#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ngf s GLY 4 N 0.00 -0.19 0.46 2.58 0.00 -1.26 -5.02 107.32 103.89 1ngf s GLY 4 Ca 0.00 0.63 -0.23 0.00 0.00 0.00 0.00 44.72 45.12 1ngf s GLY 4 CO 0.00 0.48 1.20 -4.14 0.00 0.00 0.00 173.10 170.64 1ngf s PRO 5 N -0.41 3.72 0.08 2.90 0.02 -1.26 -4.87 135.00 135.17 1ngf s PRO 5 Ca -0.05 1.86 -0.21 0.00 0.02 0.00 0.00 61.00 62.62 1ngf s PRO 5 Cb -0.04 -2.43 -0.07 0.00 0.02 0.00 0.00 34.50 31.99 1ngf s PRO 5 CO 0.02 -0.61 0.62 0.00 -0.33 0.00 0.00 177.00 176.70 1ngf s ALA 6 N -1.49 3.54 0.28 -1.55 0.00 -1.26 -4.51 121.76 116.78 1ngf s ALA 6 Ca 0.64 0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.78 1ngf s ALA 6 Cb -0.31 -2.73 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1ngf s ALA 6 CO 0.37 0.33 0.22 0.14 0.00 0.00 0.00 175.76 176.82 1ngf s VAL 7 N -0.92 4.04 -0.19 0.00 -7.23 -0.39 -4.59 120.40 111.12 1ngf s VAL 7 Ca 0.31 -1.42 -0.04 0.00 -1.81 0.00 0.00 61.98 59.03 1ngf s VAL 7 Cb -0.20 -3.29 -0.02 0.00 0.56 0.00 0.00 36.38 33.43 1ngf s VAL 7 CO 0.20 -0.28 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.84 1ngf s GLY 8 N -3.89 1.65 -0.12 2.32 0.00 -0.20 -0.97 107.32 106.10 1ngf s GLY 8 Ca 0.36 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 44.10 1ngf s GLY 8 CO 0.25 0.18 -0.19 -0.42 0.00 0.00 0.00 173.10 172.92 1ngf s ILE 9 N 0.94 1.77 -0.40 0.90 1.01 0.32 -1.10 121.20 124.63 1ngf s ILE 9 Ca -0.00 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 1ngf s ILE 9 Cb -0.15 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.76 1ngf s ILE 9 CO 0.01 0.49 0.39 -0.62 0.00 0.00 0.00 174.94 175.21 1ngf s ASP 10 N 0.83 6.17 -0.86 3.58 2.15 0.01 -2.15 116.67 126.40 1ngf s ASP 10 Ca -0.09 -0.64 -0.13 0.00 0.43 0.00 0.00 52.55 52.12 1ngf s ASP 10 Cb -0.16 -2.20 0.23 0.00 -0.30 0.00 0.00 42.92 40.49 1ngf s ASP 10 CO -0.00 -0.51 0.81 -0.22 -0.17 0.00 0.00 175.17 175.08 1ngf s LEU 11 N 2.01 6.71 0.60 -1.34 2.96 -1.26 -1.32 118.68 127.04 1ngf s LEU 11 Ca 0.10 -2.81 -0.03 0.00 -0.22 0.00 0.00 54.13 51.18 1ngf s LEU 11 Cb -0.17 -2.21 0.04 0.00 0.50 0.00 0.00 46.19 44.35 1ngf s LEU 11 CO 0.12 -0.53 0.87 -0.83 -1.32 0.00 0.00 176.35 174.66 1ngf s GLY 12 N 2.04 1.73 0.24 7.98 0.00 -0.94 -4.95 107.32 113.42 1ngf s GLY 12 Ca 0.19 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 43.81 1ngf s GLY 12 CO -0.09 -0.76 1.70 -0.84 0.00 0.00 0.00 173.10 173.12 1ngf h THR 13 N -0.18 1.26 0.00 0.90 2.02 -1.98 -3.37 112.91 111.55 1ngf h THR 13 Ca -0.44 -1.17 -0.17 0.00 0.77 0.00 0.00 66.41 65.41 1ngf h THR 13 Cb 1.30 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 1ngf h THR 13 CO 0.57 0.40 -1.62 0.35 0.37 0.00 0.00 175.52 175.58 1ngf n THR 14 N -4.16 0.62 -4.14 3.16 -2.24 -1.26 -4.13 114.28 102.13 1ngf n THR 14 Ca 0.01 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.41 1ngf n THR 14 Cb 0.37 -0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 67.51 1ngf n THR 14 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1ngf s TYR 15 N -2.22 0.79 0.32 4.78 1.51 -1.26 -0.79 117.35 120.48 1ngf s TYR 15 Ca -0.15 -0.39 0.10 0.00 -1.01 0.00 0.00 57.07 55.62 1ngf s TYR 15 Cb 0.04 -0.47 -0.06 0.00 -0.11 0.00 0.00 41.96 41.36 1ngf s TYR 15 CO 0.24 -0.03 -0.13 -1.12 -1.11 0.00 0.00 175.55 173.40 1ngf s SER 16 N -1.25 3.71 -0.09 2.29 0.01 0.16 -2.22 113.70 116.32 1ngf s SER 16 Ca -0.05 -1.12 -0.16 0.00 1.31 0.00 0.00 55.95 55.93 1ngf s SER 16 Cb -0.08 -0.35 0.04 0.00 0.21 0.00 0.00 66.02 65.84 1ngf s SER 16 CO 0.01 -0.11 0.39 0.00 0.41 0.00 0.00 173.24 173.94 1ngf s VAL 18 N -0.55 1.57 0.13 0.00 1.01 -1.26 -0.81 120.40 120.49 1ngf s VAL 18 Ca -0.07 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.19 1ngf s VAL 18 Cb -0.04 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1ngf s VAL 18 CO 0.03 0.45 -0.11 -0.83 0.00 0.00 0.00 175.10 174.64 1ngf s GLY 19 N 0.17 1.03 -0.04 4.51 0.00 -0.26 -1.17 107.32 111.55 1ngf s GLY 19 Ca -0.08 -1.41 -0.03 0.00 0.00 0.00 0.00 44.72 43.19 1ngf s GLY 19 CO 0.04 -1.51 0.10 0.54 0.00 0.00 0.00 173.10 172.28 1ngf s VAL 20 N -3.03 -0.01 -0.24 1.40 0.11 0.60 -1.04 120.40 118.19 1ngf s VAL 20 Ca 0.14 0.03 -0.16 0.00 -2.93 0.00 0.00 61.98 59.06 1ngf s VAL 20 Cb 0.01 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 1ngf s VAL 20 CO 0.01 0.01 0.41 0.12 -3.33 0.00 0.00 175.10 172.32 1ngf s PHE 21 N 0.24 3.30 -0.07 1.54 2.19 -1.26 0.20 117.98 124.13 1ngf s PHE 21 Ca -0.02 0.53 -0.04 0.00 0.33 0.00 0.00 56.93 57.74 1ngf s PHE 21 Cb -0.03 -2.58 0.03 0.00 -1.31 0.00 0.00 43.02 39.13 1ngf s PHE 21 CO -0.01 -0.16 0.16 -0.65 1.83 0.00 0.00 175.22 176.39 1ngf s GLN 22 N 1.83 0.12 -1.35 10.12 -0.21 0.91 -4.91 119.66 126.17 1ngf s GLN 22 Ca 0.18 0.35 -0.00 0.00 0.02 0.00 0.00 55.36 55.90 1ngf s GLN 22 Cb -0.15 -0.11 0.00 0.00 1.00 0.00 0.00 33.01 33.75 1ngf s GLN 22 CO 0.09 -0.13 0.58 0.72 -2.12 0.00 0.00 175.29 174.43 1ngf n HIS 23 N 3.93 -1.80 -0.70 0.91 8.25 -1.26 -1.42 115.22 123.12 1ngf n HIS 23 Ca -0.23 0.80 0.00 0.00 -0.26 0.00 0.00 57.72 58.03 1ngf n HIS 23 Cb 0.53 -4.11 0.00 0.00 1.12 0.00 0.00 29.99 27.53 1ngf n HIS 23 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ngf n GLY 24 N -1.75 0.61 3.37 -1.41 0.00 -1.26 -4.98 105.19 99.78 1ngf n GLY 24 Ca -0.30 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 1ngf n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ngf s LYS 25 N -0.43 1.38 -0.23 1.61 1.02 -0.51 -5.12 119.74 117.46 1ngf s LYS 25 Ca 0.00 -1.47 -0.08 0.00 0.02 0.00 0.00 55.97 54.44 1ngf s LYS 25 Cb 0.00 -1.53 -0.04 0.00 -0.52 0.00 0.00 37.83 35.74 1ngf s LYS 25 CO 0.00 0.32 0.08 0.08 -0.92 0.00 0.00 175.35 174.91 1ngf s VAL 26 N -1.94 4.62 -0.26 3.17 1.01 -1.26 -0.06 120.40 125.68 1ngf s VAL 26 Ca 0.18 -0.08 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 1ngf s VAL 26 Cb -0.06 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 1ngf s VAL 26 CO 0.08 0.38 0.22 -1.61 0.00 0.00 0.00 175.10 174.17 1ngf s GLU 27 N 1.13 4.03 -0.37 2.72 0.41 0.13 -4.91 118.70 121.85 1ngf s GLU 27 Ca 0.05 -0.21 -0.16 0.00 -0.41 0.00 0.00 54.97 54.24 1ngf s GLU 27 Cb -0.14 -3.60 0.00 0.00 -1.78 0.00 0.00 34.13 28.61 1ngf s GLU 27 CO 0.04 -0.08 0.41 0.42 -0.49 0.00 0.00 175.26 175.55 1ngf s ILE 28 N 1.47 5.12 -0.10 -1.63 -1.09 -1.26 -0.29 121.20 123.42 1ngf s ILE 28 Ca 0.09 -0.05 -0.30 0.00 -2.23 0.00 0.00 60.65 58.17 1ngf s ILE 28 Cb -0.15 -3.91 -0.02 0.00 -1.58 0.00 0.00 42.46 36.79 1ngf s ILE 28 CO 0.08 -0.22 1.20 -0.63 -1.23 0.00 0.00 174.94 174.14 1ngf s ILE 29 N 2.11 4.32 0.38 2.92 1.01 -0.32 -5.00 121.20 126.61 1ngf s ILE 29 Ca 0.13 1.62 -0.20 0.00 0.00 0.00 0.00 60.65 62.20 1ngf s ILE 29 Cb -0.17 -4.05 -0.10 0.00 0.01 0.00 0.00 42.46 38.16 1ngf s ILE 29 CO 0.13 -0.05 0.88 0.00 0.00 0.00 0.00 174.94 175.90 1ngf s ALA 30 N 2.64 3.15 0.70 9.38 0.00 -1.26 -4.64 121.76 131.73 1ngf s ALA 30 Ca 0.54 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1ngf s ALA 30 Cb -0.23 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1ngf s ALA 30 CO 0.19 0.20 0.00 0.27 0.00 0.00 0.00 175.76 176.41 1ngf n ASN 31 N -0.35 0.00 -0.30 0.00 0.23 0.37 -4.84 115.26 110.37 1ngf n ASN 31 Ca 0.05 -0.93 0.05 0.00 -0.53 0.00 0.00 54.58 53.21 1ngf n ASN 31 Cb 0.53 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.43 1ngf n ASN 31 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ngf h ASP 32 N 0.00 0.65 -0.00 0.53 3.32 -1.98 0.14 116.42 119.08 1ngf h ASP 32 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1ngf h ASP 32 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1ngf h ASP 32 CO 0.00 0.34 0.00 0.00 -1.72 0.00 0.00 179.24 177.86 1ngf n GLN 33 N -4.77 1.12 -1.01 3.56 1.13 -1.26 -4.88 117.38 111.27 1ngf n GLN 33 Ca 0.15 -0.18 -0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1ngf n GLN 33 Cb 0.34 -1.49 -0.00 0.00 0.11 0.00 0.00 30.24 29.20 1ngf n GLN 33 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ngf n GLY 34 N 1.03 0.42 3.81 1.08 0.00 0.48 -5.03 105.19 106.98 1ngf n GLY 34 Ca 0.23 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 1ngf n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ngf s ASN 35 N -2.78 6.95 0.09 1.61 0.01 -1.26 -4.70 114.94 114.85 1ngf s ASN 35 Ca 0.00 1.12 0.28 0.00 -0.71 0.00 0.00 52.86 53.55 1ngf s ASN 35 Cb 0.00 -2.32 1.06 0.00 0.41 0.00 0.00 41.25 40.41 1ngf s ASN 35 CO 0.00 0.27 1.87 0.54 -1.51 0.00 0.00 177.10 178.27 1ngf n ARG 36 N 1.91 0.11 -4.08 -0.60 1.74 -1.26 -0.48 116.66 114.00 1ngf n ARG 36 Ca -0.11 0.09 -0.14 0.00 -0.77 0.00 0.00 57.85 56.92 1ngf n ARG 36 Cb 0.51 -1.63 -0.12 0.00 -1.02 0.00 0.00 32.46 30.21 1ngf n ARG 36 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ngf s THR 37 N -3.04 0.60 -0.04 0.55 -4.23 -1.26 -4.59 115.64 103.64 1ngf s THR 37 Ca 0.13 -1.07 0.03 0.00 -1.18 0.00 0.00 61.69 59.60 1ngf s THR 37 Cb 0.16 -0.65 0.00 0.00 1.34 0.00 0.00 72.50 73.35 1ngf s THR 37 CO 0.56 -0.34 -0.13 0.42 -0.54 0.00 0.00 174.62 174.58 1ngf s THR 38 N -1.31 1.13 0.39 3.99 -4.23 -0.30 -4.93 115.64 110.38 1ngf s THR 38 Ca -0.09 -0.55 -0.25 0.00 -1.18 0.00 0.00 61.69 59.62 1ngf s THR 38 Cb -0.10 -0.98 -0.11 0.00 1.34 0.00 0.00 72.50 72.65 1ngf s THR 38 CO 0.01 0.34 1.04 -2.65 -0.54 0.00 0.00 174.62 172.81 1ngf n PRO 39 N 3.24 1.45 -1.43 3.99 -0.02 -1.26 -0.67 135.00 140.30 1ngf n PRO 39 Ca -0.18 0.51 -0.26 0.00 -2.02 0.00 0.00 63.50 61.55 1ngf n PRO 39 Cb 0.53 -2.04 -0.08 0.00 -0.02 0.00 0.00 33.50 31.90 1ngf n PRO 39 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ngf n SER 40 N 0.68 6.57 -4.63 2.55 7.64 0.03 -4.08 113.62 122.38 1ngf n SER 40 Ca 0.09 -2.96 -0.32 0.00 1.01 0.00 0.00 58.87 56.69 1ngf n SER 40 Cb 0.37 -1.33 -0.10 0.00 -1.01 0.00 0.00 64.21 62.15 1ngf n SER 40 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1ngf s TYR 41 N -0.64 2.94 -0.00 1.43 1.51 -1.26 -4.49 117.35 116.84 1ngf s TYR 41 Ca 0.61 -0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.67 1ngf s TYR 41 Cb 0.32 -1.61 -0.00 0.00 -0.11 0.00 0.00 41.96 40.56 1ngf s TYR 41 CO -0.13 0.41 -0.03 0.08 -1.11 0.00 0.00 175.55 174.77 1ngf s VAL 42 N -1.06 0.26 0.00 0.71 1.01 -0.55 -0.59 120.40 120.18 1ngf s VAL 42 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1ngf s VAL 42 Cb -0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 36.38 36.04 1ngf s VAL 42 CO 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 175.10 175.26 1ngf s ALA 43 N -0.02 0.12 -0.12 5.51 0.00 0.38 0.21 121.76 127.84 1ngf s ALA 43 Ca 0.01 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 51.90 1ngf s ALA 43 Cb -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1ngf s ALA 43 CO -0.00 0.02 -0.20 -0.06 0.00 0.00 0.00 175.76 175.52 1ngf s PHE 44 N -0.12 2.66 0.00 0.00 0.40 -0.42 -0.13 117.98 120.38 1ngf s PHE 44 Ca -0.00 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.39 1ngf s PHE 44 Cb -0.01 -1.77 0.00 0.00 0.51 0.00 0.00 43.02 41.75 1ngf s PHE 44 CO -0.00 -0.37 0.00 0.25 0.70 0.00 0.00 175.22 175.80 1ngf n THR 45 N 3.60 0.00 0.01 0.64 -2.24 -0.04 -4.81 114.28 111.44 1ngf n THR 45 Ca -0.19 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.53 1ngf n THR 45 Cb 0.53 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.88 1ngf n THR 45 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ngf h ASP 46 N 0.00 0.54 0.00 3.42 3.32 -1.94 -0.97 116.42 120.78 1ngf h ASP 46 Ca 0.00 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1ngf h ASP 46 Cb 0.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1ngf h ASP 46 CO 0.00 0.88 -1.18 0.35 -1.72 0.00 0.00 179.24 177.57 1ngf n THR 47 N -4.03 0.00 -3.83 0.35 -2.24 -1.26 -3.91 114.28 99.36 1ngf n THR 47 Ca -0.02 -0.26 -0.05 0.00 -2.27 0.00 0.00 64.05 61.46 1ngf n THR 47 Cb 0.51 0.54 0.01 0.00 -2.10 0.00 0.00 70.33 69.29 1ngf n THR 47 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1ngf s GLU 48 N -2.62 1.57 -0.20 -0.78 -1.05 -1.26 -5.05 118.70 109.32 1ngf s GLU 48 Ca -0.01 -0.97 -0.05 0.00 -0.15 0.00 0.00 54.97 53.79 1ngf s GLU 48 Cb 0.09 0.46 -0.02 0.00 -0.44 0.00 0.00 34.13 34.22 1ngf s GLU 48 CO 0.54 -0.73 -0.01 0.50 0.95 0.00 0.00 175.26 176.51 1ngf s ARG 49 N -2.57 3.59 -0.07 -4.83 3.52 -1.26 -0.86 118.95 116.46 1ngf s ARG 49 Ca 0.17 -0.54 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 1ngf s ARG 49 Cb -0.03 -3.04 -0.03 0.00 -1.56 0.00 0.00 34.95 30.29 1ngf s ARG 49 CO 0.06 0.02 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.96 1ngf s LEU 50 N 0.97 2.93 0.01 -0.88 1.02 0.82 -4.98 118.68 118.56 1ngf s LEU 50 Ca 0.01 -0.14 0.03 0.00 0.02 0.00 0.00 54.13 54.05 1ngf s LEU 50 Cb -0.14 -1.63 -0.01 0.00 0.02 0.00 0.00 46.19 44.43 1ngf s LEU 50 CO 0.01 0.32 -0.09 -0.63 0.02 0.00 0.00 176.35 175.98 1ngf s ILE 51 N -0.54 0.71 0.00 -0.59 1.01 -1.26 -0.47 121.20 120.06 1ngf s ILE 51 Ca 0.08 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.14 1ngf s ILE 51 Cb -0.12 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.71 1ngf s ILE 51 CO 0.02 0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.62 1ngf n GLY 52 N 2.47 0.52 0.26 6.18 0.00 0.25 -3.93 105.19 110.94 1ngf n GLY 52 Ca -0.16 -0.83 0.02 0.00 0.00 0.00 0.00 46.02 45.05 1ngf n GLY 52 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ngf h ASP 53 N 6.32 0.40 -0.21 1.61 3.32 -1.89 -1.01 116.42 124.96 1ngf h ASP 53 Ca 0.00 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1ngf h ASP 53 Cb 0.00 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1ngf h ASP 53 CO 0.00 0.22 0.10 0.00 -1.72 0.00 0.00 179.24 177.84 1ngf h ALA 54 N 1.44 1.71 -0.01 3.45 0.00 -1.96 0.16 119.26 124.06 1ngf h ALA 54 Ca 0.35 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 1ngf h ALA 54 Cb 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ngf h ALA 54 CO -0.29 0.23 -0.18 0.00 0.00 0.00 0.00 179.25 179.01 1ngf h ALA 55 N 1.77 0.03 -0.64 0.00 0.00 -1.40 -3.30 119.26 115.73 1ngf h ALA 55 Ca 0.09 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1ngf h ALA 55 Cb 0.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1ngf h ALA 55 CO -0.01 0.03 0.18 -0.22 0.00 0.00 0.00 179.25 179.22 1ngf h LYS 56 N -0.54 1.00 0.00 0.00 3.64 -0.97 -2.74 116.57 116.96 1ngf h LYS 56 Ca -0.02 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1ngf h LYS 56 Cb 0.91 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1ngf h LYS 56 CO 0.04 0.87 0.00 0.09 -2.27 0.00 0.00 179.45 178.18 1ngf n ASN 57 N -4.26 0.00 -0.15 4.20 3.02 0.54 -2.50 115.26 116.10 1ngf n ASN 57 Ca 0.05 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 1ngf n ASN 57 Cb 0.23 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1ngf n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ngf n GLN 58 N -0.60 0.00 -0.06 3.52 -0.00 -1.04 -4.90 117.38 114.31 1ngf n GLN 58 Ca 0.02 -0.58 0.10 0.00 -0.00 0.00 0.00 57.00 56.55 1ngf n GLN 58 Cb 0.01 -0.44 0.49 0.00 -0.00 0.00 0.00 30.24 30.30 1ngf n GLN 58 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1ngf h VAL 59 N 4.14 0.93 0.00 -0.39 3.04 -1.48 -0.55 116.25 121.94 1ngf h VAL 59 Ca 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 1ngf h VAL 59 Cb 1.11 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 1ngf h VAL 59 CO 0.00 0.08 0.00 0.00 -1.01 0.00 0.00 177.57 176.64 1ngf h ALA 60 N 1.71 1.00 0.00 3.17 0.00 -1.90 -2.63 119.26 120.61 1ngf h ALA 60 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.79 1ngf h ALA 60 Cb 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1ngf h ALA 60 CO -0.07 0.00 -2.38 -1.33 0.00 0.00 0.00 179.25 175.47 1ngf n MET 61 N -2.67 0.73 -3.06 0.00 2.00 -0.25 -4.72 117.12 109.15 1ngf n MET 61 Ca -0.00 0.03 -0.24 0.00 0.00 0.00 0.00 57.70 57.49 1ngf n MET 61 Cb 0.16 -1.51 -0.04 0.00 0.00 0.00 0.00 33.22 31.83 1ngf n MET 61 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1ngf n ASN 62 N -2.88 3.16 -0.26 7.83 5.15 -0.97 -4.94 115.26 122.36 1ngf n ASN 62 Ca -0.36 -3.43 -0.01 0.00 -0.60 0.00 0.00 54.58 50.18 1ngf n ASN 62 Cb 1.10 -0.59 0.11 0.00 -0.53 0.00 0.00 39.78 39.87 1ngf n ASN 62 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1ngf h PRO 63 N 3.10 0.77 0.00 1.20 0.13 -1.76 -1.63 132.00 133.80 1ngf h PRO 63 Ca 0.12 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1ngf h PRO 63 Cb 0.67 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.63 1ngf h PRO 63 CO 0.71 0.51 0.00 1.79 -0.23 0.00 0.00 178.00 180.78 1ngf h THR 64 N 0.80 0.00 -0.19 1.56 1.35 -1.90 -3.24 112.91 111.28 1ngf h THR 64 Ca 0.32 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1ngf h THR 64 Cb 0.15 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 1ngf h THR 64 CO -0.17 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.69 1ngf n ASN 65 N -2.92 3.11 -4.15 5.36 3.02 -0.98 -4.51 115.26 114.18 1ngf n ASN 65 Ca 0.03 -2.71 -0.35 0.00 -0.03 0.00 0.00 54.58 51.53 1ngf n ASN 65 Cb 0.43 -0.39 -0.14 0.00 -0.61 0.00 0.00 39.78 39.07 1ngf n ASN 65 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ngf s THR 66 N -2.25 2.92 0.04 3.41 2.01 -0.65 -1.30 115.64 119.83 1ngf s THR 66 Ca 0.31 -1.53 -0.13 0.00 0.31 0.00 0.00 61.69 60.65 1ngf s THR 66 Cb 0.24 -2.74 -0.06 0.00 0.01 0.00 0.00 72.50 69.95 1ngf s THR 66 CO 0.08 -0.19 0.42 -0.69 -0.69 0.00 0.00 174.62 173.55 1ngf s VAL 67 N 1.21 5.04 0.38 3.82 1.01 0.13 -4.81 120.40 127.19 1ngf s VAL 67 Ca -0.03 0.69 -0.10 0.00 0.00 0.00 0.00 61.98 62.53 1ngf s VAL 67 Cb -0.20 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1ngf s VAL 67 CO -0.02 0.44 0.69 0.72 0.00 0.00 0.00 175.10 176.93 1ngf s PHE 68 N -1.24 0.49 -1.80 5.22 -0.12 -1.26 -1.49 117.98 117.78 1ngf s PHE 68 Ca 0.29 -1.02 0.00 0.00 -0.05 0.00 0.00 56.93 56.14 1ngf s PHE 68 Cb -0.15 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 42.76 1ngf s PHE 68 CO 0.16 -1.45 0.00 -0.25 -0.05 0.00 0.00 175.22 173.62 1ngf n ASP 69 N -1.52 -5.28 0.29 1.98 9.92 -1.26 -4.85 116.55 115.83 1ngf n ASP 69 Ca -0.05 0.22 0.15 0.00 -0.53 0.00 0.00 54.79 54.58 1ngf n ASP 69 Cb 0.60 -4.53 0.89 0.00 -0.64 0.00 0.00 41.12 37.44 1ngf n ASP 69 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ngf h ALA 70 N 0.65 1.35 0.00 2.24 0.00 -1.87 -0.88 119.26 120.75 1ngf h ALA 70 Ca -0.42 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1ngf h ALA 70 Cb 1.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ngf h ALA 70 CO 0.55 0.05 -0.11 -0.22 0.00 0.00 0.00 179.25 179.53 1ngf h LYS 71 N 0.00 0.00 0.00 0.00 3.64 -1.88 -0.85 116.57 117.48 1ngf h LYS 71 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1ngf h LYS 71 Cb 0.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1ngf h LYS 71 CO 0.01 0.11 -0.01 0.00 -2.27 0.00 0.00 179.45 177.28 1ngf h ARG 72 N 0.00 0.00 0.02 1.90 3.08 -1.54 -3.36 114.38 114.48 1ngf h ARG 72 Ca -0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.67 1ngf h ARG 72 Cb 0.34 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 1ngf h ARG 72 CO 0.01 0.01 -2.14 1.28 -1.07 0.00 0.00 179.97 178.07 1ngf n LEU 73 N -3.10 2.21 -3.12 3.04 7.99 -0.70 -4.86 117.00 118.46 1ngf n LEU 73 Ca 0.04 0.25 -0.42 0.00 -0.01 0.00 0.00 56.01 55.87 1ngf n LEU 73 Cb 0.51 -0.91 -0.06 0.00 -0.11 0.00 0.00 43.42 42.85 1ngf n LEU 73 CO 0.33 0.60 0.49 0.00 -1.51 0.00 0.00 177.39 177.31 1ngf n ILE 74 N -4.01 0.00 -0.90 -0.08 3.06 -0.41 -0.88 119.36 116.14 1ngf n ILE 74 Ca -0.44 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 59.81 1ngf n ILE 74 Cb 0.88 -0.09 0.00 0.00 0.54 0.00 0.00 39.64 40.97 1ngf n ILE 74 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1ngf n GLY 75 N 1.46 0.27 3.91 4.50 0.00 -1.26 -4.66 105.19 109.41 1ngf n GLY 75 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 1ngf n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ngf s ARG 76 N -1.00 2.68 0.10 1.61 0.52 -0.06 -4.10 118.95 118.70 1ngf s ARG 76 Ca 0.00 -1.38 0.02 0.00 -0.52 0.00 0.00 55.73 53.85 1ngf s ARG 76 Cb 0.00 -2.52 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 1ngf s ARG 76 CO 0.00 -0.15 0.15 0.50 0.02 0.00 0.00 175.30 175.82 1ngf s ARG 77 N -4.17 3.10 0.36 3.54 3.52 -1.26 -4.48 118.95 119.57 1ngf s ARG 77 Ca 0.48 -0.64 0.04 0.00 -0.13 0.00 0.00 55.73 55.48 1ngf s ARG 77 Cb -0.06 -2.83 0.69 0.00 -1.56 0.00 0.00 34.95 31.20 1ngf s ARG 77 CO 0.29 0.56 1.98 0.35 -0.81 0.00 0.00 175.30 177.67 1ngf h PHE 78 N 2.94 0.63 0.00 5.12 3.04 -0.85 -1.14 116.94 126.68 1ngf h PHE 78 Ca -0.47 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.47 1ngf h PHE 78 Cb 1.17 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 39.48 1ngf h PHE 78 CO 0.59 0.46 0.00 -0.40 -2.02 0.00 0.00 178.31 176.95 1ngf n ASP 79 N -4.40 0.00 -4.72 0.41 5.75 -1.26 -4.47 116.55 107.86 1ngf n ASP 79 Ca 0.04 -1.43 -0.42 0.00 -0.01 0.00 0.00 54.79 52.97 1ngf n ASP 79 Cb 0.12 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.18 1ngf n ASP 79 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1ngf s ASP 80 N -1.51 6.80 0.29 -1.12 -1.08 -0.43 -4.90 116.67 114.72 1ngf s ASP 80 Ca 0.21 2.38 0.02 0.00 -0.52 0.00 0.00 52.55 54.65 1ngf s ASP 80 Cb 0.10 -2.59 0.60 0.00 -1.46 0.00 0.00 42.92 39.56 1ngf s ASP 80 CO 0.17 -0.66 1.83 0.00 0.52 0.00 0.00 175.17 177.02 1ngf h ALA 81 N 6.62 1.56 0.10 3.66 0.00 -1.88 -0.08 119.26 129.24 1ngf h ALA 81 Ca -0.43 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.52 1ngf h ALA 81 Cb 1.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1ngf h ALA 81 CO 0.86 0.18 -0.12 0.28 0.00 0.00 0.00 179.25 180.45 1ngf h VAL 82 N 0.95 0.73 -0.62 0.00 2.07 -1.94 -1.32 116.25 116.12 1ngf h VAL 82 Ca 0.50 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.05 1ngf h VAL 82 Cb 0.55 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 1ngf h VAL 82 CO -0.27 0.00 0.39 0.58 0.02 0.00 0.00 177.57 178.28 1ngf h VAL 83 N -0.25 1.08 -0.50 2.57 2.07 -1.57 -0.33 116.25 119.32 1ngf h VAL 83 Ca 0.01 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.29 1ngf h VAL 83 Cb 0.25 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 1ngf h VAL 83 CO -0.05 0.14 0.30 1.56 0.02 0.00 0.00 177.57 179.55 1ngf h GLN 84 N 0.76 0.59 0.34 1.57 1.08 -0.70 -1.62 115.11 117.13 1ngf h GLN 84 Ca 0.25 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.40 1ngf h GLN 84 Cb 0.01 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.31 1ngf h GLN 84 CO -0.10 0.39 -0.17 0.77 -0.95 0.00 0.00 178.83 178.78 1ngf h SER 85 N 0.61 -0.39 -0.32 1.46 0.02 -0.89 -3.34 113.55 110.69 1ngf h SER 85 Ca 0.20 -0.16 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1ngf h SER 85 Cb 0.01 0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.58 1ngf h SER 85 CO -0.09 -0.01 -0.11 0.44 -1.14 0.00 0.00 176.83 175.92 1ngf h ASP 86 N -0.83 -0.40 0.00 3.07 3.32 -1.00 -2.54 116.42 118.05 1ngf h ASP 86 Ca -0.05 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1ngf h ASP 86 Cb 0.53 0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1ngf h ASP 86 CO 0.08 -0.15 0.19 0.00 -1.72 0.00 0.00 179.24 177.64 1ngf h MET 87 N -0.05 0.00 0.00 3.56 -0.00 -1.41 -0.48 114.93 116.55 1ngf h MET 87 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.86 1ngf h MET 87 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.89 1ngf h MET 87 CO -0.36 0.00 0.00 1.63 -0.00 0.00 0.00 176.91 178.18 1ngf n LYS 88 N -2.75 0.42 -0.01 -0.10 4.76 -0.96 -3.26 118.16 116.26 1ngf n LYS 88 Ca -0.02 0.06 -0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1ngf n LYS 88 Cb 0.24 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.90 1ngf n LYS 88 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1ngf n HIS 89 N -1.16 0.00 -2.32 2.13 8.25 -0.19 -5.03 115.22 116.90 1ngf n HIS 89 Ca 0.12 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.17 1ngf n HIS 89 Cb 0.12 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.05 1ngf n HIS 89 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1ngf s TRP 90 N -2.17 3.37 -2.00 4.41 0.51 -1.20 -4.91 118.94 116.94 1ngf s TRP 90 Ca -0.02 1.43 0.10 0.00 -2.12 0.00 0.00 56.10 55.50 1ngf s TRP 90 Cb 0.02 -3.47 0.60 0.00 -0.81 0.00 0.00 33.47 29.80 1ngf s TRP 90 CO 0.16 -1.31 1.38 -0.35 -0.51 0.00 0.00 176.95 176.31 1ngf n PRO 91 N 2.04 1.00 -4.38 4.98 -0.04 -1.26 -4.80 135.00 132.53 1ngf n PRO 91 Ca 0.03 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.24 1ngf n PRO 91 Cb 0.44 -1.16 -0.10 0.00 -0.04 0.00 0.00 33.50 32.64 1ngf n PRO 91 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1ngf s PHE 92 N -2.00 2.46 0.19 0.54 -0.12 -1.26 -3.70 117.98 114.09 1ngf s PHE 92 Ca 0.15 -0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 56.44 1ngf s PHE 92 Cb 0.07 -1.15 -0.08 0.00 -0.63 0.00 0.00 43.02 41.23 1ngf s PHE 92 CO 0.12 0.58 1.06 -1.64 -0.05 0.00 0.00 175.22 175.29 1ngf s MET 93 N -3.11 4.65 -0.15 1.99 -1.94 -1.25 -4.97 119.30 114.51 1ngf s MET 93 Ca 0.26 1.67 0.00 0.00 -1.71 0.00 0.00 55.69 55.91 1ngf s MET 93 Cb -0.07 -3.28 0.03 0.00 2.01 0.00 0.00 34.83 33.52 1ngf s MET 93 CO 0.14 0.17 -0.10 0.08 -0.01 0.00 0.00 175.02 175.30 1ngf s VAL 94 N -0.47 1.32 0.45 -6.03 1.01 -1.26 -0.39 120.40 115.03 1ngf s VAL 94 Ca 0.47 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1ngf s VAL 94 Cb -0.29 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 1ngf s VAL 94 CO 0.35 0.31 0.27 0.68 0.00 0.00 0.00 175.10 176.71 1ngf s VAL 95 N 1.57 2.19 -0.32 2.92 -7.23 0.16 -4.89 120.40 114.79 1ngf s VAL 95 Ca 0.03 -1.58 -0.04 0.00 -1.81 0.00 0.00 61.98 58.58 1ngf s VAL 95 Cb -0.14 -2.77 0.05 0.00 0.56 0.00 0.00 36.38 34.08 1ngf s VAL 95 CO -0.09 0.00 0.06 0.21 -0.31 0.00 0.00 175.10 174.97 1ngf s ASN 96 N -4.04 5.10 -0.79 4.85 3.84 -1.26 -0.63 114.94 122.00 1ngf s ASN 96 Ca 0.39 -1.27 -0.06 0.00 0.21 0.00 0.00 52.86 52.14 1ngf s ASN 96 Cb 0.01 -1.79 0.20 0.00 -0.55 0.00 0.00 41.25 39.12 1ngf s ASN 96 CO 0.23 -0.31 0.67 -0.62 -2.79 0.00 0.00 177.10 174.28 1ngf s ASP 97 N 1.36 6.00 -1.15 -4.21 2.15 0.15 -4.66 116.67 116.31 1ngf s ASP 97 Ca -0.03 -3.11 -0.01 0.00 0.43 0.00 0.00 52.55 49.83 1ngf s ASP 97 Cb -0.20 -1.99 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 1ngf s ASP 97 CO 0.00 -0.36 0.96 0.00 -0.17 0.00 0.00 175.17 175.60 1ngf n ALA 98 N 3.23 -1.80 0.00 3.66 0.00 -1.26 -2.40 120.51 121.95 1ngf n ALA 98 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ngf n ALA 98 Cb 0.40 -2.73 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1ngf n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ngf n GLY 99 N -1.24 2.83 3.76 0.00 0.00 -1.26 -5.01 105.19 104.26 1ngf n GLY 99 Ca -0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 1ngf n GLY 99 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ngf s ARG 100 N -0.08 4.37 0.45 1.61 1.81 -1.01 -0.16 118.95 125.94 1ngf s ARG 100 Ca 0.00 0.83 -0.21 0.00 -1.72 0.00 0.00 55.73 54.63 1ngf s ARG 100 Cb 0.00 -3.35 -0.10 0.00 -0.45 0.00 0.00 34.95 31.05 1ngf s ARG 100 CO 0.00 0.33 1.00 -1.25 -0.68 0.00 0.00 175.30 174.70 1ngf s PRO 101 N -0.11 4.02 -0.03 3.54 0.04 -1.26 0.30 135.00 141.50 1ngf s PRO 101 Ca 0.33 1.26 -0.03 0.00 0.04 0.00 0.00 61.00 62.60 1ngf s PRO 101 Cb -0.19 -2.16 0.01 0.00 0.04 0.00 0.00 34.50 32.20 1ngf s PRO 101 CO 0.19 -0.23 0.09 0.15 0.04 0.00 0.00 177.00 177.24 1ngf s LYS 102 N -3.16 0.13 -0.09 4.56 1.02 0.20 -4.46 119.74 117.94 1ngf s LYS 102 Ca 0.64 0.10 -0.20 0.00 0.02 0.00 0.00 55.97 56.53 1ngf s LYS 102 Cb -0.13 0.06 -0.04 0.00 -0.52 0.00 0.00 37.83 37.20 1ngf s LYS 102 CO 0.17 -0.02 0.56 0.08 -0.92 0.00 0.00 175.35 175.22 1ngf s VAL 103 N -0.03 5.12 -0.16 3.17 1.01 -0.04 0.38 120.40 129.86 1ngf s VAL 103 Ca -0.01 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 63.08 1ngf s VAL 103 Cb -0.01 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1ngf s VAL 103 CO 0.00 0.31 -0.07 -1.58 0.00 0.00 0.00 175.10 173.76 1ngf s GLN 104 N 0.60 3.51 0.19 2.72 0.74 0.48 -0.49 119.66 127.40 1ngf s GLN 104 Ca 0.30 -0.60 -0.01 0.00 0.05 0.00 0.00 55.36 55.10 1ngf s GLN 104 Cb -0.16 -2.82 -0.04 0.00 1.10 0.00 0.00 33.01 31.08 1ngf s GLN 104 CO 0.13 0.15 0.10 0.14 -0.55 0.00 0.00 175.29 175.26 1ngf s VAL 105 N 0.56 0.15 -0.25 1.34 -7.23 0.68 -3.80 120.40 111.84 1ngf s VAL 105 Ca -0.05 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.08 1ngf s VAL 105 Cb -0.15 -2.36 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 1ngf s VAL 105 CO 0.03 -0.16 0.06 -0.70 -0.31 0.00 0.00 175.10 174.02 1ngf s GLU 106 N -4.10 3.52 -0.16 4.82 2.12 -1.26 -0.58 118.70 123.07 1ngf s GLU 106 Ca 0.34 -0.56 0.00 0.00 0.36 0.00 0.00 54.97 55.11 1ngf s GLU 106 Cb 0.07 -3.29 0.03 0.00 0.26 0.00 0.00 34.13 31.19 1ngf s GLU 106 CO 0.09 -0.23 -0.13 -0.47 -0.54 0.00 0.00 175.26 173.97 1ngf s TYR 107 N 1.58 2.20 -1.29 5.30 5.04 0.12 -4.44 117.35 125.86 1ngf s TYR 107 Ca 0.06 -1.28 -0.01 0.00 -2.44 0.00 0.00 57.07 53.39 1ngf s TYR 107 Cb -0.15 -1.60 0.01 0.00 0.35 0.00 0.00 41.96 40.57 1ngf s TYR 107 CO 0.03 -0.68 0.85 1.63 -1.34 0.00 0.00 175.55 176.04 1ngf n LYS 108 N 4.76 -5.75 0.00 4.97 5.02 -0.37 -1.61 118.16 125.18 1ngf n LYS 108 Ca -0.16 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1ngf n LYS 108 Cb 0.49 -5.49 0.00 0.00 -0.02 0.00 0.00 35.03 30.01 1ngf n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ngf n GLY 109 N -1.45 1.54 3.82 0.72 0.00 -1.26 -4.94 105.19 103.62 1ngf n GLY 109 Ca -0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 1ngf n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ngf s GLU 110 N 0.00 4.02 -0.30 1.61 0.41 -0.63 -5.05 118.70 118.76 1ngf s GLU 110 Ca 0.00 0.49 -0.26 0.00 -0.41 0.00 0.00 54.97 54.80 1ngf s GLU 110 Cb 0.00 -3.24 0.01 0.00 -1.78 0.00 0.00 34.13 29.11 1ngf s GLU 110 CO 0.00 0.64 0.90 0.99 -0.49 0.00 0.00 175.26 177.29 1ngf s THR 111 N -0.94 4.70 0.14 3.63 2.01 -1.26 -0.70 115.64 123.21 1ngf s THR 111 Ca 0.25 1.45 0.08 0.00 0.31 0.00 0.00 61.69 63.78 1ngf s THR 111 Cb -0.17 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.06 1ngf s THR 111 CO 0.14 -0.30 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.05 1ngf s LYS 112 N 3.18 1.19 0.11 4.92 3.01 0.25 -4.98 119.74 127.42 1ngf s LYS 112 Ca 0.37 -1.30 0.06 0.00 -1.01 0.00 0.00 55.97 54.09 1ngf s LYS 112 Cb -0.14 -1.30 -0.04 0.00 -1.01 0.00 0.00 37.83 35.35 1ngf s LYS 112 CO 0.12 0.28 -0.14 -1.54 0.51 0.00 0.00 175.35 174.58 1ngf s SER 113 N -2.37 1.97 0.02 2.83 1.04 -1.26 -0.23 113.70 115.70 1ngf s SER 113 Ca 0.12 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.78 1ngf s SER 113 Cb -0.07 -0.07 -0.02 0.00 0.10 0.00 0.00 66.02 65.96 1ngf s SER 113 CO 0.05 -0.12 -0.04 -0.36 0.98 0.00 0.00 173.24 173.76 1ngf s PHE 114 N -1.92 0.31 0.32 5.02 0.08 0.36 -4.95 117.98 117.20 1ngf s PHE 114 Ca 0.07 -0.44 -0.22 0.00 0.12 0.00 0.00 56.93 56.45 1ngf s PHE 114 Cb -0.06 -0.21 -0.10 0.00 -0.57 0.00 0.00 43.02 42.08 1ngf s PHE 114 CO 0.03 -0.14 0.87 0.71 -0.10 0.00 0.00 175.22 176.59 1ngf s TYR 115 N -1.22 3.57 0.35 0.36 2.02 -1.26 -0.86 117.35 120.31 1ngf s TYR 115 Ca -0.12 1.60 0.16 0.00 -0.37 0.00 0.00 57.07 58.33 1ngf s TYR 115 Cb -0.09 -2.80 1.10 0.00 -0.40 0.00 0.00 41.96 39.78 1ngf s TYR 115 CO -0.01 0.16 1.67 -1.35 -1.57 0.00 0.00 175.55 174.46 1ngf h PRO 116 N 2.89 0.32 -0.03 -1.71 0.11 -1.93 0.43 132.00 132.07 1ngf h PRO 116 Ca -0.48 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1ngf h PRO 116 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1ngf h PRO 116 CO 0.64 0.21 -0.32 1.05 -0.21 0.00 0.00 178.00 179.38 1ngf h GLU 117 N 0.33 0.06 -0.30 1.05 9.09 -1.91 -1.55 114.58 121.34 1ngf h GLU 117 Ca 0.73 -0.02 -0.16 0.00 0.05 0.00 0.00 59.36 59.96 1ngf h GLU 117 Cb 1.70 -0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.79 1ngf h GLU 117 CO -0.56 0.38 -0.44 0.93 0.05 0.00 0.00 179.01 179.36 1ngf h GLU 118 N 0.05 0.78 0.07 1.06 5.08 -0.53 -0.42 114.58 120.67 1ngf h GLU 118 Ca 0.01 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1ngf h GLU 118 Cb 0.60 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1ngf h GLU 118 CO 0.04 1.06 -0.03 0.28 -1.00 0.00 0.00 179.01 179.36 1ngf h VAL 119 N 0.63 1.06 -0.54 3.13 2.07 -0.97 -2.69 116.25 118.94 1ngf h VAL 119 Ca 0.04 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.16 1ngf h VAL 119 Cb 1.01 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 1ngf h VAL 119 CO 0.10 0.11 0.36 0.28 0.02 0.00 0.00 177.57 178.43 1ngf h SER 120 N -0.28 0.54 -0.09 0.57 0.02 -1.22 0.28 113.55 113.37 1ngf h SER 120 Ca -0.01 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1ngf h SER 120 Cb 0.24 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1ngf h SER 120 CO 0.01 0.37 -0.02 0.77 -1.14 0.00 0.00 176.83 176.83 1ngf h SER 121 N 0.63 0.26 -0.56 3.07 4.64 -0.77 -0.01 113.55 120.81 1ngf h SER 121 Ca 0.21 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.45 1ngf h SER 121 Cb 0.08 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 1ngf h SER 121 CO -0.06 0.33 0.17 0.24 -0.87 0.00 0.00 176.83 176.65 1ngf h MET 122 N 0.28 0.87 -0.54 4.77 2.86 -0.63 0.15 114.93 122.69 1ngf h MET 122 Ca 0.06 -0.19 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 1ngf h MET 122 Cb 0.22 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1ngf h MET 122 CO 0.01 0.79 -0.01 0.28 1.06 0.00 0.00 176.91 179.03 1ngf h VAL 123 N 0.78 1.26 -0.52 -2.22 2.07 -1.17 -2.37 116.25 114.08 1ngf h VAL 123 Ca 0.18 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.54 1ngf h VAL 123 Cb 0.28 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1ngf h VAL 123 CO -0.01 0.40 0.19 -0.07 0.02 0.00 0.00 177.57 178.10 1ngf h LEU 124 N 0.83 0.69 -0.65 2.57 4.07 -0.63 -1.61 115.31 120.58 1ngf h LEU 124 Ca 0.15 -0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.93 1ngf h LEU 124 Cb 0.55 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 1ngf h LEU 124 CO 0.03 0.63 -0.02 0.74 -1.08 0.00 0.00 178.44 178.75 1ngf h THR 125 N 0.74 1.26 -0.57 0.22 2.02 -0.41 -1.35 112.91 114.83 1ngf h THR 125 Ca 0.18 -1.16 -0.06 0.00 0.77 0.00 0.00 66.41 66.14 1ngf h THR 125 Cb 0.18 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1ngf h THR 125 CO -0.01 0.42 0.12 0.50 0.37 0.00 0.00 175.52 176.91 1ngf h LYS 126 N 0.95 0.92 -0.44 6.66 1.63 -0.88 -0.90 116.57 124.50 1ngf h LYS 126 Ca 0.17 -0.23 -0.04 0.00 -0.85 0.00 0.00 60.65 59.69 1ngf h LYS 126 Cb 0.57 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 1ngf h LYS 126 CO 0.03 0.87 0.10 0.52 -3.45 0.00 0.00 179.45 177.53 1ngf h MET 127 N 0.82 0.71 -0.36 1.90 2.86 -1.10 -1.17 114.93 118.61 1ngf h MET 127 Ca 0.18 -0.17 0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1ngf h MET 127 Cb 0.38 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1ngf h MET 127 CO 0.01 0.72 0.16 -0.22 1.06 0.00 0.00 176.91 178.64 1ngf h LYS 128 N 0.59 0.33 0.00 1.72 3.64 -1.01 0.10 116.57 121.94 1ngf h LYS 128 Ca 0.14 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 1ngf h LYS 128 Cb 0.33 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1ngf h LYS 128 CO 0.00 0.22 -0.47 1.05 -2.27 0.00 0.00 179.45 177.98 1ngf h GLU 129 N 0.34 0.00 -0.43 1.90 4.11 -1.01 0.80 114.58 120.29 1ngf h GLU 129 Ca 0.15 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.52 1ngf h GLU 129 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1ngf h GLU 129 CO -0.12 0.47 0.02 0.82 0.07 0.00 0.00 179.01 180.26 1ngf h ILE 130 N 0.00 1.26 0.43 -1.06 2.04 -0.60 0.15 117.51 119.73 1ngf h ILE 130 Ca -0.00 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 64.84 1ngf h ILE 130 Cb 0.86 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1ngf h ILE 130 CO 0.06 0.34 -0.21 0.00 0.00 0.00 0.00 178.15 178.35 1ngf h ALA 131 N 0.91 -0.57 -0.85 1.87 0.00 -0.53 -2.10 119.26 117.98 1ngf h ALA 131 Ca 0.12 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1ngf h ALA 131 Cb 0.46 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 1ngf h ALA 131 CO 0.02 -0.73 0.55 0.93 0.00 0.00 0.00 179.25 180.02 1ngf h GLU 132 N -0.77 0.65 -0.24 0.00 5.08 -0.79 0.30 114.58 118.80 1ngf h GLU 132 Ca -0.06 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.17 1ngf h GLU 132 Cb 0.53 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1ngf h GLU 132 CO 0.10 0.43 -0.26 0.00 -1.00 0.00 0.00 179.01 178.27 1ngf h ALA 133 N 1.60 1.10 0.12 3.43 0.00 -0.50 0.33 119.26 125.34 1ngf h ALA 133 Ca 0.42 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ngf h ALA 133 Cb 0.66 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ngf h ALA 133 CO -0.18 0.56 -0.06 -0.92 0.00 0.00 0.00 179.25 178.66 1ngf h TYR 134 N 0.41 -0.15 0.00 0.00 3.20 -0.16 -3.35 116.97 116.92 1ngf h TYR 134 Ca 0.06 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 1ngf h TYR 134 Cb 0.68 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.99 1ngf h TYR 134 CO 0.02 0.13 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.38 1ngf h LEU 135 N -1.00 0.00 1.07 2.82 3.38 -0.56 -3.47 115.31 117.55 1ngf h LEU 135 Ca -0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1ngf h LEU 135 Cb 0.34 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1ngf h LEU 135 CO 0.03 0.21 -0.20 0.61 0.09 0.00 0.00 178.44 179.19 1ngf n GLY 136 N -0.75 0.08 3.34 0.83 0.00 0.12 -5.01 105.19 103.80 1ngf n GLY 136 Ca -0.02 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.32 1ngf n GLY 136 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ngf s LYS 137 N -4.33 1.07 0.16 1.61 2.47 -1.19 -5.07 119.74 114.47 1ngf s LYS 137 Ca 0.00 -0.55 -0.30 0.00 -1.56 0.00 0.00 55.97 53.56 1ngf s LYS 137 Cb 0.00 0.48 -0.08 0.00 -1.46 0.00 0.00 37.83 36.77 1ngf s LYS 137 CO 0.00 -0.42 1.17 0.95 0.16 0.00 0.00 175.35 177.22 1ngf s THR 138 N -3.39 3.71 -0.23 3.43 -4.23 -1.26 -4.34 115.64 109.33 1ngf s THR 138 Ca 0.00 1.42 -0.11 0.00 -1.18 0.00 0.00 61.69 61.81 1ngf s THR 138 Cb 0.01 -3.90 -0.05 0.00 1.34 0.00 0.00 72.50 69.89 1ngf s THR 138 CO -0.09 0.21 0.19 -0.69 -0.54 0.00 0.00 174.62 173.71 1ngf s VAL 139 N 0.06 5.34 -0.02 2.29 1.01 -1.26 -4.74 120.40 123.09 1ngf s VAL 139 Ca 0.53 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.75 1ngf s VAL 139 Cb -0.31 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1ngf s VAL 139 CO 0.35 0.34 -0.05 0.41 0.00 0.00 0.00 175.10 176.15 1ngf n THR 140 N 4.23 0.49 -3.18 3.92 -1.04 -1.26 -4.91 114.28 112.52 1ngf n THR 140 Ca -0.14 0.05 -0.37 0.00 -2.04 0.00 0.00 64.05 61.55 1ngf n THR 140 Cb 0.52 -1.59 -0.06 0.00 -1.82 0.00 0.00 70.33 67.38 1ngf n THR 140 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1ngf s ASN 141 N -5.53 7.03 0.11 8.00 0.02 -1.26 0.10 114.94 123.41 1ngf s ASN 141 Ca -0.05 1.33 -0.19 0.00 -1.02 0.00 0.00 52.86 52.92 1ngf s ASN 141 Cb 0.02 -2.38 0.05 0.00 0.02 0.00 0.00 41.25 38.95 1ngf s ASN 141 CO 0.07 0.11 0.48 0.00 0.02 0.00 0.00 177.10 177.78 1ngf s ALA 142 N -1.40 -1.19 -0.15 0.60 0.00 -0.73 -1.27 121.76 117.62 1ngf s ALA 142 Ca 0.38 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.63 1ngf s ALA 142 Cb -0.17 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.59 1ngf s ALA 142 CO 0.21 -0.62 -0.20 0.08 0.00 0.00 0.00 175.76 175.22 1ngf s VAL 143 N -3.33 1.97 -0.04 0.00 1.01 -0.15 0.04 120.40 119.90 1ngf s VAL 143 Ca -0.00 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1ngf s VAL 143 Cb 0.00 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1ngf s VAL 143 CO -0.09 0.53 -0.08 -0.69 0.00 0.00 0.00 175.10 174.77 1ngf s VAL 144 N 1.02 3.58 0.33 2.92 1.01 -1.10 -0.52 120.40 127.65 1ngf s VAL 144 Ca -0.02 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.37 1ngf s VAL 144 Cb -0.14 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 1ngf s VAL 144 CO -0.06 0.52 0.49 0.42 0.00 0.00 0.00 175.10 176.47 1ngf s THR 145 N -0.87 4.59 -0.04 3.92 -4.23 -0.91 -2.57 115.64 115.53 1ngf s THR 145 Ca 0.14 -0.81 -0.23 0.00 -1.18 0.00 0.00 61.69 59.61 1ngf s THR 145 Cb -0.11 -3.63 0.05 0.00 1.34 0.00 0.00 72.50 70.14 1ngf s THR 145 CO 0.03 -0.31 0.50 0.54 -0.54 0.00 0.00 174.62 174.84 1ngf s VAL 146 N -2.21 0.03 0.68 2.29 0.11 -0.60 -4.50 120.40 116.19 1ngf s VAL 146 Ca 0.41 -0.22 -0.17 0.00 -2.93 0.00 0.00 61.98 59.07 1ngf s VAL 146 Cb -0.09 -0.81 0.00 0.00 -1.53 0.00 0.00 36.38 33.95 1ngf s VAL 146 CO 0.33 -0.12 1.27 -2.65 -3.33 0.00 0.00 175.10 170.59 1ngf n PRO 147 N 1.19 0.95 0.07 1.54 -0.02 -1.26 -0.28 135.00 137.19 1ngf n PRO 147 Ca -0.20 0.39 0.05 0.00 -2.02 0.00 0.00 63.50 61.72 1ngf n PRO 147 Cb 0.56 -2.51 0.49 0.00 -0.02 0.00 0.00 33.50 32.03 1ngf n PRO 147 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ngf h ALA 148 N 0.29 1.81 0.00 3.55 0.00 -1.94 -2.28 119.26 120.68 1ngf h ALA 148 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1ngf h ALA 148 Cb 1.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ngf h ALA 148 CO 0.52 0.18 0.00 2.48 0.00 0.00 0.00 179.25 182.42 1ngf n TYR 149 N -4.49 0.00 -2.18 0.00 0.18 -1.26 -4.85 117.16 104.55 1ngf n TYR 149 Ca 0.02 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.37 1ngf n TYR 149 Cb 0.08 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.01 1ngf n TYR 149 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 1ngf s PHE 150 N -2.00 2.88 1.11 -3.48 0.40 -0.86 -5.02 117.98 111.01 1ngf s PHE 150 Ca 0.41 0.79 -0.19 0.00 -0.60 0.00 0.00 56.93 57.34 1ngf s PHE 150 Cb 0.19 -3.70 0.27 0.00 0.51 0.00 0.00 43.02 40.28 1ngf s PHE 150 CO 0.32 -2.60 1.24 0.27 0.70 0.00 0.00 175.22 175.14 1ngf n ASN 151 N 5.11 -0.94 0.17 1.36 0.23 -1.26 -4.78 115.26 115.15 1ngf n ASN 151 Ca 0.13 -1.34 0.05 0.00 -0.53 0.00 0.00 54.58 52.89 1ngf n ASN 151 Cb 0.43 -1.03 0.49 0.00 -2.08 0.00 0.00 39.78 37.59 1ngf n ASN 151 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ngf h ASP 152 N -2.23 0.12 -0.21 0.53 3.32 -1.99 -1.88 116.42 114.08 1ngf h ASP 152 Ca -0.43 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.51 1ngf h ASP 152 Cb 1.23 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 1ngf h ASP 152 CO 0.29 0.23 -0.24 0.28 -1.72 0.00 0.00 179.24 178.08 1ngf h SER 153 N 0.13 0.58 -0.63 6.45 0.02 -1.93 0.33 113.55 118.50 1ngf h SER 153 Ca 0.03 -0.49 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 1ngf h SER 153 Cb 0.23 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 1ngf h SER 153 CO 0.01 0.95 0.10 1.56 -1.14 0.00 0.00 176.83 178.31 1ngf h GLN 154 N 0.22 1.06 -0.30 3.45 4.20 -1.65 0.14 115.11 122.23 1ngf h GLN 154 Ca 0.03 -0.28 -0.16 0.00 0.06 0.00 0.00 58.65 58.30 1ngf h GLN 154 Cb 0.79 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 1ngf h GLN 154 CO 0.06 0.98 -0.45 0.00 -0.67 0.00 0.00 178.83 178.74 1ngf h ARG 155 N 1.00 0.79 0.28 1.46 3.08 -1.32 -1.67 114.38 118.01 1ngf h ARG 155 Ca 0.20 -0.45 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 1ngf h ARG 155 Cb 0.43 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1ngf h ARG 155 CO 0.01 1.08 -0.22 0.37 -1.07 0.00 0.00 179.97 180.13 1ngf h GLN 156 N 0.63 -0.50 -0.83 0.04 -0.00 -0.53 -0.67 115.11 113.26 1ngf h GLN 156 Ca 0.04 0.03 0.06 0.00 -0.00 0.00 0.00 58.65 58.79 1ngf h GLN 156 Cb 1.02 0.11 -0.05 0.00 0.00 0.00 0.00 27.48 28.56 1ngf h GLN 156 CO 0.10 -0.33 0.54 0.00 0.00 0.00 0.00 178.83 179.14 1ngf h ALA 157 N 0.15 1.59 -0.33 3.38 0.00 -0.94 0.13 119.26 123.24 1ngf h ALA 157 Ca -0.02 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1ngf h ALA 157 Cb 0.45 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ngf h ALA 157 CO -0.01 0.28 -0.33 1.15 0.00 0.00 0.00 179.25 180.33 1ngf h THR 158 N 0.91 1.28 -0.40 0.00 2.02 -0.98 0.10 112.91 115.84 1ngf h THR 158 Ca 0.36 -1.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 1ngf h THR 158 Cb 0.22 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1ngf h THR 158 CO -0.13 0.48 0.03 0.50 0.37 0.00 0.00 175.52 176.78 1ngf h LYS 159 N 0.61 0.68 -0.43 6.66 3.64 0.35 -2.67 116.57 125.41 1ngf h LYS 159 Ca 0.06 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1ngf h LYS 159 Cb 0.86 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 1ngf h LYS 159 CO 0.07 0.75 0.16 -0.44 -2.27 0.00 0.00 179.45 177.72 1ngf h ASP 160 N 0.52 0.60 -0.73 4.20 3.32 -0.66 -1.48 116.42 122.20 1ngf h ASP 160 Ca 0.12 -0.18 0.14 0.00 0.02 0.00 0.00 57.03 57.13 1ngf h ASP 160 Cb 0.42 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.77 1ngf h ASP 160 CO 0.01 0.63 0.49 0.00 -1.72 0.00 0.00 179.24 178.65 1ngf h ALA 161 N 1.00 2.11 -0.13 3.45 0.00 -0.86 -0.59 119.26 124.23 1ngf h ALA 161 Ca 0.14 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1ngf h ALA 161 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ngf h ALA 161 CO -0.01 -0.30 -0.40 0.78 0.00 0.00 0.00 179.25 179.32 1ngf h GLY 162 N 0.41 0.56 0.69 0.00 0.00 -1.02 -3.05 103.07 100.66 1ngf h GLY 162 Ca 0.36 -0.72 0.03 0.00 0.00 0.00 0.00 47.33 47.00 1ngf h GLY 162 CO -0.11 0.65 0.00 -0.84 0.00 0.00 0.00 176.54 176.24 1ngf h THR 163 N 0.12 0.86 0.00 4.70 2.02 -0.14 -1.28 112.91 119.20 1ngf h THR 163 Ca -0.01 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1ngf h THR 163 Cb 1.03 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1ngf h THR 163 CO 0.09 0.01 0.00 0.16 0.37 0.00 0.00 175.52 176.15 1ngf h ILE 164 N 0.07 0.00 -0.01 3.11 3.07 -1.37 0.48 117.51 122.86 1ngf h ILE 164 Ca 0.10 -0.23 0.00 0.00 1.55 0.00 0.00 64.86 66.28 1ngf h ILE 164 Cb 0.12 0.97 0.00 0.00 -0.27 0.00 0.00 36.82 37.63 1ngf h ILE 164 CO -0.16 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 176.94 1ngf n ALA 165 N -1.83 2.62 -1.33 0.16 0.00 -0.58 -4.88 120.51 114.67 1ngf n ALA 165 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1ngf n ALA 165 Cb 0.20 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1ngf n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ngf n GLY 166 N 1.10 0.38 3.58 0.00 0.00 0.16 -4.78 105.19 105.62 1ngf n GLY 166 Ca 0.21 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.86 1ngf n GLY 166 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ngf s LEU 167 N 0.00 3.50 -0.69 0.99 1.02 -0.64 -4.81 118.68 118.05 1ngf s LEU 167 Ca 0.00 -0.01 -0.20 0.00 0.02 0.00 0.00 54.13 53.94 1ngf s LEU 167 Cb 0.00 -1.85 0.10 0.00 0.02 0.00 0.00 46.19 44.46 1ngf s LEU 167 CO 0.00 0.21 0.87 0.21 0.02 0.00 0.00 176.35 177.66 1ngf s ASN 168 N 0.12 6.29 -0.51 2.29 3.84 0.11 -3.65 114.94 123.43 1ngf s ASN 168 Ca 0.01 -1.45 -0.28 0.00 0.21 0.00 0.00 52.86 51.36 1ngf s ASN 168 Cb -0.13 -2.35 -0.01 0.00 -0.55 0.00 0.00 41.25 38.21 1ngf s ASN 168 CO 0.02 -1.19 1.68 -0.69 -2.79 0.00 0.00 177.10 174.13 1ngf s VAL 169 N 3.04 3.55 0.27 -5.21 1.01 -1.26 -1.78 120.40 120.02 1ngf s VAL 169 Ca 0.19 0.46 -0.02 0.00 0.00 0.00 0.00 61.98 62.61 1ngf s VAL 169 Cb -0.18 -4.03 0.17 0.00 0.00 0.00 0.00 36.38 32.35 1ngf s VAL 169 CO 0.04 -0.85 1.84 -0.07 0.00 0.00 0.00 175.10 176.06 1ngf h LEU 170 N 14.43 0.84 -7.00 3.92 4.07 -0.77 -3.47 115.31 127.33 1ngf h LEU 170 Ca -0.28 -0.13 0.08 0.00 0.08 0.00 0.00 57.88 57.63 1ngf h LEU 170 Cb 1.14 -0.22 -0.20 0.00 1.08 0.00 0.00 40.66 42.47 1ngf h LEU 170 CO 1.15 0.78 0.50 -0.60 -1.08 0.00 0.00 178.44 179.18 1ngf s ARG 171 N -5.35 0.72 -0.28 1.13 3.52 -1.25 -5.06 118.95 112.38 1ngf s ARG 171 Ca -0.10 -0.01 -0.04 0.00 -0.13 0.00 0.00 55.73 55.44 1ngf s ARG 171 Cb 0.16 0.34 0.02 0.00 -1.56 0.00 0.00 34.95 33.91 1ngf s ARG 171 CO 0.80 -0.26 0.02 0.42 -0.81 0.00 0.00 175.30 175.47 1ngf s ILE 172 N -1.88 3.42 0.21 4.11 -1.09 -1.26 -2.70 121.20 122.00 1ngf s ILE 172 Ca 0.00 -0.95 0.11 0.00 -2.23 0.00 0.00 60.65 57.58 1ngf s ILE 172 Cb -0.01 -2.80 -0.05 0.00 -1.58 0.00 0.00 42.46 38.03 1ngf s ILE 172 CO -0.02 0.07 -0.21 0.27 -1.23 0.00 0.00 174.94 173.83 1ngf s ILE 173 N 1.39 2.52 0.46 2.92 -4.36 -1.06 -4.99 121.20 118.08 1ngf s ILE 173 Ca 0.00 -2.07 -0.23 0.00 -0.26 0.00 0.00 60.65 58.10 1ngf s ILE 173 Cb -0.18 -2.25 -0.08 0.00 1.25 0.00 0.00 42.46 41.21 1ngf s ILE 173 CO -0.01 -0.19 1.14 0.20 0.24 0.00 0.00 174.94 176.33 1ngf s ASN 174 N -2.91 6.24 0.24 4.36 0.01 -1.26 -1.56 114.94 120.06 1ngf s ASN 174 Ca 0.24 2.25 -0.06 0.00 -0.71 0.00 0.00 52.86 54.57 1ngf s ASN 174 Cb -0.07 -2.60 0.24 0.00 0.41 0.00 0.00 41.25 39.23 1ngf s ASN 174 CO 0.12 -0.87 1.91 -0.33 -1.51 0.00 0.00 177.10 176.42 1ngf h GLU 175 N 2.05 1.29 -0.62 -0.60 5.08 -0.94 -1.51 114.58 119.33 1ngf h GLU 175 Ca -0.49 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 1ngf h GLU 175 Cb 1.24 -0.28 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1ngf h GLU 175 CO 0.60 0.88 0.33 -1.35 -1.00 0.00 0.00 179.01 178.47 1ngf h PRO 176 N 1.32 0.87 -0.69 2.33 0.11 -1.93 -2.11 132.00 131.91 1ngf h PRO 176 Ca 0.35 -0.11 -0.06 0.00 0.11 0.00 0.00 66.00 66.29 1ngf h PRO 176 Cb -0.10 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 30.81 1ngf h PRO 176 CO -0.07 0.68 0.19 1.15 -0.21 0.00 0.00 178.00 179.73 1ngf h THR 177 N 0.85 1.26 -0.33 -1.15 2.02 -1.88 -2.26 112.91 111.41 1ngf h THR 177 Ca 0.22 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1ngf h THR 177 Cb 0.07 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1ngf h THR 177 CO -0.03 0.36 0.21 0.00 0.37 0.00 0.00 175.52 176.42 1ngf h ALA 178 N 1.16 0.42 -0.41 6.16 0.00 -0.92 -1.61 119.26 124.06 1ngf h ALA 178 Ca 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ngf h ALA 178 Cb 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ngf h ALA 178 CO -0.00 -0.10 0.26 0.00 0.00 0.00 0.00 179.25 179.41 1ngf h ALA 179 N 1.10 0.52 -0.76 0.00 0.00 -1.17 -1.93 119.26 117.03 1ngf h ALA 179 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ngf h ALA 179 Cb -0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1ngf h ALA 179 CO -0.02 -0.01 0.49 0.00 0.00 0.00 0.00 179.25 179.70 1ngf h ALA 180 N 1.14 0.96 -0.02 0.00 0.00 -1.20 -1.92 119.26 118.21 1ngf h ALA 180 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ngf h ALA 180 Cb -0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1ngf h ALA 180 CO -0.03 0.39 -0.24 0.82 0.00 0.00 0.00 179.25 180.20 1ngf h ILE 181 N 1.03 1.18 -0.29 0.00 2.04 -1.01 -1.83 117.51 118.64 1ngf h ILE 181 Ca 0.28 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1ngf h ILE 181 Cb -0.09 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1ngf h ILE 181 CO -0.06 0.25 -0.00 0.00 0.00 0.00 0.00 178.15 178.34 1ngf h ALA 182 N 1.72 1.46 -0.02 1.87 0.00 -0.55 -2.29 119.26 121.46 1ngf h ALA 182 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ngf h ALA 182 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ngf h ALA 182 CO 0.03 0.39 -0.10 0.66 0.00 0.00 0.00 179.25 180.23 1ngf n TYR 183 N -4.31 0.00 -1.07 0.00 4.01 -0.90 -4.94 117.16 109.96 1ngf n TYR 183 Ca 0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.73 1ngf n TYR 183 Cb 0.22 -0.03 -0.01 0.00 -0.31 0.00 0.00 39.34 39.22 1ngf n TYR 183 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ngf n GLY 184 N 1.27 0.56 0.00 2.72 0.00 -0.86 -4.91 105.19 103.96 1ngf n GLY 184 Ca 0.16 -0.90 0.02 0.00 0.00 0.00 0.00 46.02 45.29 1ngf n GLY 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ngf n LEU 185 N -0.26 0.00 -0.30 0.99 4.77 -0.74 -2.50 117.00 118.97 1ngf n LEU 185 Ca -0.02 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.05 1ngf n LEU 185 Cb 0.08 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1ngf n LEU 185 CO 0.03 0.00 0.18 -0.90 -1.33 0.00 0.00 177.39 175.38 1ngf n ASP 186 N -0.56 1.54 -4.75 -1.43 5.75 -1.26 -4.96 116.55 110.88 1ngf n ASP 186 Ca 0.02 -1.27 -0.41 0.00 -0.01 0.00 0.00 54.79 53.13 1ngf n ASP 186 Cb 0.01 0.64 0.00 0.00 -1.03 0.00 0.00 41.12 40.75 1ngf n ASP 186 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ngf n LYS 187 N -0.50 2.40 -2.29 0.11 5.02 -1.04 -4.05 118.16 117.82 1ngf n LYS 187 Ca 0.07 0.85 -0.43 0.00 -2.02 0.00 0.00 58.31 56.77 1ngf n LYS 187 Cb 0.37 -2.57 -0.02 0.00 -0.02 0.00 0.00 35.03 32.78 1ngf n LYS 187 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ngf s LYS 188 N -2.16 3.67 0.00 1.97 1.02 -1.26 -4.71 119.74 118.27 1ngf s LYS 188 Ca 0.56 1.20 0.00 0.00 0.02 0.00 0.00 55.97 57.75 1ngf s LYS 188 Cb -0.49 -4.01 0.00 0.00 -0.52 0.00 0.00 37.83 32.81 1ngf s LYS 188 CO 0.61 -1.44 0.00 1.33 -0.92 0.00 0.00 175.35 174.94 1ngf n VAL 189 N 6.78 0.00 0.34 3.17 0.24 -1.26 -5.03 118.33 122.57 1ngf n VAL 189 Ca 0.17 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.58 1ngf n VAL 189 Cb 0.47 -0.86 -0.02 0.00 -1.47 0.00 0.00 33.84 31.96 1ngf n VAL 189 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ngf n GLY 190 N 5.00 -1.23 2.40 7.63 0.00 -1.26 -4.85 105.19 112.88 1ngf n GLY 190 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1ngf n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngf n ALA 191 N -2.00 0.50 -1.96 4.61 0.00 -1.26 -5.05 120.51 115.36 1ngf n ALA 191 Ca 0.00 -1.47 -0.41 0.00 0.00 0.00 0.00 53.44 51.57 1ngf n ALA 191 Cb 0.49 1.13 -0.03 0.00 0.00 0.00 0.00 19.45 21.04 1ngf n ALA 191 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ngf s GLU 192 N -3.04 4.43 -0.13 0.00 2.12 -1.26 -4.77 118.70 116.05 1ngf s GLU 192 Ca 0.26 2.02 0.02 0.00 0.36 0.00 0.00 54.97 57.62 1ngf s GLU 192 Cb 0.01 -3.19 0.02 0.00 0.26 0.00 0.00 34.13 31.23 1ngf s GLU 192 CO 0.18 -0.17 -0.17 0.50 -0.54 0.00 0.00 175.26 175.06 1ngf s ARG 193 N -0.49 2.45 -0.23 4.30 3.52 -0.26 -4.97 118.95 123.28 1ngf s ARG 193 Ca 0.54 -0.64 -0.12 0.00 -0.13 0.00 0.00 55.73 55.38 1ngf s ARG 193 Cb -0.36 -2.08 -0.05 0.00 -1.56 0.00 0.00 34.95 30.91 1ngf s ARG 193 CO 0.40 -0.09 0.24 -0.80 -0.81 0.00 0.00 175.30 174.25 1ngf s ASN 194 N 1.04 6.22 -0.01 -2.12 0.02 -1.26 -0.67 114.94 118.17 1ngf s ASN 194 Ca -0.04 0.25 0.08 0.00 -1.02 0.00 0.00 52.86 52.12 1ngf s ASN 194 Cb -0.15 -2.15 -0.02 0.00 0.02 0.00 0.00 41.25 38.96 1ngf s ASN 194 CO -0.04 0.02 -0.26 -0.69 0.02 0.00 0.00 177.10 176.15 1ngf s VAL 195 N 1.15 2.04 -0.22 1.60 1.01 0.20 -0.68 120.40 125.50 1ngf s VAL 195 Ca 0.11 -1.14 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1ngf s VAL 195 Cb -0.14 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.54 1ngf s VAL 195 CO 0.06 0.54 -0.06 -0.22 0.00 0.00 0.00 175.10 175.41 1ngf s LEU 196 N -0.71 2.88 -0.33 3.92 0.20 0.72 -0.76 118.68 124.62 1ngf s LEU 196 Ca 0.10 -0.51 -0.14 0.00 0.69 0.00 0.00 54.13 54.27 1ngf s LEU 196 Cb -0.10 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 43.94 1ngf s LEU 196 CO -0.00 -0.04 0.29 -0.63 -0.29 0.00 0.00 176.35 175.67 1ngf s ILE 197 N 1.43 5.24 -0.45 6.68 -1.09 0.13 -0.99 121.20 132.14 1ngf s ILE 197 Ca 0.05 0.01 -0.09 0.00 -2.23 0.00 0.00 60.65 58.38 1ngf s ILE 197 Cb -0.15 -3.72 0.11 0.00 -1.58 0.00 0.00 42.46 37.12 1ngf s ILE 197 CO -0.04 0.01 0.32 0.12 -1.23 0.00 0.00 174.94 174.12 1ngf s PHE 198 N 1.87 3.40 -0.29 3.97 2.19 -0.42 -1.61 117.98 127.08 1ngf s PHE 198 Ca 0.09 -1.75 -0.05 0.00 0.33 0.00 0.00 56.93 55.55 1ngf s PHE 198 Cb -0.17 -3.32 0.02 0.00 -1.31 0.00 0.00 43.02 38.24 1ngf s PHE 198 CO 0.11 -0.95 0.05 1.21 1.83 0.00 0.00 175.22 177.47 1ngf s ASN 199 N 2.50 4.96 -0.33 6.13 3.84 -0.06 -0.98 114.94 130.99 1ngf s ASN 199 Ca 0.05 -0.88 0.01 0.00 0.21 0.00 0.00 52.86 52.24 1ngf s ASN 199 Cb -0.25 -1.81 0.10 0.00 -0.55 0.00 0.00 41.25 38.74 1ngf s ASN 199 CO 0.00 -0.21 0.10 -0.22 -2.79 0.00 0.00 177.10 173.98 1ngf s LEU 200 N 1.42 2.95 0.00 3.21 2.96 -0.46 -0.45 118.68 128.31 1ngf s LEU 200 Ca 0.00 -1.88 0.00 0.00 -0.22 0.00 0.00 54.13 52.03 1ngf s LEU 200 Cb -0.18 -1.09 0.00 0.00 0.50 0.00 0.00 46.19 45.43 1ngf s LEU 200 CO 0.01 -0.39 0.00 0.61 -1.32 0.00 0.00 176.35 175.26 1ngf n GLY 201 N 4.55 1.80 0.22 7.98 0.00 -0.71 -1.87 105.19 117.16 1ngf n GLY 201 Ca 0.01 -1.80 -0.16 0.00 0.00 0.00 0.00 46.02 44.06 1ngf n GLY 201 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ngf h GLY 202 N 0.00 0.84 0.00 -0.02 0.00 -1.92 0.68 103.07 102.65 1ngf h GLY 202 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 47.33 46.21 1ngf h GLY 202 CO 0.00 1.00 0.00 0.61 0.00 0.00 0.00 176.54 178.15 1ngf n GLY 203 N 0.60 0.22 3.15 4.60 0.00 -1.26 -1.17 105.19 111.33 1ngf n GLY 203 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 1ngf n GLY 203 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ngf s THR 204 N -0.00 0.82 -0.10 2.61 -4.23 -1.12 -3.22 115.64 110.39 1ngf s THR 204 Ca 0.00 -1.60 -0.01 0.00 -1.18 0.00 0.00 61.69 58.90 1ngf s THR 204 Cb 0.00 -1.29 0.03 0.00 1.34 0.00 0.00 72.50 72.57 1ngf s THR 204 CO 0.00 -0.59 -0.06 0.12 -0.54 0.00 0.00 174.62 173.55 1ngf s PHE 205 N -2.50 1.26 0.04 3.99 5.36 0.11 -1.74 117.98 124.50 1ngf s PHE 205 Ca 0.04 -0.58 0.04 0.00 -0.96 0.00 0.00 56.93 55.47 1ngf s PHE 205 Cb -0.02 -1.11 -0.02 0.00 -0.34 0.00 0.00 43.02 41.52 1ngf s PHE 205 CO -0.01 -0.46 -0.13 0.34 -1.46 0.00 0.00 175.22 173.50 1ngf s ASP 206 N 1.77 1.56 -0.14 6.13 2.15 0.40 -0.12 116.67 128.41 1ngf s ASP 206 Ca 0.05 -0.44 -0.01 0.00 0.43 0.00 0.00 52.55 52.57 1ngf s ASP 206 Cb -0.12 -0.10 0.04 0.00 -0.30 0.00 0.00 42.92 42.44 1ngf s ASP 206 CO -0.07 0.02 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.24 1ngf s VAL 207 N -0.84 0.76 -0.03 1.11 1.01 0.16 -0.88 120.40 121.69 1ngf s VAL 207 Ca 0.01 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.65 1ngf s VAL 207 Cb -0.08 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 1ngf s VAL 207 CO 0.01 0.10 -0.18 -0.44 0.00 0.00 0.00 175.10 174.60 1ngf s SER 208 N 1.78 2.14 -0.23 3.32 0.01 -0.63 -0.70 113.70 119.40 1ngf s SER 208 Ca 0.02 -0.34 -0.04 0.00 1.31 0.00 0.00 55.95 56.90 1ngf s SER 208 Cb -0.15 -0.44 -0.01 0.00 0.21 0.00 0.00 66.02 65.64 1ngf s SER 208 CO -0.07 0.18 -0.04 -0.63 0.41 0.00 0.00 173.24 173.09 1ngf s ILE 209 N -0.17 3.37 0.08 1.44 1.01 -0.83 0.17 121.20 126.26 1ngf s ILE 209 Ca 0.01 -0.54 0.05 0.00 0.00 0.00 0.00 60.65 60.17 1ngf s ILE 209 Cb -0.09 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 1ngf s ILE 209 CO 0.01 0.39 -0.03 -0.76 0.00 0.00 0.00 174.94 174.55 1ngf s LEU 210 N 1.47 3.32 -0.20 2.97 1.43 0.07 -0.63 118.68 127.10 1ngf s LEU 210 Ca 0.05 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 1ngf s LEU 210 Cb -0.15 -2.04 0.04 0.00 0.03 0.00 0.00 46.19 44.07 1ngf s LEU 210 CO -0.03 0.20 -0.14 -0.89 0.23 0.00 0.00 176.35 175.71 1ngf s THR 211 N -1.23 1.90 -0.20 5.49 2.01 0.81 -0.63 115.64 123.80 1ngf s THR 211 Ca 0.23 -1.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.08 1ngf s THR 211 Cb -0.11 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.49 1ngf s THR 211 CO 0.15 0.27 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.72 1ngf s ILE 212 N 1.30 3.91 -0.05 1.82 1.01 0.15 -0.99 121.20 128.36 1ngf s ILE 212 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 60.65 60.30 1ngf s ILE 212 Cb -0.16 -2.77 0.04 0.00 0.01 0.00 0.00 42.46 39.58 1ngf s ILE 212 CO -0.09 0.43 0.09 -0.70 0.00 0.00 0.00 174.94 174.66 1ngf s GLU 213 N 1.03 0.00 -1.48 2.79 2.56 -0.71 -1.10 118.70 121.79 1ngf s GLU 213 Ca 0.02 0.34 -0.12 0.00 0.00 0.00 0.00 54.97 55.21 1ngf s GLU 213 Cb -0.14 -0.28 0.06 0.00 2.00 0.00 0.00 34.13 35.77 1ngf s GLU 213 CO 0.02 -0.22 0.95 -3.47 -0.56 0.00 0.00 175.26 171.98 1ngf n ASP 214 N 4.57 -5.18 0.00 -1.70 2.03 -1.26 -0.85 116.55 114.16 1ngf n ASP 214 Ca -0.19 -0.65 0.00 0.00 0.52 0.00 0.00 54.79 54.46 1ngf n ASP 214 Cb 0.50 -4.13 0.00 0.00 -0.72 0.00 0.00 41.12 36.77 1ngf n ASP 214 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ngf n GLY 215 N -1.70 2.32 3.68 0.27 0.00 -1.26 -4.96 105.19 103.54 1ngf n GLY 215 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1ngf n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ngf s ILE 216 N -1.46 4.81 0.33 -0.61 1.01 -0.03 -4.99 121.20 120.26 1ngf s ILE 216 Ca 0.00 1.87 -0.12 0.00 0.00 0.00 0.00 60.65 62.40 1ngf s ILE 216 Cb 0.00 -4.24 -0.08 0.00 0.01 0.00 0.00 42.46 38.15 1ngf s ILE 216 CO 0.00 -0.02 0.70 -0.36 0.00 0.00 0.00 174.94 175.26 1ngf s PHE 217 N 2.26 3.42 -0.18 3.97 0.40 -1.26 -1.74 117.98 124.85 1ngf s PHE 217 Ca 0.43 1.07 -0.04 0.00 -0.60 0.00 0.00 56.93 57.79 1ngf s PHE 217 Cb -0.17 -2.43 0.09 0.00 0.51 0.00 0.00 43.02 41.02 1ngf s PHE 217 CO 0.14 0.07 0.27 -2.00 0.70 0.00 0.00 175.22 174.40 1ngf s GLU 218 N -3.24 0.21 -0.46 0.44 2.12 -0.16 -4.95 118.70 112.66 1ngf s GLU 218 Ca 0.51 0.49 -0.29 0.00 0.36 0.00 0.00 54.97 56.05 1ngf s GLU 218 Cb -0.10 -0.59 0.03 0.00 0.26 0.00 0.00 34.13 33.73 1ngf s GLU 218 CO 0.23 -0.51 1.14 0.08 -0.54 0.00 0.00 175.26 175.66 1ngf s VAL 219 N 2.41 4.22 0.08 3.70 1.01 -1.26 -0.13 120.40 130.44 1ngf s VAL 219 Ca 0.06 1.27 -0.10 0.00 0.00 0.00 0.00 61.98 63.21 1ngf s VAL 219 Cb -0.14 -4.58 -0.25 0.00 0.00 0.00 0.00 36.38 31.40 1ngf s VAL 219 CO -0.12 -0.96 1.18 0.11 0.00 0.00 0.00 175.10 175.31 1ngf h LYS 220 N 9.15 0.50 -3.14 2.72 1.57 -1.22 -3.48 116.57 122.67 1ngf h LYS 220 Ca -0.23 -0.65 0.01 0.00 -1.87 0.00 0.00 60.65 57.92 1ngf h LYS 220 Cb 1.06 0.21 -0.08 0.00 0.08 0.00 0.00 32.23 33.50 1ngf h LYS 220 CO 1.12 1.27 0.14 0.45 -0.57 0.00 0.00 179.45 181.85 1ngf s SER 221 N -7.27 -0.31 -0.14 0.86 0.15 -1.22 -4.53 113.70 101.24 1ngf s SER 221 Ca -0.07 -0.46 -0.20 0.00 0.70 0.00 0.00 55.95 55.92 1ngf s SER 221 Cb 0.07 0.64 0.05 0.00 -1.71 0.00 0.00 66.02 65.07 1ngf s SER 221 CO 0.90 -1.16 0.51 0.42 1.20 0.00 0.00 173.24 175.12 1ngf s THR 222 N -3.88 0.01 0.28 6.45 -4.23 -1.26 -1.97 115.64 111.05 1ngf s THR 222 Ca 0.09 -0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.36 1ngf s THR 222 Cb -0.03 -0.76 0.01 0.00 1.34 0.00 0.00 72.50 73.07 1ngf s THR 222 CO -0.00 -0.04 0.61 0.00 -0.54 0.00 0.00 174.62 174.64 1ngf s ALA 223 N -0.22 -0.63 0.00 3.99 0.00 0.12 -4.85 121.76 120.18 1ngf s ALA 223 Ca -0.04 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1ngf s ALA 223 Cb -0.03 0.95 0.00 0.00 0.00 0.00 0.00 23.12 24.03 1ngf s ALA 223 CO 0.03 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.26 1ngf n GLY 224 N -0.44 0.25 3.36 0.00 0.00 -1.26 0.38 105.19 107.48 1ngf n GLY 224 Ca -0.03 -1.39 -0.08 0.00 0.00 0.00 0.00 46.02 44.52 1ngf n GLY 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ngf s ASP 225 N -4.00 -0.52 0.00 1.61 -1.08 0.83 -4.99 116.67 108.52 1ngf s ASP 225 Ca 0.00 1.10 0.30 0.00 -0.52 0.00 0.00 52.55 53.43 1ngf s ASP 225 Cb 0.00 1.32 1.77 0.00 -1.46 0.00 0.00 42.92 44.55 1ngf s ASP 225 CO 0.00 -0.22 2.12 0.35 0.52 0.00 0.00 175.17 177.94 1ngf n THR 226 N 4.97 0.01 -2.35 1.71 -2.24 -1.26 0.09 114.28 115.20 1ngf n THR 226 Ca -0.14 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.55 1ngf n THR 226 Cb 0.52 -0.53 0.05 0.00 -2.10 0.00 0.00 70.33 68.27 1ngf n THR 226 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1ngf n HIS 227 N -1.04 1.67 -3.75 4.78 8.25 -1.25 -4.48 115.22 119.41 1ngf n HIS 227 Ca 0.22 -1.98 -0.20 0.00 -0.26 0.00 0.00 57.72 55.50 1ngf n HIS 227 Cb 0.12 -0.27 -0.17 0.00 1.12 0.00 0.00 29.99 30.78 1ngf n HIS 227 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ngf s LEU 228 N -3.34 0.48 0.00 2.41 1.98 -1.20 -5.00 118.68 114.01 1ngf s LEU 228 Ca 0.39 0.01 -0.08 0.00 -2.89 0.00 0.00 54.13 51.55 1ngf s LEU 228 Cb 0.37 -0.25 0.03 0.00 0.66 0.00 0.00 46.19 47.00 1ngf s LEU 228 CO -0.02 -0.20 0.42 0.61 -1.89 0.00 0.00 176.35 175.27 1ngf n GLY 229 N 5.03 1.30 0.33 7.98 0.00 -1.26 -2.72 105.19 115.85 1ngf n GLY 229 Ca -0.09 -1.09 0.20 0.00 0.00 0.00 0.00 46.02 45.04 1ngf n GLY 229 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ngf h GLY 230 N 0.94 0.00 1.81 -0.02 0.00 0.67 -0.58 103.07 105.89 1ngf h GLY 230 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.07 1ngf h GLY 230 CO 0.19 0.00 -0.46 0.83 0.00 0.00 0.00 176.54 177.10 1ngf h GLU 231 N 0.00 0.21 -0.15 4.80 5.08 -1.47 -2.75 114.58 120.30 1ngf h GLU 231 Ca 0.01 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 1ngf h GLU 231 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1ngf h GLU 231 CO -0.00 0.63 -0.37 -0.44 -1.00 0.00 0.00 179.01 177.83 1ngf h ASP 232 N 0.17 0.34 -0.28 1.42 5.19 -1.35 -2.08 116.42 119.84 1ngf h ASP 232 Ca 0.01 -0.14 -0.14 0.00 -0.62 0.00 0.00 57.03 56.15 1ngf h ASP 232 Cb 0.88 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.28 1ngf h ASP 232 CO 0.07 0.69 -0.32 -0.26 -3.12 0.00 0.00 179.24 176.30 1ngf h PHE 233 N 0.28 0.94 -0.54 4.55 0.04 -1.56 -2.71 116.94 117.94 1ngf h PHE 233 Ca 0.03 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.54 1ngf h PHE 233 Cb 0.79 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.70 1ngf h PHE 233 CO 0.02 1.02 0.32 -0.44 -0.60 0.00 0.00 178.31 178.62 1ngf h ASP 234 N 0.68 0.67 -0.36 2.17 3.32 -1.22 -2.91 116.42 118.77 1ngf h ASP 234 Ca 0.07 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.11 1ngf h ASP 234 Cb 0.86 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.19 1ngf h ASP 234 CO 0.08 0.54 0.04 0.78 -1.72 0.00 0.00 179.24 178.96 1ngf h ASN 235 N 0.73 -0.05 -0.79 6.45 2.35 -1.11 -0.45 115.58 122.70 1ngf h ASN 235 Ca 0.19 0.07 0.09 0.00 -0.55 0.00 0.00 56.30 56.10 1ngf h ASN 235 Cb 0.01 0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 1ngf h ASN 235 CO -0.03 0.01 0.51 0.03 -1.65 0.00 0.00 177.43 176.30 1ngf h ARG 236 N 0.15 0.72 -0.08 0.81 2.47 -1.30 0.77 114.38 117.92 1ngf h ARG 236 Ca 0.17 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1ngf h ARG 236 Cb 0.22 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 1ngf h ARG 236 CO -0.25 0.48 -0.07 0.52 0.56 0.00 0.00 179.97 181.21 1ngf h MET 237 N 0.74 0.19 0.01 0.04 2.86 -1.13 -2.58 114.93 115.06 1ngf h MET 237 Ca 0.36 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.94 1ngf h MET 237 Cb 0.41 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.02 1ngf h MET 237 CO -0.13 0.60 -0.31 0.28 1.06 0.00 0.00 176.91 178.41 1ngf h VAL 238 N -0.23 0.33 -0.02 -2.22 2.07 0.03 0.11 116.25 116.32 1ngf h VAL 238 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1ngf h VAL 238 Cb 0.56 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1ngf h VAL 238 CO 0.02 0.00 0.01 0.78 0.02 0.00 0.00 177.57 178.40 1ngf h ASN 239 N -0.46 0.00 -0.14 0.57 -0.26 -0.96 0.35 115.58 114.67 1ngf h ASN 239 Ca 0.06 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.63 1ngf h ASN 239 Cb 0.54 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.81 1ngf h ASN 239 CO -0.25 0.00 -0.57 -0.74 -1.06 0.00 0.00 177.43 174.81 1ngf h HIS 240 N 0.00 0.84 0.00 1.19 2.76 -0.72 -2.89 115.15 116.34 1ngf h HIS 240 Ca 0.01 -0.36 -0.12 0.00 -2.20 0.00 0.00 60.37 57.70 1ngf h HIS 240 Cb 0.03 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 1ngf h HIS 240 CO 0.00 1.15 -0.57 0.74 -1.30 0.00 0.00 177.93 177.95 1ngf h PHE 241 N 0.29 0.00 -0.58 5.26 0.04 0.40 -2.32 116.94 120.03 1ngf h PHE 241 Ca -0.03 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.64 1ngf h PHE 241 Cb 1.20 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.33 1ngf h PHE 241 CO 0.10 0.57 -0.03 0.82 -0.60 0.00 0.00 178.31 179.18 1ngf h ILE 242 N 0.00 1.26 -0.43 -0.55 2.04 -1.01 0.80 117.51 119.63 1ngf h ILE 242 Ca -0.01 -1.17 -0.06 0.00 1.00 0.00 0.00 64.86 64.62 1ngf h ILE 242 Cb 1.21 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1ngf h ILE 242 CO 0.07 0.42 0.04 0.00 0.00 0.00 0.00 178.15 178.68 1ngf h ALA 243 N 1.02 0.57 -0.60 1.87 0.00 -1.39 -1.66 119.26 119.06 1ngf h ALA 243 Ca 0.16 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1ngf h ALA 243 Cb 0.58 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ngf h ALA 243 CO 0.03 0.32 0.13 1.49 0.00 0.00 0.00 179.25 181.23 1ngf h GLU 244 N 0.58 0.98 -0.25 0.00 4.81 -1.11 -1.00 114.58 118.59 1ngf h GLU 244 Ca 0.13 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1ngf h GLU 244 Cb 0.43 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1ngf h GLU 244 CO 0.01 0.91 0.14 0.35 -0.73 0.00 0.00 179.01 179.68 1ngf h PHE 245 N 0.89 0.35 -0.76 0.92 3.57 -0.72 -1.15 116.94 120.05 1ngf h PHE 245 Ca 0.19 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1ngf h PHE 245 Cb 0.38 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 1ngf h PHE 245 CO 0.03 0.31 0.49 -0.22 -2.23 0.00 0.00 178.31 176.68 1ngf h LYS 246 N 0.29 0.93 -0.42 1.11 3.64 -1.09 0.44 116.57 121.48 1ngf h LYS 246 Ca 0.09 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1ngf h LYS 246 Cb 0.08 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1ngf h LYS 246 CO -0.01 0.62 -0.15 -0.09 -2.27 0.00 0.00 179.45 177.54 1ngf h ARG 247 N 0.96 0.84 0.00 1.90 2.43 -0.96 0.86 114.38 120.42 1ngf h ARG 247 Ca 0.30 -0.35 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1ngf h ARG 247 Cb -0.02 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 1ngf h ARG 247 CO -0.10 0.98 -0.74 -0.22 -1.51 0.00 0.00 179.97 178.39 1ngf h LYS 248 N 0.66 0.00 0.00 0.20 3.64 -0.90 -3.37 116.57 116.80 1ngf h LYS 248 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1ngf h LYS 248 Cb 0.70 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1ngf h LYS 248 CO 0.05 0.64 0.00 0.72 -2.27 0.00 0.00 179.45 178.59 1ngf n HIS 249 N -3.24 0.00 -0.80 1.91 8.25 0.15 -5.00 115.22 116.49 1ngf n HIS 249 Ca 0.00 -0.20 -0.01 0.00 -0.26 0.00 0.00 57.72 57.26 1ngf n HIS 249 Cb 0.81 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.90 1ngf n HIS 249 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1ngf n LYS 250 N -0.20 -1.97 -4.04 -0.41 4.01 0.30 -4.92 118.16 110.93 1ngf n LYS 250 Ca 0.00 0.41 -0.35 0.00 -0.51 0.00 0.00 58.31 57.86 1ngf n LYS 250 Cb 0.25 -4.45 -0.13 0.00 -0.51 0.00 0.00 35.03 30.19 1ngf n LYS 250 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1ngf s LYS 251 N -1.62 3.55 -0.26 1.97 -0.14 -1.25 -4.98 119.74 117.02 1ngf s LYS 251 Ca 0.00 -0.55 -0.21 0.00 -1.36 0.00 0.00 55.97 53.85 1ngf s LYS 251 Cb 0.00 -3.06 -0.02 0.00 -1.68 0.00 0.00 37.83 33.07 1ngf s LYS 251 CO 0.00 -0.05 0.66 0.34 -0.76 0.00 0.00 175.35 175.55 1ngf s ASP 252 N 1.14 6.62 0.00 2.83 2.15 -1.26 -3.59 116.67 124.55 1ngf s ASP 252 Ca 0.02 0.75 0.23 0.00 0.43 0.00 0.00 52.55 53.98 1ngf s ASP 252 Cb -0.14 -2.35 0.52 0.00 -0.30 0.00 0.00 42.92 40.64 1ngf s ASP 252 CO 0.01 -0.40 1.44 2.30 -0.17 0.00 0.00 175.17 178.35 1ngf n ILE 253 N 5.22 0.30 -0.31 4.11 -5.35 -1.26 -4.51 119.36 117.55 1ngf n ILE 253 Ca 0.00 -0.56 0.10 0.00 -0.27 0.00 0.00 62.75 62.02 1ngf n ILE 253 Cb 0.49 0.87 0.26 0.00 -1.74 0.00 0.00 39.64 39.52 1ngf n ILE 253 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1ngf h SER 254 N 3.74 0.58 -0.62 7.28 0.02 -1.95 -2.04 113.55 120.57 1ngf h SER 254 Ca 0.00 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1ngf h SER 254 Cb 0.82 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.33 1ngf h SER 254 CO 0.00 0.21 0.30 1.05 -1.14 0.00 0.00 176.83 177.26 1ngf h GLU 255 N 0.64 0.92 -6.25 3.45 -0.00 -2.03 -3.40 114.58 107.92 1ngf h GLU 255 Ca 0.51 -0.12 -0.53 0.00 -0.00 0.00 0.00 59.36 59.22 1ngf h GLU 255 Cb 0.77 -0.17 -0.07 0.00 -0.00 0.00 0.00 28.75 29.28 1ngf h GLU 255 CO -0.39 0.72 1.14 1.21 -0.00 0.00 0.00 179.01 181.70 1ngf s ASN 256 N -6.47 5.91 0.59 3.06 3.84 -0.77 -4.87 114.94 116.24 1ngf s ASN 256 Ca -0.10 -0.20 0.30 0.00 0.21 0.00 0.00 52.86 53.07 1ngf s ASN 256 Cb 0.16 -2.55 1.83 0.00 -0.55 0.00 0.00 41.25 40.14 1ngf s ASN 256 CO 0.79 -1.99 2.26 0.11 -2.79 0.00 0.00 177.10 175.48 1ngf h LYS 257 N 11.46 0.00 0.06 0.43 6.56 -1.83 -2.37 116.57 130.88 1ngf h LYS 257 Ca -0.27 0.00 -0.20 0.00 -1.06 0.00 0.00 60.65 59.12 1ngf h LYS 257 Cb 1.08 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.76 1ngf h LYS 257 CO 1.26 0.00 -0.82 -0.09 -2.06 0.00 0.00 179.45 177.74 1ngf h ARG 258 N 0.00 0.46 -0.33 3.15 2.43 -1.89 -2.58 114.38 115.62 1ngf h ARG 258 Ca -0.00 -0.57 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 1ngf h ARG 258 Cb 0.01 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1ngf h ARG 258 CO 0.00 1.21 0.21 0.00 -1.51 0.00 0.00 179.97 179.88 1ngf h ALA 259 N 0.27 0.41 -0.27 2.80 0.00 -1.69 -0.93 119.26 119.85 1ngf h ALA 259 Ca -0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ngf h ALA 259 Cb 1.54 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1ngf h ALA 259 CO 0.16 -0.11 0.16 0.28 0.00 0.00 0.00 179.25 179.74 1ngf h VAL 260 N 0.43 1.10 -0.36 0.00 2.07 -1.54 -0.41 116.25 117.53 1ngf h VAL 260 Ca 0.12 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1ngf h VAL 260 Cb -0.03 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1ngf h VAL 260 CO -0.02 0.09 -0.01 -0.09 0.02 0.00 0.00 177.57 177.56 1ngf h ARG 261 N 0.34 0.57 -0.22 1.57 2.43 -1.28 0.11 114.38 117.90 1ngf h ARG 261 Ca 0.10 -0.13 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1ngf h ARG 261 Cb 0.01 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1ngf h ARG 261 CO -0.02 0.60 -0.49 0.00 -1.51 0.00 0.00 179.97 178.55 1ngf h ARG 262 N 0.54 0.59 -0.38 0.20 3.08 -0.75 -2.42 114.38 115.23 1ngf h ARG 262 Ca 0.11 -0.34 -0.11 0.00 0.07 0.00 0.00 59.98 59.71 1ngf h ARG 262 Cb 0.37 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1ngf h ARG 262 CO 0.01 0.95 -0.20 1.25 -1.07 0.00 0.00 179.97 180.91 1ngf h LEU 263 N 0.46 0.84 -0.72 3.04 5.85 -0.50 -2.60 115.31 121.68 1ngf h LEU 263 Ca 0.02 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.35 1ngf h LEU 263 Cb 1.02 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1ngf h LEU 263 CO 0.10 1.06 0.46 -0.09 -0.34 0.00 0.00 178.44 179.63 1ngf h ARG 264 N 0.61 0.89 -0.61 1.25 2.43 -0.91 0.13 114.38 118.17 1ngf h ARG 264 Ca 0.08 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1ngf h ARG 264 Cb 0.76 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1ngf h ARG 264 CO 0.06 0.59 0.29 1.15 -1.51 0.00 0.00 179.97 180.54 1ngf h THR 265 N 0.92 1.20 -0.37 0.20 2.02 -1.32 0.54 112.91 116.10 1ngf h THR 265 Ca 0.28 -0.58 -0.15 0.00 0.77 0.00 0.00 66.41 66.73 1ngf h THR 265 Cb -0.02 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1ngf h THR 265 CO -0.09 0.24 -0.38 0.00 0.37 0.00 0.00 175.52 175.66 1ngf h ALA 266 N 1.45 0.63 -0.21 6.16 0.00 -0.87 -2.84 119.26 123.58 1ngf h ALA 266 Ca 0.21 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1ngf h ALA 266 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ngf h ALA 266 CO -0.03 0.67 0.01 0.00 0.00 0.00 0.00 179.25 179.91 1ngf h GLU 268 N 0.14 0.83 -0.08 0.00 4.22 -0.94 0.17 114.58 118.93 1ngf h GLU 268 Ca 0.06 -0.05 -0.19 0.00 0.08 0.00 0.00 59.36 59.26 1ngf h GLU 268 Cb 0.37 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.44 1ngf h GLU 268 CO 0.01 0.55 -0.70 -0.09 -2.18 0.00 0.00 179.01 176.60 1ngf h ARG 269 N 0.86 0.62 -0.34 1.92 2.43 -1.35 -2.96 114.38 115.56 1ngf h ARG 269 Ca 0.30 -0.56 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1ngf h ARG 269 Cb 0.12 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1ngf h ARG 269 CO -0.09 1.17 0.01 0.00 -1.51 0.00 0.00 179.97 179.55 1ngf h ALA 270 N 0.45 1.39 -0.68 2.80 0.00 -0.51 -2.59 119.26 120.12 1ngf h ALA 270 Ca -0.07 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1ngf h ALA 270 Cb 1.36 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1ngf h ALA 270 CO 0.14 0.43 0.45 -0.22 0.00 0.00 0.00 179.25 180.05 1ngf h LYS 271 N 0.50 0.88 -0.49 0.00 3.64 -0.61 -1.30 116.57 119.20 1ngf h LYS 271 Ca 0.11 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1ngf h LYS 271 Cb 0.31 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1ngf h LYS 271 CO 0.01 0.58 0.14 0.00 -2.27 0.00 0.00 179.45 177.90 1ngf h ARG 272 N 0.90 0.77 -0.91 1.90 3.08 -1.30 -2.76 114.38 116.05 1ngf h ARG 272 Ca 0.25 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 60.15 1ngf h ARG 272 Cb -0.08 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 29.81 1ngf h ARG 272 CO -0.06 0.73 0.60 1.15 -1.07 0.00 0.00 179.97 181.32 1ngf h THR 273 N 0.66 1.20 -0.01 2.04 2.02 -1.21 -1.64 112.91 115.97 1ngf h THR 273 Ca 0.15 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1ngf h THR 273 Cb 0.30 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.60 1ngf h THR 273 CO -0.00 0.22 0.07 -0.07 0.37 0.00 0.00 175.52 176.11 1ngf h LEU 274 N 1.20 0.00 -0.22 2.58 4.07 -0.95 0.30 115.31 122.30 1ngf h LEU 274 Ca 0.35 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.31 1ngf h LEU 274 Cb -0.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.65 1ngf h LEU 274 CO -0.09 0.00 0.00 -1.20 -1.08 0.00 0.00 178.44 176.07 1ngf n SER 275 N -3.17 0.60 -0.00 -0.43 7.64 -0.61 -3.96 113.62 113.68 1ngf n SER 275 Ca -0.02 0.59 -0.00 0.00 1.01 0.00 0.00 58.87 60.44 1ngf n SER 275 Cb 0.14 -0.74 -0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1ngf n SER 275 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ngf n SER 276 N -2.10 4.57 -4.90 6.43 7.64 0.01 -4.75 113.62 120.53 1ngf n SER 276 Ca 0.05 -0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.71 1ngf n SER 276 Cb 0.34 0.29 -0.02 0.00 -1.01 0.00 0.00 64.21 63.81 1ngf n SER 276 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ngf s SER 277 N -3.42 5.05 0.00 6.43 0.01 0.85 -5.04 113.70 117.58 1ngf s SER 277 Ca -0.00 -0.79 0.24 0.00 1.31 0.00 0.00 55.95 56.71 1ngf s SER 277 Cb 0.00 -0.41 0.23 0.00 0.21 0.00 0.00 66.02 66.04 1ngf s SER 277 CO 0.00 -0.75 1.23 0.35 0.41 0.00 0.00 173.24 174.48 1ngf n THR 278 N -1.64 0.00 -3.56 1.44 -2.24 -1.26 -4.41 114.28 102.61 1ngf n THR 278 Ca 0.04 -0.16 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 1ngf n THR 278 Cb 0.62 0.89 -0.05 0.00 -2.10 0.00 0.00 70.33 69.68 1ngf n THR 278 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ngf s GLN 279 N -2.60 0.70 0.05 -0.78 -2.07 -1.26 0.10 119.66 113.80 1ngf s GLN 279 Ca 0.18 0.16 0.01 0.00 -1.82 0.00 0.00 55.36 53.89 1ngf s GLN 279 Cb 0.18 0.33 -0.03 0.00 -1.09 0.00 0.00 33.01 32.40 1ngf s GLN 279 CO 0.61 -0.22 -0.05 0.00 -1.32 0.00 0.00 175.29 174.31 1ngf s ALA 280 N -1.15 0.51 0.01 2.60 0.00 -0.45 -4.86 121.76 118.42 1ngf s ALA 280 Ca -0.04 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1ngf s ALA 280 Cb -0.00 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1ngf s ALA 280 CO 0.03 -0.17 0.12 -1.54 0.00 0.00 0.00 175.76 174.20 1ngf s SER 281 N -2.09 5.91 -0.24 0.00 1.04 -1.26 -1.18 113.70 115.88 1ngf s SER 281 Ca -0.04 0.19 -0.05 0.00 0.48 0.00 0.00 55.95 56.53 1ngf s SER 281 Cb -0.04 -1.74 -0.01 0.00 0.10 0.00 0.00 66.02 64.34 1ngf s SER 281 CO -0.03 0.25 -0.01 -0.63 0.98 0.00 0.00 173.24 173.80 1ngf s ILE 282 N -1.28 3.54 -0.27 -1.02 -1.09 0.14 -4.90 121.20 116.31 1ngf s ILE 282 Ca 0.26 -0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.16 1ngf s ILE 282 Cb -0.12 -2.66 0.08 0.00 -1.58 0.00 0.00 42.46 38.18 1ngf s ILE 282 CO 0.17 0.35 0.02 -0.70 -1.23 0.00 0.00 174.94 173.56 1ngf s GLU 283 N 1.49 1.19 -0.25 2.79 2.12 -1.25 -0.97 118.70 123.81 1ngf s GLU 283 Ca 0.05 -1.11 0.00 0.00 0.36 0.00 0.00 54.97 54.27 1ngf s GLU 283 Cb -0.15 -2.45 0.07 0.00 0.26 0.00 0.00 34.13 31.86 1ngf s GLU 283 CO -0.02 -0.79 0.00 0.42 -0.54 0.00 0.00 175.26 174.34 1ngf s ILE 284 N 1.43 1.30 0.17 -3.70 1.01 -0.35 -5.00 121.20 116.07 1ngf s ILE 284 Ca 0.03 -1.24 -0.31 0.00 0.00 0.00 0.00 60.65 59.13 1ngf s ILE 284 Cb -0.18 -1.72 -0.09 0.00 0.01 0.00 0.00 42.46 40.48 1ngf s ILE 284 CO -0.13 -0.28 1.38 -1.81 0.00 0.00 0.00 174.94 174.10 1ngf s ASP 285 N 1.47 6.81 -1.17 3.58 1.01 -1.26 -0.17 116.67 126.94 1ngf s ASP 285 Ca -0.00 2.43 -0.18 0.00 0.71 0.00 0.00 52.55 55.50 1ngf s ASP 285 Cb -0.18 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.14 1ngf s ASP 285 CO -0.10 -0.62 0.75 -1.20 0.21 0.00 0.00 175.17 174.21 1ngf n SER 286 N 3.15 -4.64 -0.06 0.27 7.64 -1.23 -4.90 113.62 113.86 1ngf n SER 286 Ca 0.09 -1.01 -0.12 0.00 1.01 0.00 0.00 58.87 58.83 1ngf n SER 286 Cb 0.42 -3.34 -0.06 0.00 -1.01 0.00 0.00 64.21 60.22 1ngf n SER 286 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1ngf h LEU 287 N -1.90 0.32 -7.51 -3.43 7.12 -0.65 -3.43 115.31 105.83 1ngf h LEU 287 Ca -0.66 -0.37 -0.37 0.00 0.13 0.00 0.00 57.88 56.61 1ngf h LEU 287 Cb 1.36 -0.09 -0.36 0.00 -0.53 0.00 0.00 40.66 41.04 1ngf h LEU 287 CO 0.50 0.61 -0.75 -0.47 -0.13 0.00 0.00 178.44 178.20 1ngf s TYR 288 N -4.75 0.35 0.00 1.25 5.04 -1.16 -4.59 117.35 113.48 1ngf s TYR 288 Ca -0.14 0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.51 1ngf s TYR 288 Cb 0.06 -0.52 0.00 0.00 0.35 0.00 0.00 41.96 41.85 1ngf s TYR 288 CO 0.73 -0.19 0.00 0.39 -1.34 0.00 0.00 175.55 175.14 1ngf n GLU 289 N 4.64 0.00 -0.18 4.97 1.02 -1.26 -0.86 120.64 128.96 1ngf n GLU 289 Ca -0.17 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.09 1ngf n GLU 289 Cb 0.50 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.17 1ngf n GLU 289 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ngf n GLY 290 N 0.00 1.50 3.66 0.62 0.00 -1.26 -4.71 105.19 104.99 1ngf n GLY 290 Ca 0.00 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1ngf n GLY 290 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ngf s ILE 291 N -1.51 4.28 0.46 -0.61 1.01 -0.04 -4.51 121.20 120.28 1ngf s ILE 291 Ca 0.38 1.53 -0.16 0.00 0.00 0.00 0.00 60.65 62.41 1ngf s ILE 291 Cb 0.22 -4.03 -0.08 0.00 0.01 0.00 0.00 42.46 38.58 1ngf s ILE 291 CO 0.30 -0.18 0.91 -1.81 0.00 0.00 0.00 174.94 174.17 1ngf s ASP 292 N 2.05 6.65 -0.35 3.58 1.01 -1.26 -0.19 116.67 128.16 1ngf s ASP 292 Ca 0.55 1.47 0.03 0.00 0.71 0.00 0.00 52.55 55.30 1ngf s ASP 292 Cb -0.21 -2.46 0.10 0.00 1.01 0.00 0.00 42.92 41.36 1ngf s ASP 292 CO 0.15 -0.49 0.09 0.12 0.21 0.00 0.00 175.17 175.25 1ngf s PHE 293 N -2.46 3.17 -0.23 4.23 5.36 0.76 -4.83 117.98 123.99 1ngf s PHE 293 Ca 0.57 -2.71 -0.03 0.00 -0.96 0.00 0.00 56.93 53.80 1ngf s PHE 293 Cb -0.10 -2.60 0.00 0.00 -0.34 0.00 0.00 43.02 39.98 1ngf s PHE 293 CO 0.28 -0.91 -0.05 0.71 -1.46 0.00 0.00 175.22 173.79 1ngf s TYR 294 N 0.94 2.99 0.00 10.12 1.51 -1.26 -1.21 117.35 130.44 1ngf s TYR 294 Ca 0.11 -1.11 0.00 0.00 -1.01 0.00 0.00 57.07 55.06 1ngf s TYR 294 Cb -0.19 -2.10 0.00 0.00 -0.11 0.00 0.00 41.96 39.56 1ngf s TYR 294 CO -0.11 -0.61 0.00 -2.37 -1.11 0.00 0.00 175.55 171.35 1ngf n THR 295 N 4.77 0.00 -3.52 -0.71 5.66 -0.15 -5.01 114.28 115.32 1ngf n THR 295 Ca -0.18 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.73 1ngf n THR 295 Cb 0.50 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.26 1ngf n THR 295 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1ngf s SER 296 N -0.22 -0.43 0.23 1.09 1.04 -1.26 0.25 113.70 114.40 1ngf s SER 296 Ca 0.00 -0.09 0.08 0.00 0.48 0.00 0.00 55.95 56.41 1ngf s SER 296 Cb 0.00 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 1ngf s SER 296 CO 0.00 -0.87 -0.12 -0.63 0.98 0.00 0.00 173.24 172.60 1ngf s ILE 297 N -3.49 1.73 0.30 -1.02 1.09 -0.33 -4.95 121.20 114.53 1ngf s ILE 297 Ca 0.04 -2.20 0.09 0.00 -1.10 0.00 0.00 60.65 57.48 1ngf s ILE 297 Cb -0.01 -2.15 -0.04 0.00 -1.06 0.00 0.00 42.46 39.19 1ngf s ILE 297 CO -0.08 -0.52 0.10 0.42 -0.10 0.00 0.00 174.94 174.77 1ngf s THR 298 N -2.97 3.37 0.29 2.92 -4.23 -1.26 -1.34 115.64 112.42 1ngf s THR 298 Ca 0.24 -1.72 0.01 0.00 -1.18 0.00 0.00 61.69 59.04 1ngf s THR 298 Cb 0.00 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 70.98 1ngf s THR 298 CO 0.08 -0.27 1.81 -0.09 -0.54 0.00 0.00 174.62 175.62 1ngf h ARG 299 N 1.64 0.70 0.23 3.99 2.43 0.37 -0.93 114.38 122.82 1ngf h ARG 299 Ca -0.44 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 58.55 1ngf h ARG 299 Cb 1.25 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1ngf h ARG 299 CO 0.62 0.70 -0.11 0.00 -1.51 0.00 0.00 179.97 179.66 1ngf h ALA 300 N 1.36 -0.31 -0.74 2.80 0.00 -1.95 0.65 119.26 121.07 1ngf h ALA 300 Ca 0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1ngf h ALA 300 Cb 0.38 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1ngf h ALA 300 CO 0.01 -0.68 0.40 0.00 0.00 0.00 0.00 179.25 178.99 1ngf h ARG 301 N -0.31 1.04 0.09 0.00 2.47 -1.90 -1.86 114.38 113.91 1ngf h ARG 301 Ca -0.03 -0.13 0.00 0.00 -1.26 0.00 0.00 59.98 58.57 1ngf h ARG 301 Cb 0.24 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.35 1ngf h ARG 301 CO 0.05 0.78 -0.09 0.35 0.56 0.00 0.00 179.97 181.61 1ngf h PHE 302 N 1.03 -0.24 -0.77 3.04 3.57 -0.82 -0.24 116.94 122.50 1ngf h PHE 302 Ca 0.26 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.82 1ngf h PHE 302 Cb 0.05 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.82 1ngf h PHE 302 CO 0.00 -0.15 0.46 0.93 -2.23 0.00 0.00 178.31 177.33 1ngf h GLU 303 N -0.21 0.83 -0.77 1.11 5.08 -0.73 -1.90 114.58 117.99 1ngf h GLU 303 Ca 0.01 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1ngf h GLU 303 Cb 0.20 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1ngf h GLU 303 CO -0.03 0.55 0.51 1.49 -1.00 0.00 0.00 179.01 180.53 1ngf h GLU 304 N 0.85 1.02 0.00 2.33 4.81 -0.86 0.99 114.58 123.72 1ngf h GLU 304 Ca 0.34 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 1ngf h GLU 304 Cb 0.17 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 1ngf h GLU 304 CO -0.17 0.68 -0.13 -0.07 -0.73 0.00 0.00 179.01 178.58 1ngf h LEU 305 N 1.05 0.00 -3.03 1.64 3.38 -0.24 -3.02 115.31 115.08 1ngf h LEU 305 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1ngf h LEU 305 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1ngf h LEU 305 CO -0.06 0.13 0.00 0.59 0.09 0.00 0.00 178.44 179.19 1ngf n ASN 306 N -4.34 2.83 -0.21 -0.43 4.13 -0.95 -4.82 115.26 111.46 1ngf n ASN 306 Ca -0.03 -2.48 0.01 0.00 1.68 0.00 0.00 54.58 53.77 1ngf n ASN 306 Cb 0.20 -0.29 0.10 0.00 -1.54 0.00 0.00 39.78 38.25 1ngf n ASN 306 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ngf h ALA 307 N 1.06 0.60 -0.53 5.41 0.00 -0.68 0.49 119.26 125.61 1ngf h ALA 307 Ca 0.00 0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1ngf h ALA 307 Cb 0.91 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1ngf h ALA 307 CO 0.06 -0.40 -0.01 0.38 0.00 0.00 0.00 179.25 179.27 1ngf h ASP 308 N 0.10 0.89 -0.16 0.00 2.03 -1.87 -1.39 116.42 116.01 1ngf h ASP 308 Ca 0.33 -0.24 -0.03 0.00 -0.73 0.00 0.00 57.03 56.36 1ngf h ASP 308 Cb 0.53 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1ngf h ASP 308 CO -0.56 0.96 -0.01 -0.07 -1.03 0.00 0.00 179.24 178.53 1ngf h LEU 309 N 0.84 0.29 0.23 0.15 4.07 -1.61 -0.99 115.31 118.29 1ngf h LEU 309 Ca 0.15 -0.33 -0.01 0.00 0.08 0.00 0.00 57.88 57.78 1ngf h LEU 309 Cb 0.52 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1ngf h LEU 309 CO 0.03 0.55 -0.11 -0.26 -1.08 0.00 0.00 178.44 177.56 1ngf h PHE 310 N 0.03 -0.29 -0.72 1.13 0.04 -0.87 -3.10 116.94 113.16 1ngf h PHE 310 Ca 0.04 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.82 1ngf h PHE 310 Cb 0.41 0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.62 1ngf h PHE 310 CO 0.04 -0.17 0.47 -0.09 -0.60 0.00 0.00 178.31 177.97 1ngf h ARG 311 N -0.33 0.93 0.00 1.51 2.43 -1.27 -1.94 114.38 115.70 1ngf h ARG 311 Ca -0.03 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1ngf h ARG 311 Cb 0.26 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1ngf h ARG 311 CO 0.05 0.61 0.00 0.41 -1.51 0.00 0.00 179.97 179.54 1ngf n GLY 312 N -1.30 -0.73 0.28 2.80 0.00 -0.38 -1.75 105.19 104.12 1ngf n GLY 312 Ca 0.07 -0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.25 1ngf n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngf h THR 313 N 0.00 0.14 0.00 2.61 1.03 -1.28 -2.70 112.91 112.71 1ngf h THR 313 Ca 0.00 -0.47 -0.04 0.00 -0.01 0.00 0.00 66.41 65.89 1ngf h THR 313 Cb 0.11 1.41 -0.01 0.00 -1.07 0.00 0.00 68.15 68.59 1ngf h THR 313 CO 0.00 0.04 -0.19 -0.07 -0.01 0.00 0.00 175.52 175.29 1ngf h LEU 314 N 0.00 0.00 0.07 0.00 3.38 -1.52 -3.33 115.31 113.91 1ngf h LEU 314 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ngf h LEU 314 Cb 0.40 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1ngf h LEU 314 CO 0.01 0.19 -0.05 0.44 0.09 0.00 0.00 178.44 179.12 1ngf h ASP 315 N 0.00 -0.12 0.13 -0.43 3.32 -1.67 -1.74 116.42 115.90 1ngf h ASP 315 Ca -0.00 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1ngf h ASP 315 Cb 1.10 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1ngf h ASP 315 CO 0.02 -0.08 -0.08 -0.65 -1.72 0.00 0.00 179.24 176.74 1ngf h PRO 316 N -0.12 0.00 -0.32 3.56 0.11 -1.73 -2.08 132.00 131.42 1ngf h PRO 316 Ca -0.00 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1ngf h PRO 316 Cb 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 1ngf h PRO 316 CO 0.00 0.08 -0.20 0.28 -0.21 0.00 0.00 178.00 177.95 1ngf h VAL 317 N 0.00 1.29 -0.33 3.15 2.07 -1.54 -1.71 116.25 119.18 1ngf h VAL 317 Ca -0.00 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1ngf h VAL 317 Cb 0.16 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1ngf h VAL 317 CO 0.01 0.43 0.21 -0.33 0.02 0.00 0.00 177.57 177.91 1ngf h GLU 318 N 0.46 0.44 -0.35 1.57 5.08 -0.81 -2.45 114.58 118.53 1ngf h GLU 318 Ca 0.06 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ngf h GLU 318 Cb 0.75 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1ngf h GLU 318 CO 0.06 0.32 0.21 -0.22 -1.00 0.00 0.00 179.01 178.37 1ngf h LYS 319 N 0.44 0.48 -0.86 2.33 3.64 -1.33 -1.91 116.57 119.35 1ngf h LYS 319 Ca 0.12 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.53 1ngf h LYS 319 Cb -0.02 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 31.64 1ngf h LYS 319 CO -0.02 0.38 0.52 0.00 -2.27 0.00 0.00 179.45 178.06 1ngf h ALA 320 N 1.08 1.21 0.73 5.00 0.00 -1.19 -0.51 119.26 125.57 1ngf h ALA 320 Ca 0.13 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1ngf h ALA 320 Cb 0.03 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ngf h ALA 320 CO -0.02 0.22 -0.35 -0.07 0.00 0.00 0.00 179.25 179.03 1ngf h LEU 321 N 0.92 -0.83 -1.46 0.00 4.07 -1.11 -1.76 115.31 115.14 1ngf h LEU 321 Ca 0.39 0.02 0.03 0.00 0.08 0.00 0.00 57.88 58.40 1ngf h LEU 321 Cb 0.26 0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.18 1ngf h LEU 321 CO -0.20 -0.56 0.40 0.08 -1.08 0.00 0.00 178.44 177.07 1ngf h ARG 322 N -1.03 0.68 0.15 1.13 0.11 -1.01 0.11 114.38 114.53 1ngf h ARG 322 Ca -0.10 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 59.93 1ngf h ARG 322 Cb 0.76 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 31.69 1ngf h ARG 322 CO 0.16 0.45 -0.07 -0.44 0.10 0.00 0.00 179.97 180.17 1ngf h ASP 323 N 0.70 -0.17 0.21 0.08 3.32 -1.03 -2.46 116.42 117.07 1ngf h ASP 323 Ca 0.24 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1ngf h ASP 323 Cb 0.08 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1ngf h ASP 323 CO -0.06 0.06 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1ngf n ALA 324 N -2.29 1.80 -3.61 3.45 0.00 -0.67 -4.87 120.51 114.32 1ngf n ALA 324 Ca -0.09 -0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.09 1ngf n ALA 324 Cb 0.18 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.47 1ngf n ALA 324 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ngf n LYS 325 N -1.24 -5.22 -4.28 0.00 4.76 -0.05 -5.01 118.16 107.13 1ngf n LYS 325 Ca 0.07 0.69 -0.15 0.00 -2.87 0.00 0.00 58.31 56.04 1ngf n LYS 325 Cb 0.10 -5.36 -0.10 0.00 -1.84 0.00 0.00 35.03 27.82 1ngf n LYS 325 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ngf s LEU 326 N -6.54 2.51 0.23 -0.35 1.43 -0.97 -5.04 118.68 109.95 1ngf s LEU 326 Ca 0.03 -1.03 0.08 0.00 -1.03 0.00 0.00 54.13 52.17 1ngf s LEU 326 Cb -0.01 -0.40 -0.04 0.00 0.03 0.00 0.00 46.19 45.77 1ngf s LEU 326 CO 0.79 -0.32 0.07 -0.62 0.23 0.00 0.00 176.35 176.51 1ngf s ASP 327 N -3.21 4.99 0.33 2.29 2.15 -1.26 -4.42 116.67 117.54 1ngf s ASP 327 Ca 0.19 -0.42 0.11 0.00 0.43 0.00 0.00 52.55 52.86 1ngf s ASP 327 Cb 0.02 -1.11 0.98 0.00 -0.30 0.00 0.00 42.92 42.51 1ngf s ASP 327 CO 0.03 0.01 1.67 0.11 -0.17 0.00 0.00 175.17 176.82 1ngf h LYS 328 N 1.96 0.34 0.00 4.34 1.57 -1.97 0.19 116.57 123.00 1ngf h LYS 328 Ca -0.46 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.26 1ngf h LYS 328 Cb 1.23 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1ngf h LYS 328 CO 0.60 0.23 -0.18 0.66 -0.57 0.00 0.00 179.45 180.19 1ngf h SER 329 N 0.35 0.00 1.54 0.86 4.64 -1.97 -3.11 113.55 115.86 1ngf h SER 329 Ca 0.68 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.00 1ngf h SER 329 Cb 1.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1ngf h SER 329 CO -0.59 0.18 0.00 1.56 -0.87 0.00 0.00 176.83 177.10 1ngf h GLN 330 N 0.00 0.00 -5.89 4.77 4.20 -1.00 -3.43 115.11 113.76 1ngf h GLN 330 Ca -0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 1ngf h GLN 330 Cb 0.46 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.17 1ngf h GLN 330 CO 0.02 0.00 0.27 0.96 -0.67 0.00 0.00 178.83 179.41 1ngf s ILE 331 N -3.22 4.94 0.01 2.54 -5.25 -1.18 -4.55 121.20 114.50 1ngf s ILE 331 Ca 0.08 1.49 -0.09 0.00 -0.99 0.00 0.00 60.65 61.14 1ngf s ILE 331 Cb 0.09 -4.07 -0.31 0.00 2.95 0.00 0.00 42.46 41.12 1ngf s ILE 331 CO 0.60 0.09 0.91 0.45 -1.79 0.00 0.00 174.94 175.19 1ngf h HIS 332 N 7.27 0.68 -3.99 1.37 3.86 -1.19 -3.47 115.15 119.68 1ngf h HIS 332 Ca -0.32 -0.50 -0.36 0.00 -1.16 0.00 0.00 60.37 58.03 1ngf h HIS 332 Cb 1.15 -0.03 -0.26 0.00 1.06 0.00 0.00 27.41 29.33 1ngf h HIS 332 CO 0.70 1.49 -0.77 -0.51 0.86 0.00 0.00 177.93 179.70 1ngf s ASP 333 N -7.27 1.09 -0.18 2.45 1.01 -1.10 -5.05 116.67 107.63 1ngf s ASP 333 Ca -0.10 -0.33 0.01 0.00 0.71 0.00 0.00 52.55 52.84 1ngf s ASP 333 Cb 0.06 -0.06 0.03 0.00 1.01 0.00 0.00 42.92 43.95 1ngf s ASP 333 CO 0.89 -0.00 -0.14 -0.63 0.21 0.00 0.00 175.17 175.50 1ngf s ILE 334 N -0.68 1.72 -0.07 0.77 1.01 -1.26 -0.20 121.20 122.50 1ngf s ILE 334 Ca -0.01 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.80 1ngf s ILE 334 Cb -0.06 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 1ngf s ILE 334 CO 0.00 0.35 -0.16 0.68 0.00 0.00 0.00 174.94 175.82 1ngf s VAL 335 N 1.40 2.91 -0.10 2.92 -7.23 -0.16 -1.19 120.40 118.94 1ngf s VAL 335 Ca 0.02 -0.76 -0.15 0.00 -1.81 0.00 0.00 61.98 59.29 1ngf s VAL 335 Cb -0.14 -2.15 -0.05 0.00 0.56 0.00 0.00 36.38 34.60 1ngf s VAL 335 CO -0.10 0.57 0.36 -0.76 -0.31 0.00 0.00 175.10 174.86 1ngf s LEU 336 N -0.37 4.33 0.03 1.32 1.43 -0.90 -1.30 118.68 123.21 1ngf s LEU 336 Ca 0.04 0.71 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1ngf s LEU 336 Cb -0.12 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 1ngf s LEU 336 CO 0.02 0.16 -0.08 -0.69 0.23 0.00 0.00 176.35 175.99 1ngf s VAL 337 N -0.02 0.57 0.00 -1.59 1.01 -0.16 -4.60 120.40 115.61 1ngf s VAL 337 Ca 0.21 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.38 1ngf s VAL 337 Cb -0.14 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1ngf s VAL 337 CO 0.08 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.61 1ngf n GLY 338 N 1.97 2.12 0.36 4.51 0.00 -0.03 -1.36 105.19 112.76 1ngf n GLY 338 Ca -0.19 -1.55 0.14 0.00 0.00 0.00 0.00 46.02 44.42 1ngf n GLY 338 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ngf h GLY 339 N 0.00 0.50 2.00 -0.02 0.00 -1.80 -2.04 103.07 101.71 1ngf h GLY 339 Ca 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 1ngf h GLY 339 CO 0.00 0.07 -0.14 1.76 0.00 0.00 0.00 176.54 178.24 1ngf h SER 340 N 0.33 0.00 0.12 0.19 0.02 -1.59 -2.93 113.55 109.69 1ngf h SER 340 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1ngf h SER 340 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1ngf h SER 340 CO -0.07 0.14 0.00 0.35 -1.14 0.00 0.00 176.83 176.10 1ngf n THR 341 N -3.48 0.29 0.84 -2.27 -2.24 -0.77 -1.75 114.28 104.90 1ngf n THR 341 Ca -0.01 0.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.97 1ngf n THR 341 Cb 0.30 -0.85 0.53 0.00 -2.10 0.00 0.00 70.33 68.21 1ngf n THR 341 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ngf n ARG 342 N -1.13 0.05 -2.21 -0.78 1.74 -1.11 -4.64 116.66 108.57 1ngf n ARG 342 Ca 0.09 0.09 -0.43 0.00 -0.77 0.00 0.00 57.85 56.83 1ngf n ARG 342 Cb 0.08 -1.56 -0.02 0.00 -1.02 0.00 0.00 32.46 29.93 1ngf n ARG 342 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ngf s ILE 343 N -3.03 3.92 0.17 0.55 1.01 -0.72 -4.86 121.20 118.24 1ngf s ILE 343 Ca 0.12 1.12 -0.20 0.00 0.00 0.00 0.00 60.65 61.69 1ngf s ILE 343 Cb 0.16 -3.72 0.08 0.00 0.01 0.00 0.00 42.46 38.99 1ngf s ILE 343 CO 0.49 -0.09 1.63 -0.65 0.00 0.00 0.00 174.94 176.31 1ngf h PRO 344 N 8.82 -0.17 -0.91 2.79 0.11 -1.85 -1.86 132.00 138.94 1ngf h PRO 344 Ca -0.33 0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.92 1ngf h PRO 344 Cb 1.14 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.22 1ngf h PRO 344 CO 0.96 -0.11 0.58 -0.22 -0.21 0.00 0.00 178.00 179.00 1ngf h LYS 345 N -0.18 0.74 -0.54 1.05 1.63 -1.97 0.11 116.57 117.41 1ngf h LYS 345 Ca 0.18 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.84 1ngf h LYS 345 Cb 0.46 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1ngf h LYS 345 CO -0.47 0.49 -0.03 0.82 -3.45 0.00 0.00 179.45 176.80 1ngf h ILE 346 N 0.76 1.27 -0.62 2.00 1.08 -1.72 -0.37 117.51 119.91 1ngf h ILE 346 Ca 0.45 -1.16 -0.07 0.00 -0.39 0.00 0.00 64.86 63.70 1ngf h ILE 346 Cb 0.64 0.94 -0.02 0.00 -3.07 0.00 0.00 36.82 35.30 1ngf h ILE 346 CO -0.21 0.41 0.12 1.56 -0.69 0.00 0.00 178.15 179.34 1ngf h GLN 347 N 0.84 1.01 0.06 2.37 4.20 -0.36 -1.81 115.11 121.42 1ngf h GLN 347 Ca 0.15 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1ngf h GLN 347 Cb 0.58 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1ngf h GLN 347 CO 0.03 0.93 -0.03 -0.22 -0.67 0.00 0.00 178.83 178.88 1ngf h LYS 348 N 0.92 -0.07 -0.73 1.46 3.64 -0.77 -1.68 116.57 119.34 1ngf h LYS 348 Ca 0.19 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.69 1ngf h LYS 348 Cb 0.40 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.15 1ngf h LYS 348 CO 0.01 0.16 0.33 1.25 -2.27 0.00 0.00 179.45 178.92 1ngf h LEU 349 N -0.30 0.37 -0.10 5.20 5.85 -0.96 0.24 115.31 125.61 1ngf h LEU 349 Ca -0.01 0.09 -0.16 0.00 0.84 0.00 0.00 57.88 58.64 1ngf h LEU 349 Cb 0.27 0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.34 1ngf h LEU 349 CO 0.01 0.18 -0.55 0.25 -0.34 0.00 0.00 178.44 177.99 1ngf h LEU 350 N 0.52 0.66 -0.69 2.25 6.46 -1.28 -2.70 115.31 120.54 1ngf h LEU 350 Ca 0.38 -0.65 -0.04 0.00 -0.12 0.00 0.00 57.88 57.45 1ngf h LEU 350 Cb 0.51 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.21 1ngf h LEU 350 CO -0.34 1.20 0.26 -0.61 -0.62 0.00 0.00 178.44 178.34 1ngf h GLN 351 N 0.16 1.03 -0.86 1.25 4.15 -0.77 -1.64 115.11 118.43 1ngf h GLN 351 Ca -0.04 -0.19 -0.00 0.00 0.77 0.00 0.00 58.65 59.18 1ngf h GLN 351 Cb 1.20 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.68 1ngf h GLN 351 CO 0.11 0.87 0.53 -0.44 -1.93 0.00 0.00 178.83 177.97 1ngf h ASP 352 N 0.98 1.03 -0.77 -0.69 3.32 -0.59 0.46 116.42 120.16 1ngf h ASP 352 Ca 0.23 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 1ngf h ASP 352 Cb 0.23 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 1ngf h ASP 352 CO -0.02 0.78 0.35 0.15 -1.72 0.00 0.00 179.24 178.79 1ngf h PHE 353 N 1.18 1.13 -0.72 4.55 3.57 -1.06 -1.94 116.94 123.65 1ngf h PHE 353 Ca 0.31 -0.06 -0.39 0.00 3.53 0.00 0.00 57.97 61.35 1ngf h PHE 353 Cb -0.06 -0.35 -0.22 0.00 2.79 0.00 0.00 35.95 38.11 1ngf h PHE 353 CO -0.00 0.84 0.50 1.19 -2.23 0.00 0.00 178.31 178.60 1ngf n PHE 354 N -4.30 2.24 -4.19 0.41 3.72 -0.67 -4.92 117.46 109.74 1ngf n PHE 354 Ca 0.07 -1.64 -0.30 0.00 -0.05 0.00 0.00 57.45 55.53 1ngf n PHE 354 Cb 0.16 -0.83 -0.07 0.00 -0.94 0.00 0.00 39.48 37.80 1ngf n PHE 354 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1ngf n ASN 355 N -0.61 0.23 0.00 4.37 5.03 -0.73 -1.50 115.26 122.04 1ngf n ASN 355 Ca 0.44 -1.20 0.00 0.00 0.87 0.00 0.00 54.58 54.68 1ngf n ASN 355 Cb 1.23 -2.03 0.00 0.00 -1.02 0.00 0.00 39.78 37.95 1ngf n ASN 355 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ngf n GLY 356 N -2.38 1.57 3.55 7.41 0.00 0.10 -5.02 105.19 110.43 1ngf n GLY 356 Ca -0.31 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.24 1ngf n GLY 356 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ngf n LYS 357 N -2.00 1.01 -2.45 1.61 3.00 -0.56 -4.89 118.16 113.87 1ngf n LYS 357 Ca 0.00 0.36 -0.40 0.00 -0.00 0.00 0.00 58.31 58.26 1ngf n LYS 357 Cb 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 35.03 33.27 1ngf n LYS 357 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1ngf s GLU 358 N -0.96 4.61 0.05 1.64 8.01 -1.26 -4.82 118.70 125.97 1ngf s GLU 358 Ca 0.66 1.82 -0.06 0.00 0.01 0.00 0.00 54.97 57.40 1ngf s GLU 358 Cb -0.82 -3.20 -0.05 0.00 -4.31 0.00 0.00 34.13 25.76 1ngf s GLU 358 CO 0.56 0.15 0.31 -0.51 0.01 0.00 0.00 175.26 175.78 1ngf s LEU 359 N -1.23 4.35 -0.36 1.80 1.02 -1.26 -4.63 118.68 118.37 1ngf s LEU 359 Ca 0.46 0.59 -0.21 0.00 0.02 0.00 0.00 54.13 54.98 1ngf s LEU 359 Cb -0.32 -2.86 0.00 0.00 0.02 0.00 0.00 46.19 43.04 1ngf s LEU 359 CO 0.40 0.20 0.67 0.20 0.02 0.00 0.00 176.35 177.84 1ngf s ASN 360 N -1.89 6.46 0.00 2.29 0.01 -0.34 -4.85 114.94 116.62 1ngf s ASN 360 Ca 0.31 0.20 0.03 0.00 -0.71 0.00 0.00 52.86 52.69 1ngf s ASN 360 Cb -0.13 -2.34 0.05 0.00 0.41 0.00 0.00 41.25 39.24 1ngf s ASN 360 CO 0.19 -0.62 0.95 2.29 -1.51 0.00 0.00 177.10 178.39 1ngf n LYS 361 N 6.12 0.00 0.18 -0.60 2.85 -1.26 -2.13 118.16 123.32 1ngf n LYS 361 Ca -0.00 -0.98 0.05 0.00 -1.05 0.00 0.00 58.31 56.33 1ngf n LYS 361 Cb 0.48 0.35 0.26 0.00 -0.65 0.00 0.00 35.03 35.47 1ngf n LYS 361 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1ngf h SER 362 N 0.12 0.00 -3.26 -5.58 4.64 -1.97 -3.43 113.55 104.07 1ngf h SER 362 Ca -0.44 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.30 1ngf h SER 362 Cb 1.41 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.41 1ngf h SER 362 CO -0.20 0.40 -0.24 -0.63 -0.87 0.00 0.00 176.83 175.29 1ngf s ILE 363 N -3.41 5.23 -0.29 0.95 1.01 -1.26 -5.00 121.20 118.43 1ngf s ILE 363 Ca 0.01 0.73 -0.41 0.00 0.00 0.00 0.00 60.65 60.98 1ngf s ILE 363 Cb 0.10 -3.71 -0.17 0.00 0.01 0.00 0.00 42.46 38.69 1ngf s ILE 363 CO 0.70 0.39 1.67 0.59 0.00 0.00 0.00 174.94 178.29 1ngf n ASN 364 N 3.39 2.04 -0.29 3.58 3.02 -1.26 -4.77 115.26 120.96 1ngf n ASN 364 Ca -0.10 1.10 0.20 0.00 -0.03 0.00 0.00 54.58 55.75 1ngf n ASN 364 Cb 0.52 -1.09 0.48 0.00 -0.61 0.00 0.00 39.78 39.09 1ngf n ASN 364 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1ngf h PRO 365 N 6.47 0.44 0.00 3.52 0.11 -1.84 0.15 132.00 140.86 1ngf h PRO 365 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ngf h PRO 365 Cb 1.33 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ngf h PRO 365 CO 0.94 0.29 0.00 -0.40 -0.21 0.00 0.00 178.00 178.63 1ngf n ASP 366 N -4.59 0.00 -0.00 -2.05 5.68 -1.26 -0.85 116.55 113.48 1ngf n ASP 366 Ca 0.22 -0.66 0.02 0.00 -0.50 0.00 0.00 54.79 53.87 1ngf n ASP 366 Cb 0.75 -0.11 -0.02 0.00 -1.14 0.00 0.00 41.12 40.61 1ngf n ASP 366 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ngf n GLU 367 N -1.11 4.25 -0.22 0.11 1.02 0.44 -4.78 120.64 120.36 1ngf n GLU 367 Ca 0.20 -0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.35 1ngf n GLU 367 Cb 0.15 -0.78 0.13 0.00 -0.02 0.00 0.00 31.44 30.93 1ngf n GLU 367 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ngf h ALA 368 N 0.41 0.82 -0.22 0.62 0.00 -1.34 -0.83 119.26 118.73 1ngf h ALA 368 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ngf h ALA 368 Cb 0.10 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1ngf h ALA 368 CO 0.00 -0.28 0.06 0.28 0.00 0.00 0.00 179.25 179.31 1ngf h VAL 369 N 0.31 1.20 -0.63 0.00 2.07 -1.86 -1.46 116.25 115.88 1ngf h VAL 369 Ca 0.35 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1ngf h VAL 369 Cb 0.53 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1ngf h VAL 369 CO -0.41 0.21 0.37 0.00 0.02 0.00 0.00 177.57 177.76 1ngf h ALA 370 N 0.87 0.80 -0.25 1.67 0.00 -1.79 -1.27 119.26 119.29 1ngf h ALA 370 Ca 0.07 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1ngf h ALA 370 Cb 0.26 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 1ngf h ALA 370 CO -0.00 0.29 -0.14 -0.92 0.00 0.00 0.00 179.25 178.48 1ngf h TYR 371 N 0.85 -0.34 -0.59 0.00 5.03 -1.01 -0.12 116.97 120.79 1ngf h TYR 371 Ca 0.22 0.03 -0.09 0.00 2.58 0.00 0.00 58.73 61.48 1ngf h TYR 371 Cb -0.01 0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.44 1ngf h TYR 371 CO -0.02 -0.21 0.02 0.78 -1.32 0.00 0.00 178.16 177.42 1ngf h GLY 372 N -0.11 1.09 1.19 1.82 0.00 -0.97 -2.78 103.07 103.31 1ngf h GLY 372 Ca 0.14 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.67 1ngf h GLY 372 CO -0.33 0.71 0.31 0.00 0.00 0.00 0.00 176.54 177.23 1ngf h ALA 373 N 1.08 1.19 -0.53 3.60 0.00 -0.57 -1.15 119.26 122.89 1ngf h ALA 373 Ca 0.17 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1ngf h ALA 373 Cb 0.51 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1ngf h ALA 373 CO 0.02 0.60 0.10 0.00 0.00 0.00 0.00 179.25 179.97 1ngf h ALA 374 N 1.31 1.19 -0.07 0.00 0.00 -0.83 0.15 119.26 121.01 1ngf h ALA 374 Ca 0.24 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1ngf h ALA 374 Cb 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ngf h ALA 374 CO -0.03 0.55 -0.08 0.28 0.00 0.00 0.00 179.25 179.97 1ngf h VAL 375 N 0.79 1.38 -0.45 0.00 2.07 -1.18 -2.18 116.25 116.68 1ngf h VAL 375 Ca 0.17 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.42 1ngf h VAL 375 Cb 0.33 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1ngf h VAL 375 CO 0.00 0.35 0.30 -0.61 0.02 0.00 0.00 177.57 177.63 1ngf h GLN 376 N -0.27 0.56 -0.43 1.57 5.75 -0.93 -1.27 115.11 120.08 1ngf h GLN 376 Ca 0.01 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1ngf h GLN 376 Cb 0.61 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 1ngf h GLN 376 CO 0.02 0.37 0.02 0.00 -2.65 0.00 0.00 178.83 176.59 1ngf h ALA 377 N 1.73 0.58 -0.03 3.38 0.00 -0.63 -1.93 119.26 122.36 1ngf h ALA 377 Ca 0.17 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ngf h ALA 377 Cb -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1ngf h ALA 377 CO -0.04 0.35 -0.06 0.00 0.00 0.00 0.00 179.25 179.50 1ngf h ALA 378 N 0.91 -0.04 -0.58 0.00 0.00 -0.59 0.11 119.26 119.08 1ngf h ALA 378 Ca 0.13 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1ngf h ALA 378 Cb 0.46 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ngf h ALA 378 CO 0.02 -0.55 0.17 -0.84 0.00 0.00 0.00 179.25 178.05 1ngf h ILE 379 N -0.10 1.24 -0.40 0.00 3.07 -1.36 0.65 117.51 120.62 1ngf h ILE 379 Ca 0.04 -0.83 -0.02 0.00 1.55 0.00 0.00 64.86 65.60 1ngf h ILE 379 Cb 0.15 0.69 -0.02 0.00 -0.27 0.00 0.00 36.82 37.37 1ngf h ILE 379 CO -0.09 0.31 0.15 -0.07 -1.05 0.00 0.00 178.15 177.40 1ngf h LEU 380 N 0.81 0.51 -0.15 0.16 4.07 -0.97 -2.41 115.31 117.34 1ngf h LEU 380 Ca 0.18 -0.05 -0.23 0.00 0.08 0.00 0.00 57.88 57.86 1ngf h LEU 380 Cb 0.30 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 41.91 1ngf h LEU 380 CO -0.00 0.48 -0.94 0.28 -1.08 0.00 0.00 178.44 177.17 1ngf h SER 381 N 0.56 0.64 0.00 -0.43 0.02 -0.34 -3.48 113.55 110.53 1ngf h SER 381 Ca 0.14 -0.50 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1ngf h SER 381 Cb 0.13 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.48 1ngf h SER 381 CO -0.01 1.30 0.00 0.61 -1.14 0.00 0.00 176.83 177.58 1ngf n GLY 382 N 0.94 1.91 0.43 -3.77 0.00 -0.24 -5.01 105.19 99.44 1ngf n GLY 382 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.98 1ngf n GLY 382 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ngf n ASP 383 N 0.00 2.50 0.00 1.61 8.00 0.06 -5.02 116.55 123.70 1ngf n ASP 383 Ca 0.00 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.61 1ngf n ASP 383 Cb 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 1ngf n ASP 383 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98