#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ngb s VAL 2 N 0.00 2.56 -0.15 1.69 1.01 -1.26 -4.40 120.40 119.84 3ngb s VAL 2 Ca 0.00 0.43 -0.08 0.00 0.00 0.00 0.00 61.98 62.34 3ngb s VAL 2 Cb 0.00 -3.28 0.06 0.00 0.00 0.00 0.00 36.38 33.16 3ngb s VAL 2 CO 0.00 0.05 0.36 -1.58 0.00 0.00 0.00 175.10 173.93 3ngb s GLN 3 N 0.31 0.32 -0.19 2.72 0.74 -0.53 -5.02 119.66 118.01 3ngb s GLN 3 Ca 0.65 0.75 -0.02 0.00 0.05 0.00 0.00 55.36 56.79 3ngb s GLN 3 Cb -0.44 -0.01 -0.01 0.00 1.10 0.00 0.00 33.01 33.66 3ngb s GLN 3 CO 0.38 -0.18 -0.08 -0.51 -0.55 0.00 0.00 175.29 174.35 3ngb s LEU 4 N 1.59 2.82 -0.18 3.68 1.02 -1.26 -1.55 118.68 124.79 3ngb s LEU 4 Ca -0.08 -0.37 -0.02 0.00 0.02 0.00 0.00 54.13 53.68 3ngb s LEU 4 Cb -0.10 -1.69 -0.01 0.00 0.02 0.00 0.00 46.19 44.42 3ngb s LEU 4 CO -0.11 0.05 -0.09 -0.69 0.02 0.00 0.00 176.35 175.52 3ngb s VAL 5 N 1.07 3.16 0.54 -1.59 1.01 0.39 -4.32 120.40 120.65 3ngb s VAL 5 Ca 0.00 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.47 3ngb s VAL 5 Cb -0.15 -2.39 0.05 0.00 0.00 0.00 0.00 36.38 33.90 3ngb s VAL 5 CO -0.01 0.47 0.56 -1.10 0.00 0.00 0.00 175.10 175.02 3ngb s GLN 6 N 1.02 2.32 0.49 2.72 -0.21 -1.26 -0.39 119.66 124.35 3ngb s GLN 6 Ca -0.00 -1.80 0.02 0.00 0.02 0.00 0.00 55.36 53.59 3ngb s GLN 6 Cb -0.15 -2.36 0.01 0.00 1.00 0.00 0.00 33.01 31.52 3ngb s GLN 6 CO -0.01 -0.66 0.70 -1.54 -2.12 0.00 0.00 175.29 171.66 3ngb s SER 7 N -4.42 5.56 0.98 5.90 1.04 -1.20 -4.96 113.70 116.59 3ngb s SER 7 Ca 0.47 0.06 -0.11 0.00 0.48 0.00 0.00 55.95 56.85 3ngb s SER 7 Cb -0.04 -1.13 0.18 0.00 0.10 0.00 0.00 66.02 65.13 3ngb s SER 7 CO 0.29 -0.90 1.09 -0.83 0.98 0.00 0.00 173.24 173.87 3ngb s GLY 8 N -4.32 1.63 0.87 7.32 0.00 -1.26 -4.63 107.32 106.92 3ngb s GLY 8 Ca 0.53 0.19 -0.11 0.00 0.00 0.00 0.00 44.72 45.32 3ngb s GLY 8 CO 0.37 0.71 1.09 -0.32 0.00 0.00 0.00 173.10 174.96 3ngb s GLY 9 N -2.86 1.64 -0.00 0.20 0.00 -1.26 -4.80 107.32 100.23 3ngb s GLY 9 Ca 0.66 0.07 -0.01 0.00 0.00 0.00 0.00 44.72 45.43 3ngb s GLY 9 CO 0.60 0.52 0.02 1.20 0.00 0.00 0.00 173.10 175.43 3ngb s GLN 10 N -4.89 0.13 -0.27 2.90 -0.21 -0.14 -4.96 119.66 112.21 3ngb s GLN 10 Ca 0.63 -0.16 -0.07 0.00 0.02 0.00 0.00 55.36 55.79 3ngb s GLN 10 Cb -0.18 0.05 -0.01 0.00 1.00 0.00 0.00 33.01 33.87 3ngb s GLN 10 CO 0.57 -0.02 0.06 -1.64 -2.12 0.00 0.00 175.29 172.14 3ngb s MET 11 N -0.45 3.34 0.43 2.91 -1.94 -1.26 -1.43 119.30 120.89 3ngb s MET 11 Ca -0.05 -0.69 0.06 0.00 -1.71 0.00 0.00 55.69 53.31 3ngb s MET 11 Cb -0.03 -3.31 -0.06 0.00 2.01 0.00 0.00 34.83 33.44 3ngb s MET 11 CO -0.00 -0.32 0.08 0.15 -0.01 0.00 0.00 175.02 174.92 3ngb s LYS 12 N 1.54 2.08 0.11 2.03 3.01 0.27 -4.96 119.74 123.82 3ngb s LYS 12 Ca 0.04 -2.06 0.10 0.00 -1.01 0.00 0.00 55.97 53.04 3ngb s LYS 12 Cb -0.16 -1.75 -0.04 0.00 -1.01 0.00 0.00 37.83 34.87 3ngb s LYS 12 CO 0.02 -0.13 -0.24 0.15 0.51 0.00 0.00 175.35 175.67 3ngb s LYS 13 N -3.81 1.28 0.17 1.68 1.02 -1.26 -1.48 119.74 117.34 3ngb s LYS 13 Ca 0.34 -1.24 -0.33 0.00 0.02 0.00 0.00 55.97 54.75 3ngb s LYS 13 Cb 0.07 -1.65 -0.15 0.00 -0.52 0.00 0.00 37.83 35.58 3ngb s LYS 13 CO 0.18 0.39 1.35 -2.30 -0.92 0.00 0.00 175.35 174.05 3ngb n PRO 14 N 1.05 1.61 0.00 -1.68 -0.02 -1.26 -1.83 135.00 132.87 3ngb n PRO 14 Ca -0.19 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3ngb n PRO 14 Cb 0.53 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3ngb n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ngb n GLY 15 N 2.42 2.72 3.70 -1.23 0.00 -0.19 -4.92 105.19 107.69 3ngb n GLY 15 Ca 0.15 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 3ngb n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ngb s GLU 16 N 0.00 -0.85 0.32 1.61 2.02 -0.76 -3.85 118.70 117.19 3ngb s GLU 16 Ca 0.00 -0.28 0.03 0.00 0.02 0.00 0.00 54.97 54.74 3ngb s GLU 16 Cb 0.00 -1.66 -0.06 0.00 0.10 0.00 0.00 34.13 32.51 3ngb s GLU 16 CO 0.00 -3.43 0.07 -1.54 0.02 0.00 0.00 175.26 170.39 3ngb s SER 17 N -4.31 2.17 0.11 -0.19 1.04 -1.26 -0.91 113.70 110.36 3ngb s SER 17 Ca 0.73 -1.41 0.04 0.00 0.48 0.00 0.00 55.95 55.80 3ngb s SER 17 Cb -0.06 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.05 3ngb s SER 17 CO 0.55 -0.67 -0.11 0.00 0.98 0.00 0.00 173.24 173.99 3ngb s MET 18 N -3.90 0.92 -0.03 4.02 0.23 -0.28 -4.98 119.30 115.28 3ngb s MET 18 Ca 0.35 -1.22 -0.00 0.00 -1.03 0.00 0.00 55.69 53.79 3ngb s MET 18 Cb 0.08 -0.64 0.03 0.00 -1.53 0.00 0.00 34.83 32.77 3ngb s MET 18 CO 0.15 0.10 0.02 1.03 -2.03 0.00 0.00 175.02 174.29 3ngb s ARG 19 N -2.91 0.19 0.03 3.16 0.52 -1.26 -2.33 118.95 116.36 3ngb s ARG 19 Ca 0.08 0.15 0.04 0.00 -0.52 0.00 0.00 55.73 55.48 3ngb s ARG 19 Cb -0.03 -0.46 -0.02 0.00 0.52 0.00 0.00 34.95 34.96 3ngb s ARG 19 CO 0.01 -0.18 -0.12 0.96 0.02 0.00 0.00 175.30 175.99 3ngb s ILE 20 N 1.25 0.95 0.33 1.52 -4.36 -0.80 -4.97 121.20 115.13 3ngb s ILE 20 Ca -0.07 -0.91 0.07 0.00 -0.26 0.00 0.00 60.65 59.49 3ngb s ILE 20 Cb -0.13 -0.88 -0.03 0.00 1.25 0.00 0.00 42.46 42.68 3ngb s ILE 20 CO -0.02 -0.03 0.29 -0.94 0.24 0.00 0.00 174.94 174.47 3ngb s SER 21 N -1.06 5.32 -0.44 4.36 1.04 -1.26 -1.49 113.70 120.18 3ngb s SER 21 Ca 0.00 -0.47 0.05 0.00 0.48 0.00 0.00 55.95 56.01 3ngb s SER 21 Cb -0.07 -1.02 0.17 0.00 0.10 0.00 0.00 66.02 65.20 3ngb s SER 21 CO 0.01 -0.32 0.50 0.00 0.98 0.00 0.00 173.24 174.41 3ngb s ARG 23 N 0.83 4.37 0.07 0.00 3.52 0.48 -2.44 118.95 125.78 3ngb s ARG 23 Ca 0.26 1.57 0.01 0.00 -0.13 0.00 0.00 55.73 57.44 3ngb s ARG 23 Cb -0.03 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.76 3ngb s ARG 23 CO -0.09 -0.41 0.20 0.00 -0.81 0.00 0.00 175.30 174.20 3ngb s ALA 24 N 2.18 3.96 -0.19 6.12 0.00 -0.33 -0.47 121.76 133.03 3ngb s ALA 24 Ca 0.53 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 51.45 3ngb s ALA 24 Cb -0.22 -1.78 0.05 0.00 0.00 0.00 0.00 23.12 21.17 3ngb s ALA 24 CO 0.20 0.79 0.50 -1.54 0.00 0.00 0.00 175.76 175.71 3ngb s SER 25 N -2.58 -0.57 0.00 0.00 1.04 -0.59 -4.87 113.70 106.14 3ngb s SER 25 Ca 0.34 1.04 0.00 0.00 0.48 0.00 0.00 55.95 57.81 3ngb s SER 25 Cb -0.13 1.01 0.00 0.00 0.10 0.00 0.00 66.02 67.01 3ngb s SER 25 CO 0.27 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.92 3ngb n GLY 26 N 3.25 1.26 3.75 7.32 0.00 -1.26 -1.45 105.19 118.06 3ngb n GLY 26 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 3ngb n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ngb s TYR 27 N -2.00 -0.14 -0.42 1.61 1.13 -1.26 -4.52 117.35 111.74 3ngb s TYR 27 Ca 0.00 -0.17 -0.28 0.00 -1.41 0.00 0.00 57.07 55.21 3ngb s TYR 27 Cb 0.00 0.64 -0.00 0.00 -1.10 0.00 0.00 41.96 41.50 3ngb s TYR 27 CO 0.00 -0.85 1.59 -1.21 -2.51 0.00 0.00 175.55 172.57 3ngb s GLU 28 N -3.33 3.36 0.26 -3.49 0.41 -1.26 -4.90 118.70 109.76 3ngb s GLU 28 Ca 0.12 1.01 -0.01 0.00 -0.41 0.00 0.00 54.97 55.68 3ngb s GLU 28 Cb -0.02 -4.13 0.55 0.00 -1.78 0.00 0.00 34.13 28.75 3ngb s GLU 28 CO 0.02 -1.83 1.74 0.35 -0.49 0.00 0.00 175.26 175.05 3ngb h PHE 29 N 11.92 0.68 0.00 1.61 3.57 -1.93 -1.09 116.94 131.70 3ngb h PHE 29 Ca -0.29 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.24 3ngb h PHE 29 Cb 1.13 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.70 3ngb h PHE 29 CO 0.98 0.11 0.00 0.44 -2.23 0.00 0.00 178.31 177.61 3ngb n ILE 30 N -4.94 0.32 0.01 1.41 -5.35 -1.26 -3.46 119.36 106.10 3ngb n ILE 30 Ca 0.17 0.08 -0.09 0.00 -0.27 0.00 0.00 62.75 62.64 3ngb n ILE 30 Cb 0.47 -0.67 -0.13 0.00 -1.74 0.00 0.00 39.64 37.56 3ngb n ILE 30 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 3ngb h ASP 31 N 0.00 0.03 -3.70 7.28 3.32 -1.60 -3.37 116.42 118.39 3ngb h ASP 31 Ca 0.00 -0.05 -0.68 0.00 0.02 0.00 0.00 57.03 56.32 3ngb h ASP 31 Cb 0.35 -0.01 -0.19 0.00 0.22 0.00 0.00 39.33 39.71 3ngb h ASP 31 CO 0.00 1.05 -0.72 0.00 -1.72 0.00 0.00 179.24 177.84 3ngb s THR 33 N -0.93 4.07 0.11 0.00 2.01 -1.26 -4.53 115.64 115.11 3ngb s THR 33 Ca 0.15 1.66 0.06 0.00 0.31 0.00 0.00 61.69 63.88 3ngb s THR 33 Cb -0.11 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 3ngb s THR 33 CO 0.06 0.08 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.79 3ngb s LEU 34 N -2.27 3.20 0.16 4.42 2.96 0.24 -4.57 118.68 122.81 3ngb s LEU 34 Ca 0.53 -0.33 0.06 0.00 -0.22 0.00 0.00 54.13 54.17 3ngb s LEU 34 Cb -0.19 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 3ngb s LEU 34 CO 0.25 0.17 -0.13 0.20 -1.32 0.00 0.00 176.35 175.51 3ngb s ASN 35 N -2.33 2.13 -0.17 3.68 0.01 -0.36 -0.42 114.94 117.48 3ngb s ASN 35 Ca 0.23 -0.95 0.00 0.00 -0.71 0.00 0.00 52.86 51.44 3ngb s ASN 35 Cb -0.11 -0.07 0.03 0.00 0.41 0.00 0.00 41.25 41.51 3ngb s ASN 35 CO 0.16 -0.21 -0.10 0.26 -1.51 0.00 0.00 177.10 175.69 3ngb s TRP 36 N -2.81 2.15 -0.12 2.20 0.52 -0.99 -1.47 118.94 118.43 3ngb s TRP 36 Ca 0.16 -1.33 0.03 0.00 0.02 0.00 0.00 56.10 54.98 3ngb s TRP 36 Cb -0.01 -1.54 0.00 0.00 -1.15 0.00 0.00 33.47 30.77 3ngb s TRP 36 CO 0.03 -0.68 -0.22 0.42 0.02 0.00 0.00 176.95 176.52 3ngb s ILE 37 N 1.49 2.20 -0.06 2.03 -1.09 -0.35 -0.29 121.20 125.13 3ngb s ILE 37 Ca 0.01 -0.96 -0.05 0.00 -2.23 0.00 0.00 60.65 57.43 3ngb s ILE 37 Cb -0.15 -1.86 -0.04 0.00 -1.58 0.00 0.00 42.46 38.83 3ngb s ILE 37 CO -0.09 0.55 0.15 0.00 -1.23 0.00 0.00 174.94 174.32 3ngb s ARG 38 N 0.50 3.40 -0.33 2.79 1.70 -0.47 -0.02 118.95 126.52 3ngb s ARG 38 Ca -0.14 -0.25 -0.00 0.00 -0.47 0.00 0.00 55.73 54.87 3ngb s ARG 38 Cb -0.17 -3.12 0.11 0.00 -0.57 0.00 0.00 34.95 31.20 3ngb s ARG 38 CO 0.05 0.72 0.12 -0.51 -1.08 0.00 0.00 175.30 174.60 3ngb s LEU 39 N -1.48 2.47 -0.12 -1.89 1.43 -0.56 -1.50 118.68 117.04 3ngb s LEU 39 Ca 0.21 -1.83 -0.07 0.00 -1.03 0.00 0.00 54.13 51.42 3ngb s LEU 39 Cb -0.12 -0.94 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 3ngb s LEU 39 CO 0.11 -0.39 0.13 0.00 0.23 0.00 0.00 176.35 176.43 3ngb s ALA 40 N 1.38 3.82 0.26 4.21 0.00 -1.26 -2.27 121.76 127.90 3ngb s ALA 40 Ca 0.11 -0.66 -0.31 0.00 0.00 0.00 0.00 51.96 51.11 3ngb s ALA 40 Cb -0.18 -1.92 -0.12 0.00 0.00 0.00 0.00 23.12 20.90 3ngb s ALA 40 CO -0.20 0.61 1.64 -2.14 0.00 0.00 0.00 175.76 175.67 3ngb s PRO 41 N -1.00 4.12 -0.28 0.00 0.02 -1.26 -2.50 135.00 134.10 3ngb s PRO 41 Ca 0.15 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.76 3ngb s PRO 41 Cb -0.12 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3ngb s PRO 41 CO 0.04 -0.68 0.00 0.41 -0.33 0.00 0.00 177.00 176.44 3ngb n GLY 42 N 2.79 0.36 3.22 0.52 0.00 -1.26 -5.04 105.19 105.79 3ngb n GLY 42 Ca 0.11 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 3ngb n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ngb s LYS 43 N -3.54 0.89 0.34 1.61 1.02 -1.04 -5.14 119.74 113.88 3ngb s LYS 43 Ca 0.00 -1.03 -0.28 0.00 0.02 0.00 0.00 55.97 54.68 3ngb s LYS 43 Cb 0.00 0.34 -0.10 0.00 -0.52 0.00 0.00 37.83 37.55 3ngb s LYS 43 CO 0.00 -0.29 1.25 1.03 -0.92 0.00 0.00 175.35 176.42 3ngb s ARG 44 N -3.89 4.33 0.13 1.68 0.52 -1.26 -4.75 118.95 115.70 3ngb s ARG 44 Ca 0.08 2.08 -0.34 0.00 -0.52 0.00 0.00 55.73 57.03 3ngb s ARG 44 Cb 0.05 -3.01 -0.13 0.00 0.52 0.00 0.00 34.95 32.38 3ngb s ARG 44 CO -0.09 -0.16 1.63 -2.30 0.02 0.00 0.00 175.30 174.40 3ngb n PRO 45 N 0.70 2.20 -3.93 3.54 -0.02 -1.26 -4.75 135.00 131.48 3ngb n PRO 45 Ca 0.01 0.79 -0.35 0.00 -2.02 0.00 0.00 63.50 61.93 3ngb n PRO 45 Cb 0.43 -2.58 -0.13 0.00 -0.02 0.00 0.00 33.50 31.20 3ngb n PRO 45 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3ngb s GLU 46 N 1.38 3.58 -0.11 -0.52 2.12 -0.56 -4.97 118.70 119.61 3ngb s GLU 46 Ca 0.81 -0.53 -0.30 0.00 0.36 0.00 0.00 54.97 55.31 3ngb s GLU 46 Cb -0.67 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 30.56 3ngb s GLU 46 CO 0.39 -0.10 1.13 -0.46 -0.54 0.00 0.00 175.26 175.68 3ngb s TRP 47 N 1.31 3.25 -0.13 5.30 -0.00 -1.26 -1.36 118.94 126.05 3ngb s TRP 47 Ca 0.04 1.33 0.18 0.00 -0.00 0.00 0.00 56.10 57.65 3ngb s TRP 47 Cb -0.15 -3.35 -0.19 0.00 -0.00 0.00 0.00 33.47 29.79 3ngb s TRP 47 CO 0.01 -0.94 0.61 -1.33 -0.00 0.00 0.00 176.95 175.31 3ngb n MET 48 N 5.55 0.64 0.00 5.86 2.81 0.60 -4.72 117.12 127.86 3ngb n MET 48 Ca 0.11 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 3ngb n MET 48 Cb 0.47 -1.70 0.00 0.00 -0.71 0.00 0.00 33.22 31.28 3ngb n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ngb n GLY 49 N 1.43 4.19 3.81 3.03 0.00 -1.25 -2.16 105.19 114.24 3ngb n GLY 49 Ca -0.13 -1.25 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 3ngb n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3ngb s TRP 50 N -2.00 2.74 -0.06 1.61 1.48 -1.14 -2.34 118.94 119.23 3ngb s TRP 50 Ca 0.00 -0.44 -0.05 0.00 -1.06 0.00 0.00 56.10 54.56 3ngb s TRP 50 Cb 0.00 -1.92 0.02 0.00 -1.16 0.00 0.00 33.47 30.41 3ngb s TRP 50 CO 0.00 0.11 0.16 -1.17 -4.06 0.00 0.00 176.95 171.99 3ngb s LEU 51 N -3.99 1.14 -0.37 -4.66 0.20 0.44 -2.32 118.68 109.13 3ngb s LEU 51 Ca 0.43 0.32 -0.06 0.00 0.69 0.00 0.00 54.13 55.51 3ngb s LEU 51 Cb -0.02 0.49 0.06 0.00 -0.43 0.00 0.00 46.19 46.30 3ngb s LEU 51 CO 0.25 -0.09 0.16 -0.54 -0.29 0.00 0.00 176.35 175.84 3ngb s LYS 52 N 0.48 2.49 0.55 1.98 1.02 -0.27 -0.59 119.74 125.39 3ngb s LYS 52 Ca -0.03 -1.39 0.41 0.00 0.02 0.00 0.00 55.97 54.98 3ngb s LYS 52 Cb -0.05 -3.55 1.61 0.00 -0.52 0.00 0.00 37.83 35.32 3ngb s LYS 52 CO -0.02 -0.82 1.73 -1.35 -0.92 0.00 0.00 175.35 173.97 3ngb h PRO 52 N 8.22 0.00 -5.84 -1.68 0.11 -1.83 -1.84 132.00 129.15 3ngb h PRO 52 Ca -0.21 -0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.41 3ngb h PRO 52 Cb 1.07 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3ngb h PRO 52 CO 0.66 0.00 1.47 0.50 -0.21 0.00 0.00 178.00 180.42 3ngb s ARG 53 N -4.93 2.43 0.00 1.05 6.06 -1.26 -3.05 118.95 119.26 3ngb s ARG 53 Ca -0.05 0.95 0.00 0.00 -2.50 0.00 0.00 55.73 54.13 3ngb s ARG 53 Cb 0.24 -4.46 0.00 0.00 0.06 0.00 0.00 34.95 30.79 3ngb s ARG 53 CO 0.83 -2.94 0.00 0.41 -2.50 0.00 0.00 175.30 171.11 3ngb n GLY 54 N 5.82 3.02 1.72 8.12 0.00 -1.26 -3.86 105.19 118.75 3ngb n GLY 54 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3ngb n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ngb n GLY 55 N -2.00 0.47 3.73 -0.02 0.00 -0.71 -5.01 105.19 101.65 3ngb n GLY 55 Ca 0.00 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 3ngb n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngb n ALA 56 N 0.58 1.90 -2.46 4.61 0.00 -1.14 -4.73 120.51 119.27 3ngb n ALA 56 Ca 0.00 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.70 3ngb n ALA 56 Cb 0.00 -2.36 -0.11 0.00 0.00 0.00 0.00 19.45 16.99 3ngb n ALA 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ngb s VAL 57 N -0.80 0.47 -0.30 0.00 0.11 -1.26 -1.11 120.40 117.50 3ngb s VAL 57 Ca 0.57 -1.53 -0.03 0.00 -2.93 0.00 0.00 61.98 58.06 3ngb s VAL 57 Cb -0.53 -1.16 0.11 0.00 -1.53 0.00 0.00 36.38 33.27 3ngb s VAL 57 CO 0.59 -0.71 0.14 0.21 -3.33 0.00 0.00 175.10 172.00 3ngb s ASN 58 N -2.39 3.52 0.23 3.54 3.84 -0.98 -5.02 114.94 117.68 3ngb s ASN 58 Ca 0.01 -1.47 -0.26 0.00 0.21 0.00 0.00 52.86 51.35 3ngb s ASN 58 Cb -0.01 -0.43 -0.09 0.00 -0.55 0.00 0.00 41.25 40.18 3ngb s ASN 58 CO -0.04 -0.42 0.85 -0.31 -2.79 0.00 0.00 177.10 174.40 3ngb s TYR 59 N 1.88 3.84 0.45 0.43 2.02 -1.26 -2.88 117.35 121.83 3ngb s TYR 59 Ca 0.10 1.71 -0.24 0.00 -0.37 0.00 0.00 57.07 58.28 3ngb s TYR 59 Cb -0.17 -2.84 -0.07 0.00 -0.40 0.00 0.00 41.96 38.47 3ngb s TYR 59 CO -0.30 0.40 1.25 0.00 -1.57 0.00 0.00 175.55 175.33 3ngb s ALA 60 N -1.33 3.06 0.17 3.71 0.00 -0.92 -4.82 121.76 121.63 3ngb s ALA 60 Ca 0.42 1.11 -0.19 0.00 0.00 0.00 0.00 51.96 53.30 3ngb s ALA 60 Cb -0.22 -3.45 0.10 0.00 0.00 0.00 0.00 23.12 19.55 3ngb s ALA 60 CO 0.26 -0.83 1.64 0.00 0.00 0.00 0.00 175.76 176.83 3ngb h ARG 61 N 2.21 -0.12 0.00 0.00 3.08 -1.94 -1.00 114.38 116.61 3ngb h ARG 61 Ca -0.50 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.56 3ngb h ARG 61 Cb 1.26 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3ngb h ARG 61 CO 0.61 -0.08 0.12 -1.35 -1.07 0.00 0.00 179.97 178.20 3ngb h PRO 62 N -0.12 0.00 0.00 0.04 0.11 -1.97 -2.58 132.00 127.48 3ngb h PRO 62 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 3ngb h PRO 62 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.53 3ngb h PRO 62 CO -0.48 0.00 -0.52 1.28 -0.21 0.00 0.00 178.00 178.08 3ngb n LEU 63 N -2.72 0.37 -4.68 2.35 4.77 -0.45 -5.00 117.00 111.65 3ngb n LEU 63 Ca -0.02 -0.45 -0.46 0.00 -0.03 0.00 0.00 56.01 55.05 3ngb n LEU 63 Cb 0.17 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.22 3ngb n LEU 63 CO 0.14 0.09 1.33 0.00 -1.33 0.00 0.00 177.39 177.62 3ngb n GLN 64 N -1.27 2.29 0.00 3.23 6.02 -0.79 -1.60 117.38 125.26 3ngb n GLN 64 Ca 0.01 0.83 0.00 0.00 -0.01 0.00 0.00 57.00 57.83 3ngb n GLN 64 Cb 0.15 -2.65 0.00 0.00 1.02 0.00 0.00 30.24 28.76 3ngb n GLN 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ngb n GLY 65 N 3.83 2.22 0.06 1.08 0.00 -1.26 -4.81 105.19 106.31 3ngb n GLY 65 Ca 0.19 -0.37 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 3ngb n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ngb n ARG 66 N 0.00 1.30 -3.52 1.61 1.74 -0.62 -4.94 116.66 112.22 3ngb n ARG 66 Ca 0.00 -0.04 -0.33 0.00 -0.77 0.00 0.00 57.85 56.72 3ngb n ARG 66 Cb 0.00 -1.39 -0.05 0.00 -1.02 0.00 0.00 32.46 30.00 3ngb n ARG 66 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3ngb s VAL 67 N -2.53 5.03 -0.21 1.55 0.11 -0.74 -1.43 120.40 122.18 3ngb s VAL 67 Ca -0.07 0.37 -0.10 0.00 -2.93 0.00 0.00 61.98 59.25 3ngb s VAL 67 Cb 0.06 -3.63 0.08 0.00 -1.53 0.00 0.00 36.38 31.35 3ngb s VAL 67 CO 0.64 0.06 0.48 -0.89 -3.33 0.00 0.00 175.10 172.05 3ngb s THR 68 N -1.66 -0.31 -0.07 5.04 2.01 -0.04 -4.93 115.64 115.69 3ngb s THR 68 Ca 0.42 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.56 3ngb s THR 68 Cb -0.12 -0.72 -0.00 0.00 0.01 0.00 0.00 72.50 71.67 3ngb s THR 68 CO 0.21 0.04 -0.21 -0.04 -0.69 0.00 0.00 174.62 173.93 3ngb s MET 69 N 1.96 2.44 0.18 4.92 -1.94 -1.26 -0.67 119.30 124.93 3ngb s MET 69 Ca -0.07 -0.76 0.03 0.00 -1.71 0.00 0.00 55.69 53.18 3ngb s MET 69 Cb -0.09 -1.97 -0.01 0.00 2.01 0.00 0.00 34.83 34.76 3ngb s MET 69 CO -0.14 0.23 0.12 0.25 -0.01 0.00 0.00 175.02 175.47 3ngb n THR 70 N 3.32 0.00 -3.55 2.05 -2.24 -0.94 -4.99 114.28 107.93 3ngb n THR 70 Ca -0.19 -1.22 -0.07 0.00 -2.27 0.00 0.00 64.05 60.31 3ngb n THR 70 Cb 0.52 0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 69.30 3ngb n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ngb s ARG 71 N -2.71 0.69 -0.30 -0.78 3.03 -1.26 -0.97 118.95 116.65 3ngb s ARG 71 Ca 0.17 -0.27 0.02 0.00 2.03 0.00 0.00 55.73 57.68 3ngb s ARG 71 Cb 0.01 0.31 0.08 0.00 -1.03 0.00 0.00 34.95 34.32 3ngb s ARG 71 CO 0.12 -0.30 0.01 0.34 -1.13 0.00 0.00 175.30 174.34 3ngb s ASP 72 N -2.45 4.37 0.16 -2.89 3.68 0.37 -4.99 116.67 114.91 3ngb s ASP 72 Ca 0.07 -1.71 -0.16 0.00 2.13 0.00 0.00 52.55 52.87 3ngb s ASP 72 Cb -0.01 -1.37 0.07 0.00 -1.45 0.00 0.00 42.92 40.15 3ngb s ASP 72 CO -0.07 -0.32 1.75 0.58 0.13 0.00 0.00 175.17 177.24 3ngb h VAL 73 N 6.63 0.88 -0.27 1.11 2.07 -1.92 0.13 116.25 124.87 3ngb h VAL 73 Ca -0.11 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 3ngb h VAL 73 Cb 1.03 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 3ngb h VAL 73 CO 0.48 0.05 -0.18 0.22 0.02 0.00 0.00 177.57 178.15 3ngb h TYR 74 N 0.26 0.52 0.00 1.57 5.03 -1.96 -2.17 116.97 120.22 3ngb h TYR 74 Ca 0.17 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.38 3ngb h TYR 74 Cb 0.15 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.30 3ngb h TYR 74 CO -0.15 0.64 -0.09 0.45 -1.32 0.00 0.00 178.16 177.68 3ngb n SER 75 N -4.17 0.32 -1.93 -2.11 2.88 -0.80 -4.92 113.62 102.88 3ngb n SER 75 Ca 0.00 0.42 -0.19 0.00 -1.33 0.00 0.00 58.87 57.77 3ngb n SER 75 Cb 0.36 -0.46 -0.03 0.00 -0.75 0.00 0.00 64.21 63.33 3ngb n SER 75 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3ngb n ASP 76 N -1.74 -5.34 -4.49 -3.46 8.00 0.38 -4.87 116.55 105.02 3ngb n ASP 76 Ca 0.06 0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.35 3ngb n ASP 76 Cb 0.37 -4.42 -0.12 0.00 -0.02 0.00 0.00 41.12 36.93 3ngb n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ngb s THR 77 N -2.86 3.09 -0.01 -3.53 2.01 -1.03 -1.19 115.64 112.12 3ngb s THR 77 Ca 0.00 -0.86 0.07 0.00 0.31 0.00 0.00 61.69 61.21 3ngb s THR 77 Cb 0.00 -2.26 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 3ngb s THR 77 CO 0.00 0.49 -0.22 0.00 -0.69 0.00 0.00 174.62 174.20 3ngb s ALA 78 N -0.83 2.37 0.16 7.40 0.00 -1.02 -0.48 121.76 129.36 3ngb s ALA 78 Ca 0.13 -1.11 0.11 0.00 0.00 0.00 0.00 51.96 51.10 3ngb s ALA 78 Cb -0.11 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 3ngb s ALA 78 CO 0.03 0.54 -0.25 -0.06 0.00 0.00 0.00 175.76 176.02 3ngb s PHE 79 N -0.71 2.29 -0.01 0.00 0.40 -0.15 -0.42 117.98 119.38 3ngb s PHE 79 Ca 0.11 -0.37 0.03 0.00 -0.60 0.00 0.00 56.93 56.10 3ngb s PHE 79 Cb -0.10 -1.18 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 3ngb s PHE 79 CO 0.01 0.42 -0.11 -1.17 0.70 0.00 0.00 175.22 175.07 3ngb s LEU 80 N -2.39 1.95 -0.06 -0.37 2.96 -0.55 -2.22 118.68 118.00 3ngb s LEU 80 Ca 0.18 -0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 3ngb s LEU 80 Cb -0.09 -0.57 0.03 0.00 0.50 0.00 0.00 46.19 46.06 3ngb s LEU 80 CO 0.08 0.12 -0.00 -0.70 -1.32 0.00 0.00 176.35 174.52 3ngb s GLU 81 N -0.13 0.57 -0.17 1.98 2.12 0.16 -1.90 118.70 121.33 3ngb s GLU 81 Ca 0.02 0.07 0.01 0.00 0.36 0.00 0.00 54.97 55.43 3ngb s GLU 81 Cb -0.06 -0.84 0.01 0.00 0.26 0.00 0.00 34.13 33.50 3ngb s GLU 81 CO -0.00 -0.23 -0.19 -1.17 -0.54 0.00 0.00 175.26 173.13 3ngb s LEU 82 N 1.62 2.24 0.52 2.70 2.96 -0.99 -0.86 118.68 126.86 3ngb s LEU 82 Ca -0.01 -0.59 0.08 0.00 -0.22 0.00 0.00 54.13 53.40 3ngb s LEU 82 Cb -0.13 -1.50 0.04 0.00 0.50 0.00 0.00 46.19 45.10 3ngb s LEU 82 CO -0.03 0.04 0.57 0.00 -1.32 0.00 0.00 176.35 175.61 3ngb s ARG 82 N 1.06 2.40 -1.34 1.98 1.70 -0.52 -1.12 118.95 123.11 3ngb s ARG 82 Ca -0.01 -1.68 -0.19 0.00 -0.47 0.00 0.00 55.73 53.38 3ngb s ARG 82 Cb -0.14 -2.45 0.02 0.00 -0.57 0.00 0.00 34.95 31.81 3ngb s ARG 82 CO -0.06 -0.59 0.43 -1.13 -1.08 0.00 0.00 175.30 172.87 3ngb n SER 82 N -1.92 -2.11 -4.75 -2.89 3.41 -1.15 -4.84 113.62 99.37 3ngb n SER 82 Ca 0.07 -1.26 -0.39 0.00 -0.26 0.00 0.00 58.87 57.04 3ngb n SER 82 Cb 0.62 -1.85 0.04 0.00 -0.26 0.00 0.00 64.21 62.76 3ngb n SER 82 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ngb s LEU 82 N -7.35 3.91 0.25 1.04 1.43 -0.09 -4.65 118.68 113.22 3ngb s LEU 82 Ca 0.28 2.81 0.07 0.00 -1.03 0.00 0.00 54.13 56.26 3ngb s LEU 82 Cb -0.15 -4.20 -0.05 0.00 0.03 0.00 0.00 46.19 41.82 3ngb s LEU 82 CO 0.97 -1.49 -0.09 0.28 0.23 0.00 0.00 176.35 176.25 3ngb s THR 83 N -1.28 1.64 -0.16 5.49 -1.32 -1.26 -1.02 115.64 117.73 3ngb s THR 83 Ca 0.69 -2.15 0.23 0.00 -1.21 0.00 0.00 61.69 59.25 3ngb s THR 83 Cb -0.41 -2.28 0.23 0.00 -1.51 0.00 0.00 72.50 68.53 3ngb s THR 83 CO 0.50 -0.42 1.71 1.62 -2.21 0.00 0.00 174.62 175.81 3ngb h VAL 84 N 2.41 0.00 0.00 5.08 3.04 -1.97 0.16 116.25 124.97 3ngb h VAL 84 Ca -0.39 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 3ngb h VAL 84 Cb 1.23 0.54 0.00 0.00 -2.01 0.00 0.00 31.29 31.05 3ngb h VAL 84 CO 0.65 0.00 -0.00 0.47 -1.01 0.00 0.00 177.57 177.67 3ngb n ASP 85 N -2.31 0.34 -0.29 3.17 8.00 -1.26 -3.00 116.55 121.20 3ngb n ASP 85 Ca -0.01 0.53 0.09 0.00 0.71 0.00 0.00 54.79 56.10 3ngb n ASP 85 Cb 0.05 -0.62 0.41 0.00 -0.02 0.00 0.00 41.12 40.94 3ngb n ASP 85 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3ngb n ASP 86 N -1.82 0.86 -4.62 -2.24 8.00 0.56 -4.83 116.55 112.47 3ngb n ASP 86 Ca 0.06 -1.62 -0.43 0.00 0.71 0.00 0.00 54.79 53.51 3ngb n ASP 86 Cb 0.38 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.39 3ngb n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ngb s THR 87 N -1.88 3.87 0.16 -3.53 2.01 -1.16 -4.86 115.64 110.26 3ngb s THR 87 Ca 0.28 0.95 -0.23 0.00 0.31 0.00 0.00 61.69 63.00 3ngb s THR 87 Cb 0.14 -3.98 0.08 0.00 0.01 0.00 0.00 72.50 68.75 3ngb s THR 87 CO 0.22 -0.49 1.08 0.00 -0.69 0.00 0.00 174.62 174.73 3ngb s ALA 88 N 5.18 -1.72 -0.34 7.40 0.00 -0.91 -4.68 121.76 126.69 3ngb s ALA 88 Ca 0.65 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 52.16 3ngb s ALA 88 Cb -0.19 0.80 0.00 0.00 0.00 0.00 0.00 23.12 23.74 3ngb s ALA 88 CO 0.29 -1.08 0.20 0.08 0.00 0.00 0.00 175.76 175.25 3ngb s VAL 89 N -2.06 4.80 -0.20 0.00 1.01 -0.96 -0.66 120.40 122.32 3ngb s VAL 89 Ca 0.24 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 61.50 3ngb s VAL 89 Cb -0.03 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 3ngb s VAL 89 CO 0.05 -0.07 0.57 -0.31 0.00 0.00 0.00 175.10 175.34 3ngb s TYR 90 N 1.63 3.37 0.19 5.22 1.51 -0.67 -1.49 117.35 127.11 3ngb s TYR 90 Ca 0.04 0.84 0.08 0.00 -1.01 0.00 0.00 57.07 57.02 3ngb s TYR 90 Cb -0.18 -2.73 -0.04 0.00 -0.11 0.00 0.00 41.96 38.90 3ngb s TYR 90 CO 0.08 -0.15 -0.01 -0.06 -1.11 0.00 0.00 175.55 174.30 3ngb s PHE 91 N 1.82 2.79 -0.08 2.71 0.08 0.97 -0.52 117.98 125.75 3ngb s PHE 91 Ca 0.26 -0.16 0.01 0.00 0.12 0.00 0.00 56.93 57.16 3ngb s PHE 91 Cb -0.16 -1.33 -0.02 0.00 -0.57 0.00 0.00 43.02 40.94 3ngb s PHE 91 CO 0.10 0.54 -0.12 0.00 -0.10 0.00 0.00 175.22 175.64 3ngb s THR 93 N -0.34 1.00 -0.05 0.00 -4.23 -0.54 -1.71 115.64 109.75 3ngb s THR 93 Ca 0.04 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.77 3ngb s THR 93 Cb -0.13 -1.47 0.01 0.00 1.34 0.00 0.00 72.50 72.26 3ngb s THR 93 CO 0.02 -0.60 0.14 -0.60 -0.54 0.00 0.00 174.62 173.05 3ngb s ARG 94 N -2.99 0.16 0.87 3.99 3.52 -0.88 -1.22 118.95 122.40 3ngb s ARG 94 Ca 0.08 0.20 -0.11 0.00 -0.13 0.00 0.00 55.73 55.77 3ngb s ARG 94 Cb -0.02 0.08 0.12 0.00 -1.56 0.00 0.00 34.95 33.57 3ngb s ARG 94 CO 0.00 -0.02 1.16 0.20 -0.81 0.00 0.00 175.30 175.83 3ngb s GLY 95 N 0.08 1.82 0.31 8.12 0.00 -1.25 -2.78 107.32 113.62 3ngb s GLY 95 Ca -0.00 0.63 0.06 0.00 0.00 0.00 0.00 44.72 45.41 3ngb s GLY 95 CO 0.00 1.04 1.80 1.70 0.00 0.00 0.00 173.10 177.65 3ngb h LYS 96 N -1.53 0.76 -4.46 2.90 3.64 -1.24 -3.42 116.57 113.21 3ngb h LYS 96 Ca -0.44 -0.05 -0.19 0.00 -1.27 0.00 0.00 60.65 58.71 3ngb h LYS 96 Cb 1.27 -0.17 -0.15 0.00 -0.41 0.00 0.00 32.23 32.77 3ngb h LYS 96 CO 0.44 0.50 -0.66 0.54 -2.27 0.00 0.00 179.45 177.99 3ngb s ASN 97 N -5.52 0.58 0.14 4.20 4.22 -1.26 -5.00 114.94 112.30 3ngb s ASN 97 Ca -0.11 -1.13 0.20 0.00 -2.14 0.00 0.00 52.86 49.68 3ngb s ASN 97 Cb 0.24 0.22 0.84 0.00 1.28 0.00 0.00 41.25 43.83 3ngb s ASN 97 CO 0.80 -0.65 1.63 0.00 -2.04 0.00 0.00 177.10 176.84 3ngb h ASP 99 N 0.00 0.70 -3.11 0.00 3.45 -1.96 -3.44 116.42 112.06 3ngb h ASP 99 Ca 0.00 -0.80 -0.65 0.00 0.43 0.00 0.00 57.03 56.00 3ngb h ASP 99 Cb 0.34 -0.22 -0.35 0.00 -0.56 0.00 0.00 39.33 38.54 3ngb h ASP 99 CO 0.00 1.42 -0.85 -0.47 -1.57 0.00 0.00 179.24 177.77 3ngb s TYR 100 N -3.05 2.65 -0.83 4.55 6.04 -1.19 -5.03 117.35 120.49 3ngb s TYR 100 Ca -0.12 -1.57 0.27 0.00 0.04 0.00 0.00 57.07 55.69 3ngb s TYR 100 Cb 0.04 -1.84 0.87 0.00 -1.04 0.00 0.00 41.96 40.00 3ngb s TYR 100 CO 0.88 -0.78 1.75 -1.71 -1.54 0.00 0.00 175.55 174.14 3ngb n ASN 100 N 4.65 0.52 -0.32 4.32 5.15 -1.26 -4.16 115.26 124.15 3ngb n ASN 100 Ca -0.20 0.44 0.11 0.00 -0.60 0.00 0.00 54.58 54.33 3ngb n ASN 100 Cb 0.50 -0.52 -0.04 0.00 -0.53 0.00 0.00 39.78 39.19 3ngb n ASN 100 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 3ngb n TRP 100 N -1.95 0.00 -2.43 1.20 7.02 -1.26 -3.94 117.44 116.07 3ngb n TRP 100 Ca 0.06 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.11 3ngb n TRP 100 Cb 0.40 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.29 3ngb n TRP 100 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 3ngb n ASP 100 N -0.53 5.16 -4.56 -0.99 8.00 -1.26 -4.96 116.55 117.41 3ngb n ASP 100 Ca 0.07 -3.11 -0.22 0.00 0.71 0.00 0.00 54.79 52.25 3ngb n ASP 100 Cb 0.42 -1.48 -0.06 0.00 -0.02 0.00 0.00 41.12 39.98 3ngb n ASP 100 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3ngb s PHE 100 N 0.38 1.15 -0.09 1.24 0.08 -1.26 -0.91 117.98 118.57 3ngb s PHE 100 Ca 0.40 1.79 0.15 0.00 0.12 0.00 0.00 56.93 59.38 3ngb s PHE 100 Cb 0.08 -3.52 -0.13 0.00 -0.57 0.00 0.00 43.02 38.89 3ngb s PHE 100 CO 0.01 -1.89 0.95 1.49 -0.10 0.00 0.00 175.22 175.67 3ngb h GLU 101 N 14.89 0.00 -5.06 0.44 4.81 -1.77 -3.46 114.58 124.43 3ngb h GLU 101 Ca -0.08 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.50 3ngb h GLU 101 Cb 1.09 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.20 3ngb h GLU 101 CO 1.07 0.44 -0.72 -1.01 -0.73 0.00 0.00 179.01 178.06 3ngb s HIS 102 N -2.84 2.95 0.11 0.92 3.76 -1.12 -5.01 115.29 114.07 3ngb s HIS 102 Ca -0.02 -0.82 0.09 0.00 -0.15 0.00 0.00 55.06 54.17 3ngb s HIS 102 Cb 0.08 -2.07 -0.04 0.00 1.11 0.00 0.00 32.58 31.67 3ngb s HIS 102 CO 0.80 -0.45 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.43 3ngb s TRP 103 N 1.25 2.01 0.75 1.40 0.52 -1.26 -2.07 118.94 121.55 3ngb s TRP 103 Ca 0.03 -0.40 -0.11 0.00 0.02 0.00 0.00 56.10 55.64 3ngb s TRP 103 Cb -0.14 -1.10 0.04 0.00 -1.15 0.00 0.00 33.47 31.12 3ngb s TRP 103 CO -0.01 0.26 1.08 0.20 0.02 0.00 0.00 176.95 178.50 3ngb s GLY 104 N -1.96 1.64 0.41 0.98 0.00 -0.70 -4.65 107.32 103.05 3ngb s GLY 104 Ca 0.10 -0.11 0.29 0.00 0.00 0.00 0.00 44.72 44.99 3ngb s GLY 104 CO 0.05 0.26 1.88 3.21 0.00 0.00 0.00 173.10 178.50 3ngb h ARG 105 N -0.91 0.00 0.00 2.90 3.08 -1.93 -3.45 114.38 114.07 3ngb h ARG 105 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3ngb h ARG 105 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3ngb h ARG 105 CO 0.59 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.90 3ngb n GLY 106 N -0.76 2.41 2.92 0.04 0.00 -1.26 -5.01 105.19 103.52 3ngb n GLY 106 Ca -0.01 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 3ngb n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ngb s THR 107 N -1.39 2.15 0.30 2.61 2.01 0.32 -4.86 115.64 116.79 3ngb s THR 107 Ca 0.00 -2.69 -0.29 0.00 0.31 0.00 0.00 61.69 59.02 3ngb s THR 107 Cb 0.00 -2.54 -0.11 0.00 0.01 0.00 0.00 72.50 69.86 3ngb s THR 107 CO 0.00 -0.73 1.49 -2.84 -0.69 0.00 0.00 174.62 171.85 3ngb s PRO 108 N 0.40 4.19 -0.06 4.92 0.02 -1.26 -1.66 135.00 141.55 3ngb s PRO 108 Ca 0.14 2.45 0.01 0.00 0.02 0.00 0.00 61.00 63.62 3ngb s PRO 108 Cb -0.22 -3.04 0.02 0.00 0.02 0.00 0.00 34.50 31.28 3ngb s PRO 108 CO -0.05 -0.50 -0.06 0.08 -0.33 0.00 0.00 177.00 176.15 3ngb s VAL 109 N -0.40 0.69 -0.26 3.83 1.01 0.16 -0.97 120.40 124.46 3ngb s VAL 109 Ca 0.58 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.39 3ngb s VAL 109 Cb -0.45 -0.71 0.05 0.00 0.00 0.00 0.00 36.38 35.27 3ngb s VAL 109 CO 0.51 0.27 -0.08 -0.63 0.00 0.00 0.00 175.10 175.17 3ngb s ILE 110 N 1.12 2.50 -0.70 2.22 1.01 -0.51 -2.14 121.20 124.70 3ngb s ILE 110 Ca -0.07 -1.43 -0.18 0.00 0.00 0.00 0.00 60.65 58.97 3ngb s ILE 110 Cb -0.14 -2.41 0.13 0.00 0.01 0.00 0.00 42.46 40.06 3ngb s ILE 110 CO -0.01 0.02 0.80 -0.69 0.00 0.00 0.00 174.94 175.06 3ngb s VAL 111 N 1.19 4.95 -0.15 2.92 1.01 -1.26 -0.56 120.40 128.50 3ngb s VAL 111 Ca -0.06 -1.39 -0.20 0.00 0.00 0.00 0.00 61.98 60.33 3ngb s VAL 111 Cb -0.19 -4.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.61 3ngb s VAL 111 CO -0.04 -1.19 0.58 -0.94 0.00 0.00 0.00 175.10 173.51 3ngb s SER 112 N 3.35 6.72 -0.12 3.32 1.04 -0.55 -4.48 113.70 122.98 3ngb s SER 112 Ca 0.17 0.87 -0.05 0.00 0.48 0.00 0.00 55.95 57.42 3ngb s SER 112 Cb -0.18 -2.33 -0.04 0.00 0.10 0.00 0.00 66.02 63.57 3ngb s SER 112 CO 0.00 -0.15 0.06 -0.55 0.98 0.00 0.00 173.24 173.58 3ngb s SER 113 N 0.96 5.69 0.28 7.02 0.15 -1.26 -4.24 113.70 122.30 3ngb s SER 113 Ca 0.29 0.23 0.11 0.00 0.70 0.00 0.00 55.95 57.28 3ngb s SER 113 Cb -0.16 -1.78 0.40 0.00 -1.71 0.00 0.00 66.02 62.77 3ngb s SER 113 CO 0.12 0.34 1.63 -0.65 1.20 0.00 0.00 173.24 175.88 3ngb h PRO 114 N 5.45 0.00 -6.87 5.44 0.11 -2.00 -3.46 132.00 130.67 3ngb h PRO 114 Ca -0.49 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.09 3ngb h PRO 114 Cb 1.20 0.00 0.08 0.00 0.11 0.00 0.00 31.00 32.39 3ngb h PRO 114 CO 0.59 0.59 0.74 0.45 -0.21 0.00 0.00 178.00 180.16 3ngb s SER 115 N -6.83 6.54 0.19 -2.05 0.15 -1.26 -5.02 113.70 105.42 3ngb s SER 115 Ca -0.01 2.86 -0.03 0.00 0.70 0.00 0.00 55.95 59.46 3ngb s SER 115 Cb 0.13 -2.65 -0.03 0.00 -1.71 0.00 0.00 66.02 61.75 3ngb s SER 115 CO 0.76 -0.74 0.18 0.42 1.20 0.00 0.00 173.24 175.05 3ngb s THR 116 N -0.80 0.02 -0.19 6.45 -4.23 -1.26 -4.65 115.64 110.98 3ngb s THR 116 Ca 0.54 -1.86 -0.12 0.00 -1.18 0.00 0.00 61.69 59.06 3ngb s THR 116 Cb -0.44 -2.34 0.06 0.00 1.34 0.00 0.00 72.50 71.12 3ngb s THR 116 CO 0.55 -0.09 0.48 -0.75 -0.54 0.00 0.00 174.62 174.26 3ngb s LYS 117 N -4.11 0.49 0.47 3.99 2.20 -0.45 -4.97 119.74 117.36 3ngb s LYS 117 Ca 0.33 0.84 -0.22 0.00 -0.36 0.00 0.00 55.97 56.56 3ngb s LYS 117 Cb 0.06 0.08 -0.08 0.00 -1.51 0.00 0.00 37.83 36.38 3ngb s LYS 117 CO 0.09 -0.14 1.09 0.20 -0.36 0.00 0.00 175.35 176.24 3ngb s GLY 118 N 1.17 2.67 0.38 5.54 0.00 -1.26 -2.39 107.32 113.42 3ngb s GLY 118 Ca -0.07 0.76 -0.23 0.00 0.00 0.00 0.00 44.72 45.18 3ngb s GLY 118 CO -0.11 1.15 0.93 -4.14 0.00 0.00 0.00 173.10 170.94 3ngb s PRO 119 N -2.91 4.36 -0.43 2.90 0.02 -1.26 -4.59 135.00 133.08 3ngb s PRO 119 Ca 0.65 1.17 -0.15 0.00 0.02 0.00 0.00 61.00 62.69 3ngb s PRO 119 Cb -0.23 -2.46 0.04 0.00 0.02 0.00 0.00 34.50 31.88 3ngb s PRO 119 CO 0.27 0.11 0.34 -1.12 -0.33 0.00 0.00 177.00 176.27 3ngb s SER 120 N -1.95 6.12 -0.39 2.53 0.01 0.17 -4.88 113.70 115.31 3ngb s SER 120 Ca 0.56 -1.08 -0.22 0.00 1.31 0.00 0.00 55.95 56.53 3ngb s SER 120 Cb -0.13 -2.17 0.01 0.00 0.21 0.00 0.00 66.02 63.95 3ngb s SER 120 CO 0.18 -0.53 0.73 -0.69 0.41 0.00 0.00 173.24 173.34 3ngb s VAL 121 N 1.66 4.76 -0.03 3.43 1.01 -1.26 -2.02 120.40 127.95 3ngb s VAL 121 Ca 0.05 0.61 0.02 0.00 0.00 0.00 0.00 61.98 62.66 3ngb s VAL 121 Cb -0.21 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 3ngb s VAL 121 CO 0.09 -0.49 -0.05 -0.36 0.00 0.00 0.00 175.10 174.28 3ngb s PHE 122 N 3.02 2.95 0.25 5.22 0.08 -1.15 -4.91 117.98 123.44 3ngb s PHE 122 Ca 0.28 0.02 -0.30 0.00 0.12 0.00 0.00 56.93 57.05 3ngb s PHE 122 Cb -0.13 -1.67 -0.09 0.00 -0.57 0.00 0.00 43.02 40.56 3ngb s PHE 122 CO 0.18 0.38 1.06 -2.14 -0.10 0.00 0.00 175.22 174.60 3ngb s PRO 123 N -1.16 4.68 -0.95 0.24 0.02 -1.26 -0.73 135.00 135.84 3ngb s PRO 123 Ca 0.15 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 62.88 3ngb s PRO 123 Cb -0.11 -3.23 0.30 0.00 0.02 0.00 0.00 34.50 31.49 3ngb s PRO 123 CO 0.05 0.26 1.40 1.28 -0.33 0.00 0.00 177.00 179.66 3ngb n LEU 124 N 1.46 6.06 -4.59 -5.54 4.32 0.08 -4.90 117.00 113.88 3ngb n LEU 124 Ca -0.01 -5.34 -0.42 0.00 -0.02 0.00 0.00 56.01 50.22 3ngb n LEU 124 Cb 0.45 -1.08 0.01 0.00 -1.62 0.00 0.00 43.42 41.18 3ngb n LEU 124 CO 0.53 1.90 0.52 0.00 -1.22 0.00 0.00 177.39 179.12 3ngb n ALA 125 N 0.75 -0.11 -2.05 -1.18 0.00 -1.26 -3.33 120.51 113.33 3ngb n ALA 125 Ca 0.32 0.25 -0.34 0.00 0.00 0.00 0.00 53.44 53.67 3ngb n ALA 125 Cb 0.33 -2.03 -0.04 0.00 0.00 0.00 0.00 19.45 17.71 3ngb n ALA 125 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3ngb s PRO 126 N -1.87 2.61 0.00 0.00 0.02 -1.26 -4.86 135.00 129.63 3ngb s PRO 126 Ca 0.62 0.28 0.00 0.00 0.02 0.00 0.00 61.00 61.92 3ngb s PRO 126 Cb -0.59 -4.63 0.00 0.00 0.02 0.00 0.00 34.50 29.30 3ngb s PRO 126 CO 0.57 -2.96 0.00 -1.13 -0.33 0.00 0.00 177.00 173.16 3ngb n SER 127 N 13.15 0.00 0.10 2.53 3.41 -1.26 -3.70 113.62 127.85 3ngb n SER 127 Ca 0.27 -0.81 -0.04 0.00 -0.26 0.00 0.00 58.87 58.03 3ngb n SER 127 Cb 0.50 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.47 3ngb n SER 127 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3ngb h SER 128 N 0.00 0.00 -0.94 4.04 4.64 -1.93 -3.28 113.55 116.08 3ngb h SER 128 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3ngb h SER 128 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 3ngb h SER 128 CO 0.00 0.82 0.74 0.29 -0.87 0.00 0.00 176.83 177.81 3ngb n LYS 129 N -3.55 2.42 -1.62 4.77 5.02 -1.26 -4.03 118.16 119.90 3ngb n LYS 129 Ca -0.01 -2.97 -0.02 0.00 -2.02 0.00 0.00 58.31 53.30 3ngb n LYS 129 Cb 0.79 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 3ngb n LYS 129 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3ngb n SER 130 N -0.88 -0.02 -3.75 4.39 3.41 -1.24 -5.07 113.62 110.47 3ngb n SER 130 Ca 0.58 -2.03 -0.28 0.00 -0.26 0.00 0.00 58.87 56.88 3ngb n SER 130 Cb 1.03 0.04 -0.16 0.00 -0.26 0.00 0.00 64.21 64.85 3ngb n SER 130 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3ngb s THR 131 N -0.44 0.59 -0.81 6.66 -4.23 -1.26 -2.28 115.64 113.87 3ngb s THR 131 Ca 0.17 -0.61 -0.18 0.00 -1.18 0.00 0.00 61.69 59.89 3ngb s THR 131 Cb 0.24 -1.09 0.15 0.00 1.34 0.00 0.00 72.50 73.14 3ngb s THR 131 CO -0.08 -0.21 0.92 -0.55 -0.54 0.00 0.00 174.62 174.15 3ngb s SER 132 N 1.83 6.54 1.39 3.99 0.15 0.26 -4.90 113.70 122.95 3ngb s SER 132 Ca -0.01 -2.04 0.00 0.00 0.70 0.00 0.00 55.95 54.60 3ngb s SER 132 Cb -0.17 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 3ngb s SER 132 CO -0.08 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 174.02 3ngb n GLY 133 N 5.00 2.37 1.14 9.45 0.00 -1.26 -2.60 105.19 119.29 3ngb n GLY 133 Ca 0.12 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.84 3ngb n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ngb n GLY 134 N 0.00 2.09 3.15 -0.02 0.00 -1.26 -4.83 105.19 104.33 3ngb n GLY 134 Ca 0.00 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 3ngb n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ngb s THR 135 N -1.84 1.64 -0.12 2.61 2.01 -1.07 -1.42 115.64 117.46 3ngb s THR 135 Ca 0.27 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.49 3ngb s THR 135 Cb 0.20 -1.42 0.01 0.00 0.01 0.00 0.00 72.50 71.29 3ngb s THR 135 CO 0.09 0.47 -0.21 0.00 -0.69 0.00 0.00 174.62 174.27 3ngb s ALA 136 N 0.24 2.09 -0.05 7.40 0.00 -0.31 -0.58 121.76 130.55 3ngb s ALA 136 Ca -0.11 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.81 3ngb s ALA 136 Cb -0.15 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.05 3ngb s ALA 136 CO 0.05 0.10 0.24 0.00 0.00 0.00 0.00 175.76 176.15 3ngb s ALA 137 N 0.64 3.83 0.11 0.00 0.00 -0.97 -2.08 121.76 123.30 3ngb s ALA 137 Ca -0.12 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 3ngb s ALA 137 Cb -0.16 -2.09 0.00 0.00 0.00 0.00 0.00 23.12 20.87 3ngb s ALA 137 CO 0.03 0.61 0.16 1.47 0.00 0.00 0.00 175.76 178.02 3ngb n LEU 138 N 1.61 0.00 0.00 0.00 -0.00 -1.03 -4.38 117.00 113.20 3ngb n LEU 138 Ca -0.15 -0.88 0.00 0.00 -0.00 0.00 0.00 56.01 54.97 3ngb n LEU 138 Cb 0.54 0.83 0.00 0.00 -0.00 0.00 0.00 43.42 44.79 3ngb n LEU 138 CO 0.36 -0.21 0.00 0.61 -0.00 0.00 0.00 177.39 178.15 3ngb n GLY 139 N -0.18 -0.79 3.67 1.47 0.00 -1.21 -1.45 105.19 106.70 3ngb n GLY 139 Ca -0.00 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 3ngb n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngb s LEU 141 N -3.78 1.92 -0.37 0.00 2.96 0.10 -2.90 118.68 116.60 3ngb s LEU 141 Ca 0.27 -3.10 -0.28 0.00 -0.22 0.00 0.00 54.13 50.80 3ngb s LEU 141 Cb 0.07 -0.63 -0.03 0.00 0.50 0.00 0.00 46.19 46.10 3ngb s LEU 141 CO 0.14 -0.17 1.95 -0.69 -1.32 0.00 0.00 176.35 176.26 3ngb s VAL 142 N -0.08 3.32 0.11 1.68 1.01 -1.03 -2.93 120.40 122.49 3ngb s VAL 142 Ca 0.30 0.30 0.10 0.00 0.00 0.00 0.00 61.98 62.68 3ngb s VAL 142 Cb -0.00 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 3ngb s VAL 142 CO -0.17 -0.37 -0.25 -0.75 0.00 0.00 0.00 175.10 173.55 3ngb s LYS 143 N 6.30 1.37 -0.73 2.72 2.20 -0.86 -1.55 119.74 129.19 3ngb s LYS 143 Ca 0.84 -1.26 -0.03 0.00 -0.36 0.00 0.00 55.97 55.16 3ngb s LYS 143 Cb -0.22 -1.76 0.00 0.00 -1.51 0.00 0.00 37.83 34.34 3ngb s LYS 143 CO 0.31 0.42 0.66 -0.25 -0.36 0.00 0.00 175.35 176.13 3ngb n ASP 144 N 1.08 -6.81 -4.27 1.43 8.00 -0.96 -0.65 116.55 114.38 3ngb n ASP 144 Ca -0.18 -0.31 -0.15 0.00 0.71 0.00 0.00 54.79 54.86 3ngb n ASP 144 Cb 0.53 -4.04 -0.10 0.00 -0.02 0.00 0.00 41.12 37.48 3ngb n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3ngb s TYR 145 N -2.91 1.32 -0.29 1.24 1.13 -0.90 -4.16 117.35 112.79 3ngb s TYR 145 Ca 0.03 -1.05 -0.21 0.00 -1.41 0.00 0.00 57.07 54.43 3ngb s TYR 145 Cb -0.01 -0.76 0.13 0.00 -1.10 0.00 0.00 41.96 40.23 3ngb s TYR 145 CO 0.80 -0.23 1.00 0.12 -2.51 0.00 0.00 175.55 174.73 3ngb s PHE 146 N -3.66 -0.54 0.00 -3.49 2.19 -1.01 -1.28 117.98 110.20 3ngb s PHE 146 Ca 0.28 1.18 0.00 0.00 0.33 0.00 0.00 56.93 58.72 3ngb s PHE 146 Cb 0.06 0.37 0.00 0.00 -1.31 0.00 0.00 43.02 42.14 3ngb s PHE 146 CO 0.07 -0.26 0.00 -2.30 1.83 0.00 0.00 175.22 174.56 3ngb n PRO 147 N 2.90 3.51 -3.45 10.12 -0.02 -1.26 -1.34 135.00 145.46 3ngb n PRO 147 Ca -0.15 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.12 3ngb n PRO 147 Cb 0.57 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 34.04 3ngb n PRO 147 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3ngb s GLU 148 N 2.36 3.20 0.51 -0.52 2.02 -1.26 -4.79 118.70 120.22 3ngb s GLU 148 Ca 0.00 -0.79 0.07 0.00 0.02 0.00 0.00 54.97 54.27 3ngb s GLU 148 Cb 0.00 -2.76 0.07 0.00 0.10 0.00 0.00 34.13 31.53 3ngb s GLU 148 CO 0.00 0.07 0.56 -0.35 0.02 0.00 0.00 175.26 175.56 3ngb n PRO 149 N -1.71 0.69 -4.49 0.39 -0.05 -1.26 -4.93 135.00 123.64 3ngb n PRO 149 Ca -0.02 -2.96 -0.26 0.00 -0.05 0.00 0.00 63.50 60.21 3ngb n PRO 149 Cb 0.58 0.04 -0.17 0.00 -0.05 0.00 0.00 33.50 33.90 3ngb n PRO 149 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 3ngb s VAL 150 N -2.36 1.23 0.01 0.52 -7.23 -1.26 -4.45 120.40 106.86 3ngb s VAL 150 Ca 0.43 -0.51 -0.18 0.00 -1.81 0.00 0.00 61.98 59.91 3ngb s VAL 150 Cb -0.03 -1.14 -0.06 0.00 0.56 0.00 0.00 36.38 35.71 3ngb s VAL 150 CO 0.27 0.38 0.50 0.42 -0.31 0.00 0.00 175.10 176.37 3ngb s THR 151 N 0.87 4.92 -0.10 5.32 -4.23 -0.96 -4.96 115.64 116.50 3ngb s THR 151 Ca -0.10 1.06 0.00 0.00 -1.18 0.00 0.00 61.69 61.47 3ngb s THR 151 Cb -0.15 -3.83 0.02 0.00 1.34 0.00 0.00 72.50 69.88 3ngb s THR 151 CO 0.01 0.52 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.82 3ngb s VAL 152 N -0.76 1.13 0.44 2.29 1.01 -1.26 -1.71 120.40 121.54 3ngb s VAL 152 Ca 0.27 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.89 3ngb s VAL 152 Cb -0.18 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 3ngb s VAL 152 CO 0.16 0.38 0.06 -0.94 0.00 0.00 0.00 175.10 174.75 3ngb s SER 153 N 1.36 3.42 -0.06 3.32 1.04 -0.27 -4.95 113.70 117.56 3ngb s SER 153 Ca -0.01 -1.60 0.01 0.00 0.48 0.00 0.00 55.95 54.83 3ngb s SER 153 Cb -0.14 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.36 3ngb s SER 153 CO -0.05 -0.82 -0.07 0.26 0.98 0.00 0.00 173.24 173.55 3ngb s TRP 154 N -3.03 1.08 -1.58 5.02 0.52 -1.26 -0.07 118.94 119.62 3ngb s TRP 154 Ca 0.19 -0.39 -0.15 0.00 0.02 0.00 0.00 56.10 55.77 3ngb s TRP 154 Cb 0.04 -0.89 0.11 0.00 -1.15 0.00 0.00 33.47 31.57 3ngb s TRP 154 CO 0.10 -0.28 0.93 0.09 0.02 0.00 0.00 176.95 177.82 3ngb n ASN 155 N 4.19 -4.39 -3.43 2.95 3.02 -0.44 -1.85 115.26 115.32 3ngb n ASN 155 Ca -0.21 -0.84 -0.17 0.00 -0.03 0.00 0.00 54.58 53.33 3ngb n ASN 155 Cb 0.51 -3.58 0.09 0.00 -0.61 0.00 0.00 39.78 36.19 3ngb n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3ngb n SER 156 N -2.79 -2.15 0.00 6.41 7.64 -1.26 -2.51 113.62 118.96 3ngb n SER 156 Ca 0.05 -0.63 0.00 0.00 1.01 0.00 0.00 58.87 59.30 3ngb n SER 156 Cb 0.52 -5.11 0.00 0.00 -1.01 0.00 0.00 64.21 58.61 3ngb n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ngb n GLY 157 N -1.14 0.35 0.16 0.23 0.00 -0.77 -4.83 105.19 99.19 3ngb n GLY 157 Ca -0.28 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.88 3ngb n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngb n ALA 158 N 1.00 2.74 -3.86 4.61 0.00 -1.04 -4.66 120.51 119.29 3ngb n ALA 158 Ca 0.00 -0.29 -0.28 0.00 0.00 0.00 0.00 53.44 52.87 3ngb n ALA 158 Cb 0.16 -1.33 -0.16 0.00 0.00 0.00 0.00 19.45 18.12 3ngb n ALA 158 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3ngb s LEU 159 N -2.34 1.61 0.00 0.00 0.20 -1.04 -4.96 118.68 112.14 3ngb s LEU 159 Ca 0.33 -0.74 0.00 0.00 0.69 0.00 0.00 54.13 54.40 3ngb s LEU 159 Cb 0.20 -0.86 0.00 0.00 -0.43 0.00 0.00 46.19 45.11 3ngb s LEU 159 CO 0.44 -0.22 0.00 0.35 -0.29 0.00 0.00 176.35 176.63 3ngb n THR 160 N 4.90 0.00 -2.05 3.68 -2.24 -1.26 -4.34 114.28 112.96 3ngb n THR 160 Ca -0.11 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 3ngb n THR 160 Cb 0.47 -0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.50 3ngb n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3ngb s SER 161 N -1.41 5.75 0.00 3.42 0.01 -1.26 -2.86 113.70 117.35 3ngb s SER 161 Ca 0.00 0.97 0.00 0.00 1.31 0.00 0.00 55.95 58.23 3ngb s SER 161 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 3ngb s SER 161 CO 0.00 -1.88 0.00 0.61 0.41 0.00 0.00 173.24 172.38 3ngb n GLY 162 N 5.46 1.05 3.76 3.44 0.00 -1.26 -4.74 105.19 112.90 3ngb n GLY 162 Ca 0.22 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 3ngb n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ngb s VAL 163 N -2.00 5.29 -0.26 1.61 1.01 -1.14 -2.06 120.40 122.86 3ngb s VAL 163 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 61.98 62.53 3ngb s VAL 163 Cb 0.00 -3.62 0.07 0.00 0.00 0.00 0.00 36.38 32.84 3ngb s VAL 163 CO 0.00 0.43 -0.01 -1.00 0.00 0.00 0.00 175.10 174.53 3ngb s HIS 164 N 0.14 2.38 -0.49 5.22 3.76 0.59 -4.99 115.29 121.91 3ngb s HIS 164 Ca 0.17 -1.87 -0.16 0.00 -0.15 0.00 0.00 55.06 53.05 3ngb s HIS 164 Cb -0.13 -1.76 0.08 0.00 1.11 0.00 0.00 32.58 31.88 3ngb s HIS 164 CO 0.05 -0.81 0.44 0.99 -0.85 0.00 0.00 174.74 174.56 3ngb s THR 165 N 1.39 5.19 0.49 1.30 2.01 -1.26 -0.57 115.64 124.19 3ngb s THR 165 Ca -0.00 -1.06 -0.22 0.00 0.31 0.00 0.00 61.69 60.72 3ngb s THR 165 Cb -0.18 -4.17 -0.07 0.00 0.01 0.00 0.00 72.50 68.08 3ngb s THR 165 CO -0.10 -0.64 1.14 -0.36 -0.69 0.00 0.00 174.62 173.97 3ngb s PHE 166 N 1.75 2.82 0.51 4.92 0.40 -0.13 -4.98 117.98 123.27 3ngb s PHE 166 Ca 0.05 1.54 -0.23 0.00 -0.60 0.00 0.00 56.93 57.70 3ngb s PHE 166 Cb -0.24 -3.33 -0.06 0.00 0.51 0.00 0.00 43.02 39.89 3ngb s PHE 166 CO 0.07 -1.48 1.31 -2.30 0.70 0.00 0.00 175.22 173.52 3ngb n PRO 167 N -0.78 1.74 -2.12 0.24 -0.02 -1.26 -4.34 135.00 128.46 3ngb n PRO 167 Ca 0.09 0.63 -0.36 0.00 -2.02 0.00 0.00 63.50 61.84 3ngb n PRO 167 Cb 0.49 -2.50 0.01 0.00 -0.02 0.00 0.00 33.50 31.49 3ngb n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ngb s ALA 168 N -1.28 2.77 -0.08 3.55 0.00 -1.26 -4.78 121.76 120.69 3ngb s ALA 168 Ca 0.68 0.99 0.02 0.00 0.00 0.00 0.00 51.96 53.65 3ngb s ALA 168 Cb -0.44 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.27 3ngb s ALA 168 CO 0.52 -0.92 -0.12 0.08 0.00 0.00 0.00 175.76 175.32 3ngb s VAL 169 N -1.57 1.14 -0.22 0.00 1.01 -0.66 -4.94 120.40 115.16 3ngb s VAL 169 Ca 0.71 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.94 3ngb s VAL 169 Cb -0.30 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 3ngb s VAL 169 CO 0.34 0.36 1.48 -0.22 0.00 0.00 0.00 175.10 177.06 3ngb s LEU 170 N 0.85 3.97 0.81 3.92 2.96 -1.26 -2.61 118.68 127.32 3ngb s LEU 170 Ca -0.11 1.56 -0.12 0.00 -0.22 0.00 0.00 54.13 55.25 3ngb s LEU 170 Cb -0.15 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.10 3ngb s LEU 170 CO 0.01 -1.11 1.17 -1.10 -1.32 0.00 0.00 176.35 174.00 3ngb s GLN 171 N 4.32 1.78 0.47 1.98 -0.21 -0.11 -4.96 119.66 122.93 3ngb s GLN 171 Ca 0.65 -0.06 0.23 0.00 0.02 0.00 0.00 55.36 56.20 3ngb s GLN 171 Cb -0.23 -1.98 1.18 0.00 1.00 0.00 0.00 33.01 32.98 3ngb s GLN 171 CO 0.25 -1.67 1.97 0.77 -2.12 0.00 0.00 175.29 174.50 3ngb h SER 172 N -1.07 0.00 0.00 5.90 0.02 -1.95 -2.10 113.55 114.36 3ngb h SER 172 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 3ngb h SER 172 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 3ngb h SER 172 CO 0.60 0.19 0.00 -1.54 -1.14 0.00 0.00 176.83 174.94 3ngb n SER 173 N -3.72 0.00 0.00 3.07 3.41 -1.26 -4.85 113.62 110.27 3ngb n SER 173 Ca -0.01 -1.01 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 3ngb n SER 173 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 3ngb n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ngb n GLY 174 N 0.76 0.70 3.67 5.00 0.00 -0.79 -5.04 105.19 109.49 3ngb n GLY 174 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 3ngb n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ngb s LEU 175 N 0.00 3.41 0.52 0.99 1.43 -1.26 -4.87 118.68 118.90 3ngb s LEU 175 Ca 0.00 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 52.87 3ngb s LEU 175 Cb 0.00 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 3ngb s LEU 175 CO 0.00 0.19 0.81 -0.31 0.23 0.00 0.00 176.35 177.27 3ngb s TYR 176 N -1.27 3.42 -0.28 0.29 2.02 -0.40 -0.93 117.35 120.19 3ngb s TYR 176 Ca 0.24 0.69 -0.19 0.00 -0.37 0.00 0.00 57.07 57.45 3ngb s TYR 176 Cb -0.12 -2.45 0.12 0.00 -0.40 0.00 0.00 41.96 39.12 3ngb s TYR 176 CO 0.17 -0.47 0.93 0.45 -1.57 0.00 0.00 175.55 175.05 3ngb s SER 177 N -4.19 -0.58 0.35 2.29 0.15 -1.07 -2.11 113.70 108.55 3ngb s SER 177 Ca 0.50 0.98 0.07 0.00 0.70 0.00 0.00 55.95 58.19 3ngb s SER 177 Cb -0.10 1.16 -0.03 0.00 -1.71 0.00 0.00 66.02 65.34 3ngb s SER 177 CO 0.44 -0.16 0.25 -1.48 1.20 0.00 0.00 173.24 173.50 3ngb s LEU 178 N 1.05 1.82 0.02 3.45 0.05 -0.59 -1.65 118.68 122.82 3ngb s LEU 178 Ca -0.05 -1.76 0.03 0.00 0.05 0.00 0.00 54.13 52.39 3ngb s LEU 178 Cb -0.04 0.43 -0.02 0.00 -2.05 0.00 0.00 46.19 44.51 3ngb s LEU 178 CO -0.13 -1.05 -0.08 -0.44 -0.55 0.00 0.00 176.35 174.10 3ngb s SER 179 N -3.44 0.94 -0.24 1.48 0.01 -1.26 -2.46 113.70 108.73 3ngb s SER 179 Ca 0.37 -0.35 0.01 0.00 1.31 0.00 0.00 55.95 57.29 3ngb s SER 179 Cb 0.02 -0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.28 3ngb s SER 179 CO 0.25 -0.04 -0.04 -0.55 0.41 0.00 0.00 173.24 173.27 3ngb s SER 180 N -0.89 3.94 0.44 2.44 0.15 -1.14 -0.96 113.70 117.68 3ngb s SER 180 Ca -0.03 -1.26 0.07 0.00 0.70 0.00 0.00 55.95 55.44 3ngb s SER 180 Cb -0.06 -1.21 -0.01 0.00 -1.71 0.00 0.00 66.02 63.03 3ngb s SER 180 CO 0.00 -0.25 0.37 0.68 1.20 0.00 0.00 173.24 175.25 3ngb s VAL 181 N 1.36 2.42 -0.28 4.45 -7.23 0.26 -1.13 120.40 120.25 3ngb s VAL 181 Ca -0.04 -1.40 -0.20 0.00 -1.81 0.00 0.00 61.98 58.53 3ngb s VAL 181 Cb -0.19 -2.82 0.12 0.00 0.56 0.00 0.00 36.38 34.06 3ngb s VAL 181 CO -0.07 0.00 0.94 0.54 -0.31 0.00 0.00 175.10 176.20 3ngb s VAL 182 N -2.55 0.00 -0.17 1.32 0.11 -0.53 -0.30 120.40 118.28 3ngb s VAL 182 Ca 0.45 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 59.35 3ngb s VAL 182 Cb -0.02 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.79 3ngb s VAL 182 CO 0.26 0.00 0.36 0.42 -3.33 0.00 0.00 175.10 172.82 3ngb s THR 183 N 0.91 5.25 0.09 5.04 -4.23 -0.87 -2.47 115.64 119.36 3ngb s THR 183 Ca -0.04 0.68 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 3ngb s THR 183 Cb -0.04 -3.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 3ngb s THR 183 CO -0.11 0.33 -0.10 0.68 -0.54 0.00 0.00 174.62 174.88 3ngb s VAL 184 N 0.79 0.89 -0.07 2.29 -7.23 -0.88 -4.76 120.40 111.43 3ngb s VAL 184 Ca 0.19 -1.65 -0.34 0.00 -1.81 0.00 0.00 61.98 58.37 3ngb s VAL 184 Cb -0.14 -1.36 -0.12 0.00 0.56 0.00 0.00 36.38 35.32 3ngb s VAL 184 CO 0.07 -0.59 1.85 -2.65 -0.31 0.00 0.00 175.10 173.46 3ngb n PRO 185 N 0.53 2.15 0.16 4.82 -0.02 -1.26 -1.16 135.00 140.21 3ngb n PRO 185 Ca -0.16 0.79 0.11 0.00 -2.02 0.00 0.00 63.50 62.22 3ngb n PRO 185 Cb 0.58 -2.62 0.56 0.00 -0.02 0.00 0.00 33.50 32.00 3ngb n PRO 185 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ngb n SER 186 N 6.27 0.56 -0.27 2.55 3.41 -0.50 -1.16 113.62 124.48 3ngb n SER 186 Ca 0.22 0.75 0.10 0.00 -0.26 0.00 0.00 58.87 59.68 3ngb n SER 186 Cb 0.29 -0.82 0.48 0.00 -0.26 0.00 0.00 64.21 63.89 3ngb n SER 186 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ngb n SER 187 N -2.24 0.81 -0.03 4.04 3.41 -1.26 -3.40 113.62 114.96 3ngb n SER 187 Ca -0.01 -1.55 0.02 0.00 -0.26 0.00 0.00 58.87 57.07 3ngb n SER 187 Cb 0.06 -0.05 0.03 0.00 -0.26 0.00 0.00 64.21 63.99 3ngb n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ngb n SER 188 N -0.25 2.09 0.25 4.04 3.41 -0.31 -4.65 113.62 118.20 3ngb n SER 188 Ca 0.15 -2.20 0.12 0.00 -0.26 0.00 0.00 58.87 56.68 3ngb n SER 188 Cb 0.20 -0.08 0.63 0.00 -0.26 0.00 0.00 64.21 64.70 3ngb n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ngb h LEU 189 N 0.04 0.00 0.02 1.04 3.38 -1.69 -0.60 115.31 117.51 3ngb h LEU 189 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 3ngb h LEU 189 Cb 0.60 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 3ngb h LEU 189 CO 0.00 0.16 -2.24 0.61 0.09 0.00 0.00 178.44 177.06 3ngb n GLY 190 N -0.34 -0.69 0.05 0.83 0.00 -1.26 -4.67 105.19 99.11 3ngb n GLY 190 Ca -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.76 3ngb n GLY 190 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ngb h THR 191 N 0.01 0.25 -3.68 2.61 1.35 -1.82 -3.46 112.91 108.18 3ngb h THR 191 Ca -0.50 -1.20 -0.50 0.00 -0.55 0.00 0.00 66.41 63.67 3ngb h THR 191 Cb 2.05 0.48 -0.02 0.00 -1.73 0.00 0.00 68.15 68.93 3ngb h THR 191 CO 0.01 0.09 0.34 -1.10 -0.25 0.00 0.00 175.52 174.60 3ngb s GLN 192 N -1.70 4.79 -0.12 4.72 -1.52 -0.24 -5.06 119.66 120.54 3ngb s GLN 192 Ca -0.04 1.45 -0.07 0.00 -1.95 0.00 0.00 55.36 54.75 3ngb s GLN 192 Cb -0.00 -3.30 -0.04 0.00 -0.22 0.00 0.00 33.01 29.45 3ngb s GLN 192 CO 0.12 0.45 0.13 -0.08 -0.25 0.00 0.00 175.29 175.65 3ngb s THR 193 N -0.88 5.39 -0.15 -0.19 -1.32 -1.26 -4.60 115.64 112.63 3ngb s THR 193 Ca 0.42 0.16 0.01 0.00 -1.21 0.00 0.00 61.69 61.07 3ngb s THR 193 Cb -0.25 -3.34 0.02 0.00 -1.51 0.00 0.00 72.50 67.42 3ngb s THR 193 CO 0.31 0.62 -0.16 -0.31 -2.21 0.00 0.00 174.62 172.87 3ngb s TYR 194 N -1.00 2.27 -0.06 9.09 2.02 -1.26 -4.98 117.35 123.44 3ngb s TYR 194 Ca 0.15 -1.25 0.02 0.00 -0.37 0.00 0.00 57.07 55.62 3ngb s TYR 194 Cb -0.12 -1.64 0.01 0.00 -0.40 0.00 0.00 41.96 39.82 3ngb s TYR 194 CO 0.04 -0.66 -0.10 0.42 -1.57 0.00 0.00 175.55 173.68 3ngb s ILE 195 N 1.32 0.98 -0.10 2.71 1.01 -1.26 -2.42 121.20 123.43 3ngb s ILE 195 Ca 0.02 -0.39 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 3ngb s ILE 195 Cb -0.13 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 3ngb s ILE 195 CO -0.09 0.32 0.45 0.00 0.00 0.00 0.00 174.94 175.62 3ngb s ASN 197 N 0.34 5.99 -0.29 0.00 0.01 0.90 -2.83 114.94 119.06 3ngb s ASN 197 Ca 0.25 -1.06 -0.07 0.00 -0.71 0.00 0.00 52.86 51.27 3ngb s ASN 197 Cb -0.15 -2.12 0.01 0.00 0.41 0.00 0.00 41.25 39.40 3ngb s ASN 197 CO 0.10 -0.48 0.07 -0.69 -1.51 0.00 0.00 177.10 174.59 3ngb s VAL 198 N 1.62 3.92 -0.15 1.60 1.01 -0.27 -1.11 120.40 127.02 3ngb s VAL 198 Ca 0.04 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.34 3ngb s VAL 198 Cb -0.20 -3.01 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 3ngb s VAL 198 CO 0.08 0.10 -0.14 0.21 0.00 0.00 0.00 175.10 175.35 3ngb s ASN 199 N 1.50 3.78 -0.42 3.32 2.47 -0.70 -0.54 114.94 124.36 3ngb s ASN 199 Ca 0.03 -0.42 0.00 0.00 0.42 0.00 0.00 52.86 52.89 3ngb s ASN 199 Cb -0.17 -1.58 0.11 0.00 -1.45 0.00 0.00 41.25 38.16 3ngb s ASN 199 CO 0.02 0.11 0.18 -2.28 -3.72 0.00 0.00 177.10 171.41 3ngb s HIS 200 N 0.66 3.59 0.15 0.43 5.65 -0.71 -2.26 115.29 122.82 3ngb s HIS 200 Ca -0.07 -2.74 -0.21 0.00 0.25 0.00 0.00 55.06 52.29 3ngb s HIS 200 Cb -0.16 -3.08 0.05 0.00 -1.18 0.00 0.00 32.58 28.21 3ngb s HIS 200 CO 0.02 -0.93 1.64 0.87 -0.65 0.00 0.00 174.74 175.69 3ngb h LYS 201 N 7.63 -0.18 -1.40 2.88 1.79 -1.88 -2.00 116.57 123.41 3ngb h LYS 201 Ca -0.08 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3ngb h LYS 201 Cb 1.01 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 3ngb h LYS 201 CO 0.64 -0.12 0.00 -2.30 -1.08 0.00 0.00 179.45 176.59 3ngb n PRO 202 N -5.36 0.43 0.00 3.15 -0.02 -1.26 -1.98 135.00 129.96 3ngb n PRO 202 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3ngb n PRO 202 Cb 0.27 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.48 3ngb n PRO 202 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ngb n SER 203 N 0.71 0.00 -4.34 2.55 3.41 -1.01 -4.76 113.62 110.18 3ngb n SER 203 Ca 0.00 -0.47 -0.37 0.00 -0.26 0.00 0.00 58.87 57.77 3ngb n SER 203 Cb 0.20 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.09 3ngb n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ngb n ASN 204 N 0.00 -1.73 -4.28 4.04 3.02 -0.79 -4.89 115.26 110.63 3ngb n ASN 204 Ca 0.00 -1.15 -0.43 0.00 -0.03 0.00 0.00 54.58 52.98 3ngb n ASN 204 Cb 0.23 -2.15 -0.08 0.00 -0.61 0.00 0.00 39.78 37.17 3ngb n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3ngb s THR 205 N -3.52 4.63 -0.22 3.41 2.01 -1.06 -4.97 115.64 115.92 3ngb s THR 205 Ca 0.58 -1.49 -0.12 0.00 0.31 0.00 0.00 61.69 60.98 3ngb s THR 205 Cb -0.33 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 3ngb s THR 205 CO 0.98 -0.69 0.22 -0.54 -0.69 0.00 0.00 174.62 173.89 3ngb s LYS 206 N 1.48 4.13 -0.08 4.92 3.01 -1.26 -1.73 119.74 130.22 3ngb s LYS 206 Ca 0.04 -0.12 0.03 0.00 -1.01 0.00 0.00 55.97 54.90 3ngb s LYS 206 Cb -0.26 -3.51 0.01 0.00 -1.01 0.00 0.00 37.83 33.06 3ngb s LYS 206 CO 0.02 0.10 -0.16 0.08 0.51 0.00 0.00 175.35 175.90 3ngb s VAL 207 N 0.92 1.42 -0.42 3.17 1.01 0.30 -5.01 120.40 121.79 3ngb s VAL 207 Ca 0.11 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3ngb s VAL 207 Cb -0.13 -1.26 0.12 0.00 0.00 0.00 0.00 36.38 35.10 3ngb s VAL 207 CO 0.04 0.42 0.17 -1.81 0.00 0.00 0.00 175.10 173.92 3ngb s ASP 208 N 0.56 4.29 -0.13 3.32 1.01 -1.26 -1.11 116.67 123.35 3ngb s ASP 208 Ca -0.16 -2.50 -0.10 0.00 0.71 0.00 0.00 52.55 50.50 3ngb s ASP 208 Cb -0.16 -1.42 -0.05 0.00 1.01 0.00 0.00 42.92 42.30 3ngb s ASP 208 CO 0.05 -0.31 0.20 -0.75 0.21 0.00 0.00 175.17 174.58 3ngb s LYS 209 N 0.44 3.80 -0.39 8.23 2.47 -1.13 -4.93 119.74 128.23 3ngb s LYS 209 Ca 0.14 -0.04 -0.13 0.00 -1.56 0.00 0.00 55.97 54.39 3ngb s LYS 209 Cb -0.22 -3.28 0.03 0.00 -1.46 0.00 0.00 37.83 32.89 3ngb s LYS 209 CO -0.06 0.58 0.25 0.21 0.16 0.00 0.00 175.35 176.49 3ngb s LYS 210 N -0.50 2.87 -0.52 4.03 2.20 -1.26 -1.20 119.74 125.36 3ngb s LYS 210 Ca 0.15 -1.09 -0.28 0.00 -0.36 0.00 0.00 55.97 54.39 3ngb s LYS 210 Cb -0.13 -3.84 0.02 0.00 -1.51 0.00 0.00 37.83 32.38 3ngb s LYS 210 CO 0.04 -0.74 1.30 0.00 -0.36 0.00 0.00 175.35 175.59 3ngb s ALA 211 N 1.60 2.97 -0.07 3.13 0.00 -1.02 -5.01 121.76 123.36 3ngb s ALA 211 Ca 0.03 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 3ngb s ALA 211 Cb -0.19 -4.01 -0.04 0.00 0.00 0.00 0.00 23.12 18.88 3ngb s ALA 211 CO 0.08 -2.63 0.05 -1.21 0.00 0.00 0.00 175.76 172.05 3ngb s GLU 212 N 5.04 3.10 0.50 0.00 2.02 -1.26 -4.68 118.70 123.42 3ngb s GLU 212 Ca 0.51 -0.37 -0.22 0.00 0.02 0.00 0.00 54.97 54.91 3ngb s GLU 212 Cb -0.10 -2.89 -0.07 0.00 0.10 0.00 0.00 34.13 31.17 3ngb s GLU 212 CO 0.28 0.71 1.12 -2.30 0.02 0.00 0.00 175.26 175.09 3ngb n PRO 213 N 1.88 1.40 -2.31 0.39 -0.02 -1.26 -4.49 135.00 130.60 3ngb n PRO 213 Ca -0.18 0.51 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 3ngb n PRO 213 Cb 0.54 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.72 3ngb n PRO 213 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3ngb s LYS 214 N -2.46 3.10 -0.29 -0.52 2.47 -1.24 -4.94 119.74 115.86 3ngb s LYS 214 Ca 0.68 -0.86 -0.29 0.00 -1.56 0.00 0.00 55.97 53.94 3ngb s LYS 214 Cb -0.47 -5.24 -0.02 0.00 -1.46 0.00 0.00 37.83 30.63 3ngb s LYS 214 CO 0.53 -2.86 1.75 -1.12 0.16 0.00 0.00 175.35 173.80 3ngb s SER 215 N 6.31 6.05 0.00 1.43 0.01 -1.26 -4.95 113.70 121.29 3ngb s SER 215 Ca 0.59 1.43 0.00 0.00 1.31 0.00 0.00 55.95 59.28 3ngb s SER 215 Cb -0.02 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3ngb s SER 215 CO -0.02 -1.56 0.00 0.00 0.41 0.00 0.00 173.24 172.07