0.00 0.70 0.00 0.00 55.95 54.80 1gkb s SER 201 Cb -0.12 -1.12 1.23 0.00 -1.71 0.00 0.00 66.02 64.30 1gkb s SER 201 CO 0.02 -0.34 1.81 1.55 1.20 0.00 0.00 173.24 177.47 1gkb h PRO 202 N 7.42 0.00 -0.28 5.44 0.13 -1.97 -2.19 132.00 140.54 1gkb h PRO 202 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 1gkb h PRO 202 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1gkb h PRO 202 CO 0.50 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.87 1gkb n ASP 203 N -2.47 2.73 -0.93 1.44 5.68 -1.26 -4.98 116.55 116.77 1gkb n ASP 203 Ca 0.00 -1.89 -0.12 0.00 -0.50 0.00 0.00 54.79 52.28 1gkb n ASP 203 Cb 0.18 -0.19 -0.05 0.00 -1.14 0.00 0.00 41.12 39.92 1gkb n ASP 203 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1gkb n SER 204 N 0.54 -5.10 -3.49 -1.12 3.41 -0.83 -4.95 113.62 102.09 1gkb n SER 204 Ca 0.11 0.30 -0.27 0.00 -0.26 0.00 0.00 58.87 58.75 1gkb n SER 204 Cb 0.40 -3.66 -0.10 0.00 -0.26 0.00 0.00 64.21 60.58 1gkb n SER 204 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1gkb n HIS 205 N -2.44 0.06 -2.57 7.33 -0.00 -1.26 -5.09 115.22 111.26 1gkb n HIS 205 Ca -0.12 -3.55 -0.31 0.00 -0.00 0.00 0.00 57.72 53.75 1gkb n HIS 205 Cb 0.50 0.03 -0.02 0.00 -0.00 0.00 0.00 29.99 30.50 1gkb n HIS 205 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1gkb s PRO 206 N -0.38 3.78 0.15 1.57 0.04 -1.26 -4.19 135.00 134.71 1gkb s PRO 206 Ca 0.32 0.63 -0.21 0.00 0.04 0.00 0.00 61.00 61.77 1gkb s PRO 206 Cb 0.03 -2.27 0.06 0.00 0.04 0.00 0.00 34.50 32.36 1gkb s PRO 206 CO -0.19 -0.19 0.55 0.00 0.04 0.00 0.00 177.00 177.21 1gkb s ALA 207 N -2.59 -1.43 -0.02 8.56 0.00 -1.21 -4.36 121.76 120.70 1gkb s ALA 207 Ca 0.54 0.37 0.07 0.00 0.00 0.00 0.00 51.96 52.94 1gkb s ALA 207 Cb -0.10 0.83 -0.11 0.00 0.00 0.00 0.00 23.12 23.73 1gkb s ALA 207 CO 0.36 -0.73 0.14 -0.25 0.00 0.00 0.00 175.76 175.27 1gkb n ASP 208 N -0.32 3.29 0.00 0.00 8.00 0.16 -2.99 116.55 124.68 1gkb n ASP 208 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1gkb n ASP 208 Cb 0.65 1.20 0.00 0.00 -0.02 0.00 0.00 41.12 42.95 1gkb n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gkb n GLY 209 N 2.18 2.10 3.26 0.44 0.00 -1.22 -2.41 105.19 109.55 1gkb n GLY 209 Ca -0.03 -1.77 -0.26 0.00 0.00 0.00 0.00 46.02 43.96 1gkb n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gkb s ILE 210 N -1.60 1.72 0.03 -0.61 1.01 -0.81 -2.61 121.20 118.33 1gkb s ILE 210 Ca 0.00 -1.26 0.01 0.00 0.00 0.00 0.00 60.65 59.40 1gkb s ILE 210 Cb 0.00 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 1gkb s ILE 210 CO 0.00 0.19 -0.06 0.00 0.00 0.00 0.00 174.94 175.07 1gkb s ALA 211 N -0.84 0.40 -0.11 9.38 0.00 0.40 -0.10 121.76 130.89 1gkb s ALA 211 Ca 0.08 -0.71 -0.13 0.00 0.00 0.00 0.00 51.96 51.20 1gkb s ALA 211 Cb -0.09 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 1gkb s ALA 211 CO 0.02 -0.08 0.29 0.12 0.00 0.00 0.00 175.76 176.11 1gkb s PHE 212 N -1.49 3.55 0.06 0.00 5.36 -0.66 -0.76 117.98 124.05 1gkb s PHE 212 Ca -0.12 0.68 -0.01 0.00 -0.96 0.00 0.00 56.93 56.53 1gkb s PHE 212 Cb -0.09 -2.25 -0.04 0.00 -0.34 0.00 0.00 43.02 40.30 1gkb s PHE 212 CO -0.00 0.44 -0.04 -0.59 -1.46 0.00 0.00 175.22 173.57 1gkb s PHE 213 N -0.21 0.56 -0.10 10.12 -0.71 -0.36 -0.79 117.98 126.49 1gkb s PHE 213 Ca 0.18 -1.01 0.02 0.00 -1.04 0.00 0.00 56.93 55.07 1gkb s PHE 213 Cb -0.14 -0.40 0.02 0.00 -1.21 0.00 0.00 43.02 41.29 1gkb s PHE 213 CO 0.06 -0.33 -0.13 0.42 -1.34 0.00 0.00 175.22 173.89 1gkb s ILE 214 N -3.73 1.34 0.25 -4.49 1.01 0.65 -1.25 121.20 114.98 1gkb s ILE 214 Ca 0.06 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1gkb s ILE 214 Cb 0.07 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1gkb s ILE 214 CO -0.09 0.41 0.14 -0.94 0.00 0.00 0.00 174.94 174.46 1gkb s SER 215 N 0.98 0.86 0.66 3.58 1.04 -0.27 -1.48 113.70 119.07 1gkb s SER 215 Ca -0.07 -1.46 -0.17 0.00 0.48 0.00 0.00 55.95 54.73 1gkb s SER 215 Cb -0.15 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.28 1gkb s SER 215 CO -0.01 -0.84 0.85 -0.46 0.98 0.00 0.00 173.24 173.76 1gkb n ASN 216 N -0.58 0.15 0.03 7.02 6.94 -1.18 -1.36 115.26 126.29 1gkb n ASN 216 Ca 0.02 0.71 0.09 0.00 -0.02 0.00 0.00 54.58 55.38 1gkb n ASN 216 Cb 0.65 -1.35 0.53 0.00 -2.36 0.00 0.00 39.78 37.26 1gkb n ASN 216 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 1gkb h ILE 217 N 0.04 0.98 -0.85 1.53 2.04 -1.85 -2.38 117.51 117.02 1gkb h ILE 217 Ca -0.47 -0.11 -0.35 0.00 1.00 0.00 0.00 64.86 64.93 1gkb h ILE 217 Cb 1.36 0.62 -0.21 0.00 -0.74 0.00 0.00 36.82 37.85 1gkb h ILE 217 CO 0.48 0.06 0.43 -0.90 0.00 0.00 0.00 178.15 178.22 1gkb n ASP 218 N -4.48 4.36 -4.74 1.72 5.75 -1.26 -4.74 116.55 113.15 1gkb n ASP 218 Ca 0.05 -3.40 -0.41 0.00 -0.01 0.00 0.00 54.79 51.01 1gkb n ASP 218 Cb 0.22 -0.79 -0.03 0.00 -1.03 0.00 0.00 41.12 39.50 1gkb n ASP 218 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1gkb s SER 219 N -1.17 6.85 0.30 -1.12 0.15 -0.90 -5.04 113.70 112.77 1gkb s SER 219 Ca 0.56 2.47 0.10 0.00 0.70 0.00 0.00 55.95 59.78 1gkb s SER 219 Cb 0.46 -2.62 -0.05 0.00 -1.71 0.00 0.00 66.02 62.10 1gkb s SER 219 CO 0.12 -0.55 -0.06 -0.44 1.20 0.00 0.00 173.24 173.51 1gkb s SER 220 N 0.26 4.10 0.05 5.45 0.01 -1.26 -5.09 113.70 117.22 1gkb s SER 220 Ca 0.56 -0.89 -0.33 0.00 1.31 0.00 0.00 55.95 56.60 1gkb s SER 220 Cb -0.38 -0.56 -0.12 0.00 0.21 0.00 0.00 66.02 65.18 1gkb s SER 220 CO 0.40 -0.07 1.78 -0.38 0.41 0.00 0.00 173.24 175.39 1gkb n ILE 221 N -0.82 0.36 -2.15 1.44 5.41 -1.26 -4.92 119.36 117.41 1gkb n ILE 221 Ca -0.05 -0.06 -0.37 0.00 1.00 0.00 0.00 62.75 63.27 1gkb n ILE 221 Cb 0.60 -1.86 0.01 0.00 -0.71 0.00 0.00 39.64 37.68 1gkb n ILE 221 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1gkb s PRO 222 N 2.79 3.47 0.28 0.38 0.02 -1.26 -4.96 135.00 135.71 1gkb s PRO 222 Ca 0.85 1.82 -0.30 0.00 0.02 0.00 0.00 61.00 63.39 1gkb s PRO 222 Cb -0.62 -2.23 -0.10 0.00 0.02 0.00 0.00 34.50 31.57 1gkb s PRO 222 CO 0.43 -0.80 1.47 -1.12 -0.33 0.00 0.00 177.00 176.65 1gkb s SER 223 N -1.42 6.57 0.00 2.53 0.01 -1.26 -2.78 113.70 117.35 1gkb s SER 223 Ca 0.69 2.77 0.00 0.00 1.31 0.00 0.00 55.95 60.72 1gkb s SER 223 Cb -0.30 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.30 1gkb s SER 223 CO 0.35 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.85 1gkb n GLY 224 N 1.95 0.59 1.08 3.44 0.00 -1.26 -4.58 105.19 106.42 1gkb n GLY 224 Ca 0.06 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.94 1gkb n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gkb n SER 225 N 0.45 3.20 -4.08 1.61 3.41 -1.12 -4.81 113.62 112.28 1gkb n SER 225 Ca 0.00 -1.96 -0.29 0.00 -0.26 0.00 0.00 58.87 56.36 1gkb n SER 225 Cb 0.00 -0.30 0.24 0.00 -0.26 0.00 0.00 64.21 63.88 1gkb n SER 225 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1gkb s THR 226 N -1.39 1.70 0.00 6.66 -4.23 -1.26 -1.21 115.64 115.90 1gkb s THR 226 Ca 0.39 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.90 1gkb s THR 226 Cb 0.22 -2.34 0.00 0.00 1.34 0.00 0.00 72.50 71.72 1gkb s THR 226 CO 0.30 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 1gkb n GLY 227 N -0.27 3.02 0.05 3.99 0.00 -0.53 -3.25 105.19 108.21 1gkb n GLY 227 Ca 0.09 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1gkb n GLY 227 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1gkb n ARG 228 N 13.66 0.07 0.00 1.61 1.85 -1.26 -1.51 116.66 131.08 1gkb n ARG 228 Ca 0.00 0.37 0.13 0.00 -1.00 0.00 0.00 57.85 57.35 1gkb n ARG 228 Cb 0.00 -1.65 0.44 0.00 -1.05 0.00 0.00 32.46 30.21 1gkb n ARG 228 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1gkb n LEU 229 N -1.78 1.33 -1.15 2.89 4.77 -1.20 -4.94 117.00 116.92 1gkb n LEU 229 Ca 0.02 -0.41 -0.15 0.00 -0.03 0.00 0.00 56.01 55.44 1gkb n LEU 229 Cb 0.15 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1gkb n LEU 229 CO 0.13 0.23 -0.14 0.18 -1.33 0.00 0.00 177.39 176.46 1gkb n LEU 230 N -0.16 -0.97 -0.06 2.23 4.77 -0.57 -1.19 117.00 121.06 1gkb n LEU 230 Ca 0.16 0.37 -0.01 0.00 -0.03 0.00 0.00 56.01 56.50 1gkb n LEU 230 Cb 0.36 -2.44 -0.00 0.00 -2.33 0.00 0.00 43.42 39.01 1gkb n LEU 230 CO 0.21 -0.90 -0.01 0.61 -1.33 0.00 0.00 177.39 175.96 1gkb n GLY 231 N -0.66 0.40 0.05 -0.72 0.00 -0.35 -4.07 105.19 99.85 1gkb n GLY 231 Ca -0.15 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.72 1gkb n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gkb n LEU 232 N -0.08 1.01 -4.12 0.99 4.32 -0.33 -4.36 117.00 114.42 1gkb n LEU 232 Ca -0.01 -0.02 -0.18 0.00 -0.02 0.00 0.00 56.01 55.78 1gkb n LEU 232 Cb 0.17 0.01 -0.13 0.00 -1.62 0.00 0.00 43.42 41.85 1gkb n LEU 232 CO 0.01 0.40 -0.44 -0.36 -1.22 0.00 0.00 177.39 175.78 1gkb s PHE 233 N -2.25 1.04 -0.94 -1.77 0.08 -1.19 -4.80 117.98 108.17 1gkb s PHE 233 Ca -0.09 -0.39 0.28 0.00 0.12 0.00 0.00 56.93 56.85 1gkb s PHE 233 Cb 0.03 -0.61 1.12 0.00 -0.57 0.00 0.00 43.02 42.99 1gkb s PHE 233 CO 0.37 0.01 1.88 -0.35 -0.10 0.00 0.00 175.22 177.03 1gkb n PRO 234 N 1.73 0.06 -3.82 0.24 -0.04 -1.26 -4.29 135.00 127.62 1gkb n PRO 234 Ca -0.19 0.05 -0.08 0.00 -0.04 0.00 0.00 63.50 63.24 1gkb n PRO 234 Cb 0.55 -1.57 0.02 0.00 -0.04 0.00 0.00 33.50 32.46 1gkb n PRO 234 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1gkb s ASP 235 N -3.36 -0.02 -0.12 3.54 1.47 -1.26 -4.77 116.67 112.15 1gkb s ASP 235 Ca 0.13 -1.03 0.12 0.00 1.18 0.00 0.00 52.55 52.95 1gkb s ASP 235 Cb 0.17 0.79 0.55 0.00 -0.34 0.00 0.00 42.92 44.10 1gkb s ASP 235 CO 0.55 -1.57 1.39 0.00 0.68 0.00 0.00 175.17 176.23 1gkb n ALA 236 N -0.54 3.18 0.38 2.11 0.00 -1.26 -4.69 120.51 119.69 1gkb n ALA 236 Ca -0.07 -1.24 0.03 0.00 0.00 0.00 0.00 53.44 52.16 1gkb n ALA 236 Cb 0.60 -1.05 0.18 0.00 0.00 0.00 0.00 19.45 19.18 1gkb n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59