#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ngb n VAL 2 N 0.00 0.87 -3.67 -0.39 0.31 -1.26 -4.29 118.33 109.90 3ngb n VAL 2 Ca 0.00 -0.22 -0.11 0.00 -0.01 0.00 0.00 64.34 64.01 3ngb n VAL 2 Cb 0.00 -1.89 -0.11 0.00 -0.91 0.00 0.00 33.84 30.93 3ngb n VAL 2 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 3ngb s GLN 3 N -0.27 0.27 -0.37 5.55 0.74 0.06 -4.99 119.66 120.65 3ngb s GLN 3 Ca 0.66 0.88 -0.15 0.00 0.05 0.00 0.00 55.36 56.81 3ngb s GLN 3 Cb -0.52 0.14 0.00 0.00 1.10 0.00 0.00 33.01 33.73 3ngb s GLN 3 CO 0.47 -0.24 0.32 -0.51 -0.55 0.00 0.00 175.29 174.77 3ngb s LEU 4 N 2.31 4.72 -0.30 3.68 1.02 -1.26 -2.19 118.68 126.65 3ngb s LEU 4 Ca -0.02 -0.55 -0.11 0.00 0.02 0.00 0.00 54.13 53.47 3ngb s LEU 4 Cb -0.11 -2.23 -0.03 0.00 0.02 0.00 0.00 46.19 43.83 3ngb s LEU 4 CO -0.11 -0.37 0.19 -0.69 0.02 0.00 0.00 176.35 175.39 3ngb s VAL 5 N 1.84 5.14 0.32 -1.59 1.01 0.14 -4.25 120.40 123.01 3ngb s VAL 5 Ca 0.08 -0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.07 3ngb s VAL 5 Cb -0.18 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3ngb s VAL 5 CO 0.11 0.15 0.36 -1.10 0.00 0.00 0.00 175.10 174.62 3ngb s GLN 6 N 1.72 2.96 0.87 2.72 -0.21 -1.26 0.85 119.66 127.31 3ngb s GLN 6 Ca 0.06 -1.11 -0.13 0.00 0.02 0.00 0.00 55.36 54.20 3ngb s GLN 6 Cb -0.17 -2.66 0.12 0.00 1.00 0.00 0.00 33.01 31.31 3ngb s GLN 6 CO 0.10 0.13 1.21 -1.54 -2.12 0.00 0.00 175.29 173.07 3ngb s SER 7 N -4.06 3.97 0.73 5.90 1.04 -0.83 -4.97 113.70 115.49 3ngb s SER 7 Ca 0.41 0.67 -0.11 0.00 0.48 0.00 0.00 55.95 57.41 3ngb s SER 7 Cb -0.08 -1.05 0.03 0.00 0.10 0.00 0.00 66.02 65.02 3ngb s SER 7 CO 0.28 -2.23 1.07 -0.83 0.98 0.00 0.00 173.24 172.51 3ngb s GLY 8 N -4.58 1.66 0.79 7.32 0.00 -1.26 -4.66 107.32 106.59 3ngb s GLY 8 Ca 0.65 0.11 -0.12 0.00 0.00 0.00 0.00 44.72 45.36 3ngb s GLY 8 CO 0.51 0.44 1.15 -0.32 0.00 0.00 0.00 173.10 174.88 3ngb s GLY 9 N -3.68 1.97 0.13 0.20 0.00 -1.26 -4.84 107.32 99.84 3ngb s GLY 9 Ca 0.59 0.61 0.01 0.00 0.00 0.00 0.00 44.72 45.94 3ngb s GLY 9 CO 0.55 1.00 -0.01 1.20 0.00 0.00 0.00 173.10 175.85 3ngb s GLN 10 N -4.39 0.95 -0.09 2.90 -0.21 0.15 -4.96 119.66 114.01 3ngb s GLN 10 Ca 0.68 -1.43 0.01 0.00 0.02 0.00 0.00 55.36 54.64 3ngb s GLN 10 Cb -0.23 -0.11 0.02 0.00 1.00 0.00 0.00 33.01 33.69 3ngb s GLN 10 CO 0.51 -0.12 -0.09 -1.64 -2.12 0.00 0.00 175.29 171.83 3ngb s MET 11 N -3.92 1.51 0.35 2.91 -1.94 -1.26 -1.85 119.30 115.10 3ngb s MET 11 Ca 0.19 -0.29 0.04 0.00 -1.71 0.00 0.00 55.69 53.91 3ngb s MET 11 Cb 0.06 -1.44 -0.05 0.00 2.01 0.00 0.00 34.83 35.41 3ngb s MET 11 CO -0.00 -0.14 0.07 0.15 -0.01 0.00 0.00 175.02 175.09 3ngb s LYS 12 N 1.25 1.72 0.19 2.03 3.01 -0.44 -4.99 119.74 122.51 3ngb s LYS 12 Ca -0.04 -1.98 0.11 0.00 -1.01 0.00 0.00 55.97 53.06 3ngb s LYS 12 Cb -0.14 -0.84 -0.04 0.00 -1.01 0.00 0.00 37.83 35.80 3ngb s LYS 12 CO -0.03 -0.25 -0.24 0.15 0.51 0.00 0.00 175.35 175.50 3ngb s LYS 13 N -3.86 1.51 0.02 1.68 1.02 -1.26 -1.08 119.74 117.76 3ngb s LYS 13 Ca 0.33 -1.52 -0.35 0.00 0.02 0.00 0.00 55.97 54.45 3ngb s LYS 13 Cb 0.07 -1.82 -0.14 0.00 -0.52 0.00 0.00 37.83 35.42 3ngb s LYS 13 CO 0.15 0.39 1.65 -2.30 -0.92 0.00 0.00 175.35 174.32 3ngb n PRO 14 N 0.26 1.86 0.00 -1.68 -0.02 -1.26 -1.81 135.00 132.35 3ngb n PRO 14 Ca -0.12 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3ngb n PRO 14 Cb 0.56 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 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 3.65 1.83 3.76 -1.23 0.00 -0.53 -4.93 105.19 107.73 3ngb n GLY 15 Ca 0.20 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 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 0.75 -0.03 1.61 2.02 -0.75 -4.12 118.70 118.18 3ngb s GLU 16 Ca 0.00 0.24 0.06 0.00 0.02 0.00 0.00 54.97 55.29 3ngb s GLU 16 Cb 0.00 -1.80 -0.01 0.00 0.10 0.00 0.00 34.13 32.42 3ngb s GLU 16 CO 0.00 -2.45 -0.20 -1.54 0.02 0.00 0.00 175.26 171.09 3ngb s SER 17 N -3.98 2.34 0.62 -0.19 1.04 -1.26 -1.52 113.70 110.76 3ngb s SER 17 Ca 0.65 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.74 3ngb s SER 17 Cb -0.14 -0.40 0.08 0.00 0.10 0.00 0.00 66.02 65.66 3ngb s SER 17 CO 0.54 0.22 0.86 0.00 0.98 0.00 0.00 173.24 175.84 3ngb s MET 18 N -0.31 2.12 -0.30 4.02 0.23 -0.63 -4.96 119.30 119.48 3ngb s MET 18 Ca 0.04 -1.13 -0.06 0.00 -1.03 0.00 0.00 55.69 53.50 3ngb s MET 18 Cb -0.09 -2.47 0.18 0.00 -1.53 0.00 0.00 34.83 30.92 3ngb s MET 18 CO 0.00 -1.04 0.75 0.50 -2.03 0.00 0.00 175.02 173.20 3ngb s ARG 19 N -4.89 0.45 0.16 3.16 3.52 -1.26 -3.16 118.95 116.94 3ngb s ARG 19 Ca 0.62 0.89 0.09 0.00 -0.13 0.00 0.00 55.73 57.20 3ngb s ARG 19 Cb -0.07 0.50 -0.04 0.00 -1.56 0.00 0.00 34.95 33.78 3ngb s ARG 19 CO 0.41 -0.41 -0.21 0.96 -0.81 0.00 0.00 175.30 175.24 3ngb s ILE 20 N 2.85 1.97 0.30 4.11 -4.36 -0.39 -4.97 121.20 120.70 3ngb s ILE 20 Ca 0.10 -1.86 0.10 0.00 -0.26 0.00 0.00 60.65 58.72 3ngb s ILE 20 Cb -0.13 -1.87 -0.06 0.00 1.25 0.00 0.00 42.46 41.66 3ngb s ILE 20 CO -0.18 -0.18 -0.13 -0.94 0.24 0.00 0.00 174.94 173.75 3ngb s SER 21 N -2.47 3.38 -0.24 4.36 1.04 -1.26 -0.47 113.70 118.03 3ngb s SER 21 Ca 0.15 -1.12 -0.02 0.00 0.48 0.00 0.00 55.95 55.43 3ngb s SER 21 Cb -0.07 -0.28 0.12 0.00 0.10 0.00 0.00 66.02 65.89 3ngb s SER 21 CO 0.07 -0.15 0.30 0.00 0.98 0.00 0.00 173.24 174.44 3ngb s ARG 23 N 2.41 4.25 0.26 0.00 3.52 0.25 -1.12 118.95 128.52 3ngb s ARG 23 Ca 0.09 0.29 0.02 0.00 -0.13 0.00 0.00 55.73 56.01 3ngb s ARG 23 Cb -0.15 -3.48 -0.03 0.00 -1.56 0.00 0.00 34.95 29.72 3ngb s ARG 23 CO -0.20 0.07 0.42 0.00 -0.81 0.00 0.00 175.30 174.79 3ngb s ALA 24 N 0.94 3.84 -0.20 6.12 0.00 -0.64 0.26 121.76 132.08 3ngb s ALA 24 Ca 0.21 -1.03 -0.28 0.00 0.00 0.00 0.00 51.96 50.87 3ngb s ALA 24 Cb -0.15 -1.91 0.11 0.00 0.00 0.00 0.00 23.12 21.17 3ngb s ALA 24 CO 0.08 0.22 0.93 -1.54 0.00 0.00 0.00 175.76 175.45 3ngb s SER 25 N -3.77 -0.48 0.00 0.00 1.04 -0.93 -4.89 113.70 104.67 3ngb s SER 25 Ca 0.37 0.73 0.00 0.00 0.48 0.00 0.00 55.95 57.53 3ngb s SER 25 Cb -0.10 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3ngb s SER 25 CO 0.31 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.84 3ngb n GLY 26 N 1.51 0.66 3.80 7.32 0.00 -1.26 -0.76 105.19 116.47 3ngb n GLY 26 Ca -0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.19 -0.06 1.61 1.13 -1.26 -4.31 117.35 112.26 3ngb s TYR 27 Ca 0.00 -0.21 -0.30 0.00 -1.41 0.00 0.00 57.07 55.15 3ngb s TYR 27 Cb 0.00 0.68 -0.04 0.00 -1.10 0.00 0.00 41.96 41.50 3ngb s TYR 27 CO 0.00 -1.09 1.41 -1.21 -2.51 0.00 0.00 175.55 172.15 3ngb s GLU 28 N -3.71 4.25 0.30 -3.49 0.41 -1.26 -4.92 118.70 110.28 3ngb s GLU 28 Ca 0.11 1.92 0.03 0.00 -0.41 0.00 0.00 54.97 56.61 3ngb s GLU 28 Cb -0.04 -3.73 0.48 0.00 -1.78 0.00 0.00 34.13 29.05 3ngb s GLU 28 CO 0.05 -0.67 1.79 0.35 -0.49 0.00 0.00 175.26 176.28 3ngb h PHE 29 N 8.34 0.57 -0.38 1.61 3.57 -1.94 -2.76 116.94 125.96 3ngb h PHE 29 Ca -0.35 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.06 3ngb h PHE 29 Cb 1.16 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.74 3ngb h PHE 29 CO 0.80 0.64 0.00 0.44 -2.23 0.00 0.00 178.31 177.96 3ngb n ILE 30 N -4.19 0.76 -0.06 1.41 -5.35 -1.26 -3.95 119.36 106.71 3ngb n ILE 30 Ca 0.01 -0.58 -0.02 0.00 -0.27 0.00 0.00 62.75 61.89 3ngb n ILE 30 Cb 0.33 0.11 -0.14 0.00 -1.74 0.00 0.00 39.64 38.20 3ngb n ILE 30 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3ngb n ASP 31 N 0.58 0.83 -4.32 7.28 9.92 -1.04 -4.44 116.55 125.36 3ngb n ASP 31 Ca 0.14 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 54.09 3ngb n ASP 31 Cb 0.44 1.26 -0.15 0.00 -0.64 0.00 0.00 41.12 42.02 3ngb n ASP 31 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ngb s THR 33 N -0.71 3.31 0.05 0.00 2.01 -1.26 -4.61 115.64 114.42 3ngb s THR 33 Ca 0.11 1.04 0.05 0.00 0.31 0.00 0.00 61.69 63.19 3ngb s THR 33 Cb -0.10 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 3ngb s THR 33 CO 0.01 0.04 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.15 3ngb s LEU 34 N -2.67 3.20 0.19 4.42 1.02 0.07 -4.49 118.68 120.42 3ngb s LEU 34 Ca 0.59 -0.21 0.07 0.00 0.02 0.00 0.00 54.13 54.60 3ngb s LEU 34 Cb -0.28 -1.90 -0.05 0.00 0.02 0.00 0.00 46.19 43.99 3ngb s LEU 34 CO 0.34 0.23 -0.14 0.20 0.02 0.00 0.00 176.35 177.00 3ngb s ASN 35 N -1.81 2.48 -0.12 2.29 0.01 -0.38 0.25 114.94 117.66 3ngb s ASN 35 Ca 0.20 -1.00 -0.00 0.00 -0.71 0.00 0.00 52.86 51.34 3ngb s ASN 35 Cb -0.11 -0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.45 3ngb s ASN 35 CO 0.11 -0.18 -0.09 0.26 -1.51 0.00 0.00 177.10 175.69 3ngb s TRP 36 N -2.94 1.66 -0.18 2.20 0.52 -1.02 -1.07 118.94 118.12 3ngb s TRP 36 Ca 0.21 -0.86 0.01 0.00 0.02 0.00 0.00 56.10 55.48 3ngb s TRP 36 Cb -0.01 -1.33 0.02 0.00 -1.15 0.00 0.00 33.47 31.01 3ngb s TRP 36 CO 0.06 -0.55 -0.18 0.42 0.02 0.00 0.00 176.95 176.72 3ngb s ILE 37 N 1.65 1.94 -0.12 2.03 -1.09 -0.08 -0.30 121.20 125.22 3ngb s ILE 37 Ca 0.05 -0.89 -0.16 0.00 -2.23 0.00 0.00 60.65 57.42 3ngb s ILE 37 Cb -0.13 -1.78 -0.05 0.00 -1.58 0.00 0.00 42.46 38.93 3ngb s ILE 37 CO -0.09 0.49 0.39 0.00 -1.23 0.00 0.00 174.94 174.50 3ngb s ARG 38 N 1.33 4.25 -0.23 2.79 1.70 -0.53 -1.00 118.95 127.26 3ngb s ARG 38 Ca 0.04 0.29 0.02 0.00 -0.47 0.00 0.00 55.73 55.61 3ngb s ARG 38 Cb -0.13 -3.41 0.05 0.00 -0.57 0.00 0.00 34.95 30.89 3ngb s ARG 38 CO -0.12 0.26 -0.14 -0.51 -1.08 0.00 0.00 175.30 173.70 3ngb s LEU 39 N 0.36 3.00 -0.04 -1.89 1.43 -0.25 -1.63 118.68 119.66 3ngb s LEU 39 Ca 0.22 -1.14 0.05 0.00 -1.03 0.00 0.00 54.13 52.22 3ngb s LEU 39 Cb -0.14 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 3ngb s LEU 39 CO 0.08 -0.12 -0.18 0.00 0.23 0.00 0.00 176.35 176.36 3ngb s ALA 40 N 1.17 2.53 0.05 4.21 0.00 -1.26 -1.16 121.76 127.29 3ngb s ALA 40 Ca -0.04 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 50.59 3ngb s ALA 40 Cb -0.18 -0.85 -0.09 0.00 0.00 0.00 0.00 23.12 22.00 3ngb s ALA 40 CO -0.08 0.55 1.95 -2.30 0.00 0.00 0.00 175.76 175.88 3ngb n PRO 41 N 2.32 2.85 -0.37 0.00 -0.02 -1.26 -2.15 135.00 136.37 3ngb n PRO 41 Ca -0.17 1.04 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 3ngb n PRO 41 Cb 0.52 -2.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.01 3ngb n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ngb n GLY 42 N 4.49 0.79 3.17 -1.23 0.00 -1.26 -5.07 105.19 106.08 3ngb n GLY 42 Ca 0.20 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.68 0.88 0.51 1.61 1.02 -0.91 -5.14 119.74 117.03 3ngb s LYS 43 Ca 0.00 -1.39 -0.22 0.00 0.02 0.00 0.00 55.97 54.38 3ngb s LYS 43 Cb 0.00 -0.04 -0.06 0.00 -0.52 0.00 0.00 37.83 37.21 3ngb s LYS 43 CO 0.00 -0.12 1.28 1.03 -0.92 0.00 0.00 175.35 176.62 3ngb s ARG 44 N -3.92 3.38 0.73 1.68 0.52 -1.26 -4.71 118.95 115.37 3ngb s ARG 44 Ca 0.17 2.05 -0.16 0.00 -0.52 0.00 0.00 55.73 57.27 3ngb s ARG 44 Cb 0.07 -2.31 0.01 0.00 0.52 0.00 0.00 34.95 33.23 3ngb s ARG 44 CO -0.02 -0.95 0.95 -2.30 0.02 0.00 0.00 175.30 173.01 3ngb n PRO 45 N -0.83 0.47 -3.80 3.54 -0.02 -1.26 -4.69 135.00 128.41 3ngb n PRO 45 Ca 0.09 0.22 -0.25 0.00 -2.02 0.00 0.00 63.50 61.53 3ngb n PRO 45 Cb 0.46 -2.21 -0.17 0.00 -0.02 0.00 0.00 33.50 31.56 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 -3.36 0.89 -0.11 -0.52 2.12 -0.65 -5.00 118.70 112.08 3ngb s GLU 46 Ca 0.73 -0.16 -0.30 0.00 0.36 0.00 0.00 54.97 55.60 3ngb s GLU 46 Cb -0.34 -1.48 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 3ngb s GLU 46 CO 0.51 -0.39 1.36 -0.46 -0.54 0.00 0.00 175.26 175.74 3ngb s TRP 47 N 1.85 2.69 -0.13 5.30 -0.00 -1.26 -1.45 118.94 125.94 3ngb s TRP 47 Ca 0.03 0.82 0.18 0.00 -0.00 0.00 0.00 56.10 57.13 3ngb s TRP 47 Cb -0.14 -3.61 -0.16 0.00 -0.00 0.00 0.00 33.47 29.56 3ngb s TRP 47 CO -0.07 -2.24 0.71 -1.33 -0.00 0.00 0.00 176.95 174.02 3ngb n MET 48 N 6.41 0.63 0.00 5.86 2.81 0.59 -4.62 117.12 128.79 3ngb n MET 48 Ca 0.14 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.18 3ngb n MET 48 Cb 0.44 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 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 1.41 3.99 3.87 3.03 0.00 -1.25 -0.50 105.19 115.74 3ngb n GLY 49 Ca -0.11 -1.19 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 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 2.88 -0.06 1.61 1.48 -1.05 -2.44 118.94 119.36 3ngb s TRP 50 Ca 0.00 -0.33 -0.02 0.00 -1.06 0.00 0.00 56.10 54.68 3ngb s TRP 50 Cb 0.00 -1.90 0.04 0.00 -1.16 0.00 0.00 33.47 30.45 3ngb s TRP 50 CO 0.00 0.10 0.11 -1.17 -4.06 0.00 0.00 176.95 171.93 3ngb s LEU 51 N -4.04 0.29 -0.47 -4.66 1.98 0.14 -2.15 118.68 109.78 3ngb s LEU 51 Ca 0.43 0.22 -0.13 0.00 -2.89 0.00 0.00 54.13 51.76 3ngb s LEU 51 Cb -0.06 0.13 0.09 0.00 0.66 0.00 0.00 46.19 47.01 3ngb s LEU 51 CO 0.27 -0.21 0.36 -0.54 -1.89 0.00 0.00 176.35 174.34 3ngb s LYS 52 N 1.88 2.79 0.63 1.98 1.02 0.12 -0.75 119.74 127.41 3ngb s LYS 52 Ca -0.00 -1.50 0.31 0.00 0.02 0.00 0.00 55.97 54.79 3ngb s LYS 52 Cb -0.12 -4.01 1.67 0.00 -0.52 0.00 0.00 37.83 34.85 3ngb s LYS 52 CO -0.05 -1.08 1.99 -1.35 -0.92 0.00 0.00 175.35 173.95 3ngb h PRO 52 N 8.62 0.00 0.00 -1.68 0.11 -1.81 -1.17 132.00 136.06 3ngb h PRO 52 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3ngb h PRO 52 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3ngb h PRO 52 CO 0.86 0.00 0.00 -2.13 -0.21 0.00 0.00 178.00 176.52 3ngb n ARG 53 N -3.27 0.00 0.00 1.05 3.00 -1.26 -3.38 116.66 112.80 3ngb n ARG 53 Ca 0.01 0.90 0.00 0.00 -0.00 0.00 0.00 57.85 58.76 3ngb n ARG 53 Cb 0.41 -1.36 0.00 0.00 0.00 0.00 0.00 32.46 31.51 3ngb n ARG 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3ngb n GLY 54 N -1.00 2.38 1.43 5.14 0.00 -1.19 -4.95 105.19 107.01 3ngb n GLY 54 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.44 0.70 3.58 -0.02 0.00 -0.48 -5.01 105.19 103.53 3ngb n GLY 55 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.03 -0.70 -2.55 4.61 0.00 -1.01 -4.68 120.51 116.15 3ngb n ALA 56 Ca 0.00 0.46 -0.09 0.00 0.00 0.00 0.00 53.44 53.81 3ngb n ALA 56 Cb 0.00 -2.03 -0.09 0.00 0.00 0.00 0.00 19.45 17.32 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 -0.22 0.15 -0.27 0.00 0.11 -1.26 0.12 120.40 119.03 3ngb s VAL 57 Ca 0.72 -1.28 -0.02 0.00 -2.93 0.00 0.00 61.98 58.47 3ngb s VAL 57 Cb -0.84 -1.08 0.11 0.00 -1.53 0.00 0.00 36.38 33.04 3ngb s VAL 57 CO 0.52 -0.70 0.22 0.21 -3.33 0.00 0.00 175.10 172.02 3ngb s ASN 58 N -2.40 2.28 0.12 3.54 3.84 -0.91 -5.01 114.94 116.40 3ngb s ASN 58 Ca -0.01 -0.84 -0.24 0.00 0.21 0.00 0.00 52.86 51.97 3ngb s ASN 58 Cb 0.02 0.17 -0.07 0.00 -0.55 0.00 0.00 41.25 40.82 3ngb s ASN 58 CO -0.07 -0.39 0.75 -0.31 -2.79 0.00 0.00 177.10 174.28 3ngb s TYR 59 N 2.26 3.85 0.25 0.43 2.02 -1.26 -2.53 117.35 122.36 3ngb s TYR 59 Ca 0.09 1.54 -0.31 0.00 -0.37 0.00 0.00 57.07 58.02 3ngb s TYR 59 Cb -0.15 -2.75 -0.13 0.00 -0.40 0.00 0.00 41.96 38.53 3ngb s TYR 59 CO -0.30 0.46 1.43 0.00 -1.57 0.00 0.00 175.55 175.57 3ngb n ALA 60 N 1.94 1.28 -0.18 3.71 0.00 0.34 -4.80 120.51 122.80 3ngb n ALA 60 Ca -0.05 0.41 -0.01 0.00 0.00 0.00 0.00 53.44 53.79 3ngb n ALA 60 Cb 0.49 -2.30 0.08 0.00 0.00 0.00 0.00 19.45 17.73 3ngb n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ngb h ARG 61 N 4.26 0.12 -0.36 0.00 3.08 -1.92 -0.80 114.38 118.75 3ngb h ARG 61 Ca -0.45 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 59.64 3ngb h ARG 61 Cb 1.27 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 3ngb h ARG 61 CO 0.76 0.08 0.25 -1.35 -1.07 0.00 0.00 179.97 178.63 3ngb h PRO 62 N 0.12 0.27 -0.01 0.04 0.11 -1.98 -2.50 132.00 128.06 3ngb h PRO 62 Ca 0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.38 3ngb h PRO 62 Cb 0.45 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.50 3ngb h PRO 62 CO -0.47 0.18 -0.27 1.28 -0.21 0.00 0.00 178.00 178.52 3ngb n LEU 63 N -4.48 1.38 -4.72 2.35 4.77 -0.35 -4.94 117.00 111.01 3ngb n LEU 63 Ca 0.04 -0.43 -0.43 0.00 -0.03 0.00 0.00 56.01 55.16 3ngb n LEU 63 Cb 0.23 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 3ngb n LEU 63 CO 0.35 0.25 1.19 0.00 -1.33 0.00 0.00 177.39 177.85 3ngb n GLN 64 N -0.34 2.51 -0.11 3.23 6.02 -0.94 -1.73 117.38 126.02 3ngb n GLN 64 Ca 0.12 0.89 0.00 0.00 -0.01 0.00 0.00 57.00 58.01 3ngb n GLN 64 Cb 0.39 -2.65 0.00 0.00 1.02 0.00 0.00 30.24 29.00 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 2.37 0.86 0.00 1.08 0.00 -1.26 -4.81 105.19 103.43 3ngb n GLY 65 Ca 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.00 3.76 -4.01 1.61 1.74 -0.70 -4.97 116.66 112.09 3ngb n ARG 66 Ca 0.00 -0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 3ngb n ARG 66 Cb 0.00 -1.00 -0.06 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.00 4.83 -0.11 1.55 0.11 -1.04 -0.89 120.40 122.84 3ngb s VAL 67 Ca -0.00 -0.63 -0.04 0.00 -2.93 0.00 0.00 61.98 58.37 3ngb s VAL 67 Cb 0.00 -3.33 0.05 0.00 -1.53 0.00 0.00 36.38 31.57 3ngb s VAL 67 CO 0.00 0.14 0.23 -0.89 -3.33 0.00 0.00 175.10 171.25 3ngb s THR 68 N -1.42 -0.27 -0.17 5.04 2.01 -0.27 -4.96 115.64 115.59 3ngb s THR 68 Ca 0.31 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.57 3ngb s THR 68 Cb -0.12 -0.38 0.01 0.00 0.01 0.00 0.00 72.50 72.01 3ngb s THR 68 CO 0.24 0.11 -0.16 -0.04 -0.69 0.00 0.00 174.62 174.07 3ngb s MET 69 N 2.04 3.14 0.25 4.92 -1.94 -1.26 -0.88 119.30 125.56 3ngb s MET 69 Ca -0.02 -0.77 0.02 0.00 -1.71 0.00 0.00 55.69 53.21 3ngb s MET 69 Cb -0.12 -2.63 -0.01 0.00 2.01 0.00 0.00 34.83 34.09 3ngb s MET 69 CO -0.08 -0.09 0.07 0.25 -0.01 0.00 0.00 175.02 175.17 3ngb n THR 70 N 4.33 0.00 -3.46 2.05 -2.24 -1.17 -4.96 114.28 108.82 3ngb n THR 70 Ca -0.20 -1.39 -0.13 0.00 -2.27 0.00 0.00 64.05 60.07 3ngb n THR 70 Cb 0.51 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 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 -2.93 1.13 -0.44 -0.78 3.03 -1.26 -1.60 118.95 116.10 3ngb s ARG 71 Ca 0.10 -0.27 -0.00 0.00 2.03 0.00 0.00 55.73 57.59 3ngb s ARG 71 Cb 0.01 0.52 0.12 0.00 -1.03 0.00 0.00 34.95 34.57 3ngb s ARG 71 CO 0.07 -0.47 0.21 0.34 -1.13 0.00 0.00 175.30 174.33 3ngb s ASP 72 N -2.33 4.99 0.13 -2.89 3.68 0.41 -4.99 116.67 115.67 3ngb s ASP 72 Ca -0.01 -2.35 -0.29 0.00 2.13 0.00 0.00 52.55 52.04 3ngb s ASP 72 Cb -0.01 -1.75 -0.05 0.00 -1.45 0.00 0.00 42.92 39.65 3ngb s ASP 72 CO -0.07 -0.43 1.59 0.58 0.13 0.00 0.00 175.17 176.97 3ngb h VAL 73 N 6.12 0.19 0.00 1.11 2.07 -1.92 -0.68 116.25 123.13 3ngb h VAL 73 Ca -0.08 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 3ngb h VAL 73 Cb 1.00 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3ngb h VAL 73 CO 0.65 0.00 -0.27 0.22 0.02 0.00 0.00 177.57 178.19 3ngb h TYR 74 N -0.50 0.00 -0.18 1.57 5.03 -1.96 -1.85 116.97 119.08 3ngb h TYR 74 Ca 0.07 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.38 3ngb h TYR 74 Cb 0.62 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.90 3ngb h TYR 74 CO -0.44 0.27 0.00 0.45 -1.32 0.00 0.00 178.16 177.12 3ngb n SER 75 N -4.03 1.78 -2.18 -2.11 2.88 -0.74 -4.93 113.62 104.30 3ngb n SER 75 Ca -0.02 -1.74 -0.10 0.00 -1.33 0.00 0.00 58.87 55.69 3ngb n SER 75 Cb 0.34 -0.12 -0.01 0.00 -0.75 0.00 0.00 64.21 63.67 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 0.40 -3.10 -4.49 -3.46 8.00 -0.34 -4.90 116.55 108.66 3ngb n ASP 76 Ca 0.16 0.26 -0.32 0.00 0.71 0.00 0.00 54.79 55.60 3ngb n ASP 76 Cb 0.35 -2.74 -0.13 0.00 -0.02 0.00 0.00 41.12 38.58 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 -2.33 3.09 -0.00 -3.53 2.01 -1.11 -1.62 115.64 112.15 3ngb s THR 77 Ca 0.00 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.24 3ngb s THR 77 Cb 0.00 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 3ngb s THR 77 CO 0.00 0.51 -0.21 0.00 -0.69 0.00 0.00 174.62 174.23 3ngb s ALA 78 N -0.81 2.41 0.23 7.40 0.00 -0.28 -0.44 121.76 130.27 3ngb s ALA 78 Ca 0.13 -1.12 0.11 0.00 0.00 0.00 0.00 51.96 51.07 3ngb s ALA 78 Cb -0.11 -0.69 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 3ngb s ALA 78 CO 0.02 0.55 -0.15 -0.06 0.00 0.00 0.00 175.76 176.12 3ngb s PHE 79 N -0.75 2.45 -0.04 0.00 0.40 -0.62 0.08 117.98 119.49 3ngb s PHE 79 Ca 0.12 -0.29 -0.02 0.00 -0.60 0.00 0.00 56.93 56.14 3ngb s PHE 79 Cb -0.10 -1.14 0.03 0.00 0.51 0.00 0.00 43.02 42.32 3ngb s PHE 79 CO 0.01 0.60 0.05 -1.17 0.70 0.00 0.00 175.22 175.41 3ngb s LEU 80 N -3.16 0.25 -0.03 -0.37 2.96 0.37 -3.07 118.68 115.64 3ngb s LEU 80 Ca 0.27 0.06 0.04 0.00 -0.22 0.00 0.00 54.13 54.28 3ngb s LEU 80 Cb -0.07 -0.16 -0.03 0.00 0.50 0.00 0.00 46.19 46.43 3ngb s LEU 80 CO 0.15 -0.24 -0.14 -0.70 -1.32 0.00 0.00 176.35 174.10 3ngb s GLU 81 N 2.07 2.46 -0.08 1.98 2.12 -0.06 -1.27 118.70 125.92 3ngb s GLU 81 Ca 0.04 -0.73 -0.01 0.00 0.36 0.00 0.00 54.97 54.63 3ngb s GLU 81 Cb -0.12 -2.37 0.03 0.00 0.26 0.00 0.00 34.13 31.92 3ngb s GLU 81 CO -0.03 0.61 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.12 3ngb s LEU 82 N -0.91 0.71 0.45 2.70 2.96 -1.19 -1.12 118.68 122.27 3ngb s LEU 82 Ca 0.13 -0.12 0.08 0.00 -0.22 0.00 0.00 54.13 53.99 3ngb s LEU 82 Cb -0.11 -0.51 0.02 0.00 0.50 0.00 0.00 46.19 46.09 3ngb s LEU 82 CO 0.02 -0.18 0.61 0.00 -1.32 0.00 0.00 176.35 175.48 3ngb s ARG 82 N 1.90 2.75 -0.56 1.98 1.70 -0.07 -1.61 118.95 125.04 3ngb s ARG 82 Ca 0.05 -1.26 -0.05 0.00 -0.47 0.00 0.00 55.73 54.00 3ngb s ARG 82 Cb -0.12 -2.73 0.01 0.00 -0.57 0.00 0.00 34.95 31.54 3ngb s ARG 82 CO -0.06 -0.37 0.45 -1.13 -1.08 0.00 0.00 175.30 173.11 3ngb n SER 82 N -1.93 -3.58 -4.80 -2.89 3.41 -1.22 -4.89 113.62 97.72 3ngb n SER 82 Ca 0.09 -0.62 -0.32 0.00 -0.26 0.00 0.00 58.87 57.76 3ngb n SER 82 Cb 0.59 -1.16 0.04 0.00 -0.26 0.00 0.00 64.21 63.42 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 -3.77 3.30 0.18 1.04 1.43 -0.57 -4.75 118.68 115.53 3ngb s LEU 82 Ca 0.05 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.94 3ngb s LEU 82 Cb -0.01 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.65 3ngb s LEU 82 CO 0.66 -1.48 0.07 0.42 0.23 0.00 0.00 176.35 176.25 3ngb s THR 83 N -2.68 0.30 0.59 5.49 -4.23 -1.26 -1.45 115.64 112.39 3ngb s THR 83 Ca 0.62 -1.97 0.29 0.00 -1.18 0.00 0.00 61.69 59.45 3ngb s THR 83 Cb -0.16 -2.29 0.36 0.00 1.34 0.00 0.00 72.50 71.75 3ngb s THR 83 CO 0.46 -0.26 2.06 1.62 -0.54 0.00 0.00 174.62 177.95 3ngb h VAL 84 N 2.67 0.45 0.00 2.29 3.04 -1.97 0.22 116.25 122.96 3ngb h VAL 84 Ca -0.36 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 3ngb h VAL 84 Cb 1.22 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 3ngb h VAL 84 CO 0.59 0.00 0.00 0.44 -1.01 0.00 0.00 177.57 177.59 3ngb h ASP 85 N 0.00 0.00 0.25 3.17 3.32 -1.95 -2.52 116.42 118.68 3ngb h ASP 85 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3ngb h ASP 85 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3ngb h ASP 85 CO -0.00 0.00 -0.04 0.47 -1.72 0.00 0.00 179.24 177.95 3ngb n ASP 86 N -3.01 0.32 -4.66 6.45 8.00 0.07 -4.82 116.55 118.90 3ngb n ASP 86 Ca -0.00 -0.72 -0.42 0.00 0.71 0.00 0.00 54.79 54.36 3ngb n ASP 86 Cb 0.24 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 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 -2.29 3.08 0.00 -3.53 2.01 -0.95 -4.88 115.64 109.08 3ngb s THR 87 Ca 0.36 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.52 3ngb s THR 87 Cb 0.21 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.62 3ngb s THR 87 CO 0.42 -0.01 0.00 0.00 -0.69 0.00 0.00 174.62 174.34 3ngb n ALA 88 N 7.27 0.00 -3.78 7.40 0.00 -0.88 -4.73 120.51 125.79 3ngb n ALA 88 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.29 3ngb n ALA 88 Cb 0.41 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.71 3ngb n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ngb s VAL 89 N -2.15 2.77 -0.24 0.00 1.01 -0.31 -0.88 120.40 120.61 3ngb s VAL 89 Ca 0.00 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 60.93 3ngb s VAL 89 Cb 0.00 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3ngb s VAL 89 CO 0.00 0.35 0.51 -0.31 0.00 0.00 0.00 175.10 175.64 3ngb s TYR 90 N 1.35 3.31 0.13 5.22 1.51 -0.82 -1.09 117.35 126.97 3ngb s TYR 90 Ca 0.03 0.68 0.07 0.00 -1.01 0.00 0.00 57.07 56.84 3ngb s TYR 90 Cb -0.15 -2.69 -0.04 0.00 -0.11 0.00 0.00 41.96 38.97 3ngb s TYR 90 CO -0.06 -0.20 -0.05 -0.06 -1.11 0.00 0.00 175.55 174.07 3ngb s PHE 91 N 2.00 2.81 -0.09 2.71 0.08 -0.17 -0.38 117.98 124.95 3ngb s PHE 91 Ca 0.22 -0.13 0.01 0.00 0.12 0.00 0.00 56.93 57.15 3ngb s PHE 91 Cb -0.15 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 40.85 3ngb s PHE 91 CO 0.09 0.48 -0.11 0.00 -0.10 0.00 0.00 175.22 175.58 3ngb s THR 93 N -0.35 1.28 -0.04 0.00 -4.23 -0.23 -2.20 115.64 109.87 3ngb s THR 93 Ca 0.04 -2.08 -0.04 0.00 -1.18 0.00 0.00 61.69 58.43 3ngb s THR 93 Cb -0.12 -2.17 0.01 0.00 1.34 0.00 0.00 72.50 71.56 3ngb s THR 93 CO 0.02 -0.49 0.12 -0.60 -0.54 0.00 0.00 174.62 173.13 3ngb s ARG 94 N -3.77 0.14 0.98 3.99 3.52 -0.63 -1.25 118.95 121.93 3ngb s ARG 94 Ca 0.24 0.16 -0.11 0.00 -0.13 0.00 0.00 55.73 55.89 3ngb s ARG 94 Cb 0.03 0.07 0.17 0.00 -1.56 0.00 0.00 34.95 33.66 3ngb s ARG 94 CO 0.06 -0.02 1.03 0.41 -0.81 0.00 0.00 175.30 175.98 3ngb n GLY 95 N 3.01 -0.91 0.31 8.12 0.00 -1.23 -2.61 105.19 111.88 3ngb n GLY 95 Ca -0.12 -0.82 0.02 0.00 0.00 0.00 0.00 46.02 45.10 3ngb n GLY 95 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ngb h LYS 96 N -2.05 0.80 -4.40 1.61 3.64 -1.29 -3.42 116.57 111.45 3ngb h LYS 96 Ca -0.47 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 58.70 3ngb h LYS 96 Cb 1.29 -0.18 -0.15 0.00 -0.41 0.00 0.00 32.23 32.78 3ngb h LYS 96 CO 0.42 0.53 -0.68 0.54 -2.27 0.00 0.00 179.45 177.99 3ngb s ASN 97 N -5.64 0.69 0.39 4.20 4.22 -1.26 -5.00 114.94 112.54 3ngb s ASN 97 Ca -0.12 -1.03 0.28 0.00 -2.14 0.00 0.00 52.86 49.85 3ngb s ASN 97 Cb 0.19 0.17 1.33 0.00 1.28 0.00 0.00 41.25 44.22 3ngb s ASN 97 CO 0.78 -0.57 1.84 0.00 -2.04 0.00 0.00 177.10 177.11 3ngb h ASP 99 N 0.00 -0.34 -3.37 0.00 3.45 -1.96 -3.44 116.42 110.76 3ngb h ASP 99 Ca 0.00 -0.17 -0.64 0.00 0.43 0.00 0.00 57.03 56.65 3ngb h ASP 99 Cb 0.21 0.09 -0.21 0.00 -0.56 0.00 0.00 39.33 38.86 3ngb h ASP 99 CO 0.00 0.14 -0.64 -0.47 -1.57 0.00 0.00 179.24 176.70 3ngb s TYR 100 N -3.59 3.09 -0.11 4.55 6.04 -1.17 -5.01 117.35 121.15 3ngb s TYR 100 Ca -0.11 -0.27 0.15 0.00 0.04 0.00 0.00 57.07 56.88 3ngb s TYR 100 Cb 0.01 -2.05 -0.08 0.00 -1.04 0.00 0.00 41.96 38.80 3ngb s TYR 100 CO 0.39 -0.08 1.09 -0.97 -1.54 0.00 0.00 175.55 174.43 3ngb h ASN 100 N 7.09 0.00 0.06 4.32 -1.24 -1.85 -3.37 115.58 120.59 3ngb h ASN 100 Ca -0.35 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.66 3ngb h ASN 100 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 3ngb h ASN 100 CO 0.63 0.62 -0.13 0.79 -1.29 0.00 0.00 177.43 178.05 3ngb n TRP 100 N -3.07 0.00 -2.18 0.67 7.02 -1.26 -3.57 117.44 115.05 3ngb n TRP 100 Ca -0.05 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.01 3ngb n TRP 100 Cb 0.82 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.68 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 0.09 5.30 -4.56 -0.99 8.00 -1.26 -4.94 116.55 118.19 3ngb n ASP 100 Ca 0.15 -3.06 -0.13 0.00 0.71 0.00 0.00 54.79 52.46 3ngb n ASP 100 Cb 0.40 -1.50 -0.08 0.00 -0.02 0.00 0.00 41.12 39.93 3ngb n ASP 100 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ngb n PHE 100 N 3.97 1.10 0.21 1.24 3.72 -1.26 -1.10 117.46 125.34 3ngb n PHE 100 Ca 0.45 -0.03 0.12 0.00 -0.05 0.00 0.00 57.45 57.93 3ngb n PHE 100 Cb 0.35 -2.56 0.02 0.00 -0.94 0.00 0.00 39.48 36.35 3ngb n PHE 100 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3ngb n GLU 101 N 8.63 0.53 -4.21 -1.08 2.13 -1.17 -4.85 120.64 120.62 3ngb n GLU 101 Ca 0.47 0.08 -0.34 0.00 0.66 0.00 0.00 57.16 58.03 3ngb n GLU 101 Cb 0.43 -1.76 -0.15 0.00 0.27 0.00 0.00 31.44 30.22 3ngb n GLU 101 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 3ngb s HIS 102 N -3.33 2.85 0.22 4.31 3.76 -1.07 -5.01 115.29 117.01 3ngb s HIS 102 Ca 0.00 -1.14 0.09 0.00 -0.15 0.00 0.00 55.06 53.86 3ngb s HIS 102 Cb 0.11 -1.97 -0.05 0.00 1.11 0.00 0.00 32.58 31.78 3ngb s HIS 102 CO 0.79 -0.57 -0.16 -1.58 -0.85 0.00 0.00 174.74 172.37 3ngb s TRP 103 N 1.14 1.83 0.71 1.40 0.52 -1.26 -1.60 118.94 121.69 3ngb s TRP 103 Ca 0.01 -0.52 -0.05 0.00 0.02 0.00 0.00 56.10 55.56 3ngb s TRP 103 Cb -0.14 -0.83 0.09 0.00 -1.15 0.00 0.00 33.47 31.44 3ngb s TRP 103 CO -0.04 0.43 1.00 0.20 0.02 0.00 0.00 176.95 178.56 3ngb s GLY 104 N -3.34 1.75 0.43 0.98 0.00 -0.94 -4.50 107.32 101.70 3ngb s GLY 104 Ca 0.24 -1.28 0.30 0.00 0.00 0.00 0.00 44.72 43.98 3ngb s GLY 104 CO 0.08 -0.80 1.90 3.21 0.00 0.00 0.00 173.10 177.49 3ngb h ARG 105 N -0.59 0.00 0.00 2.90 3.08 -1.94 -3.46 114.38 114.37 3ngb h ARG 105 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.63 3ngb h ARG 105 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3ngb h ARG 105 CO 0.50 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.81 3ngb n GLY 106 N -0.42 1.27 2.88 0.04 0.00 -1.26 -4.99 105.19 102.71 3ngb n GLY 106 Ca 0.00 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.44 1.92 0.17 2.61 2.01 0.49 -4.84 115.64 115.56 3ngb s THR 107 Ca 0.00 -2.52 -0.32 0.00 0.31 0.00 0.00 61.69 59.17 3ngb s THR 107 Cb 0.00 -2.38 -0.11 0.00 0.01 0.00 0.00 72.50 70.02 3ngb s THR 107 CO 0.00 -0.74 1.77 -2.84 -0.69 0.00 0.00 174.62 172.12 3ngb s PRO 108 N 0.54 4.13 -0.18 4.92 0.02 -1.26 -1.94 135.00 141.23 3ngb s PRO 108 Ca 0.14 2.60 -0.00 0.00 0.02 0.00 0.00 61.00 63.75 3ngb s PRO 108 Cb -0.22 -3.32 0.05 0.00 0.02 0.00 0.00 34.50 31.03 3ngb s PRO 108 CO -0.07 -0.79 -0.04 0.08 -0.33 0.00 0.00 177.00 175.85 3ngb s VAL 109 N 1.90 1.14 -0.29 3.83 1.01 -0.06 -0.67 120.40 127.25 3ngb s VAL 109 Ca 0.78 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 3ngb s VAL 109 Cb -0.48 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.53 3ngb s VAL 109 CO 0.34 0.05 0.10 -0.63 0.00 0.00 0.00 175.10 174.96 3ngb s ILE 110 N 1.60 4.17 -0.36 2.22 1.01 -0.77 -2.07 121.20 127.00 3ngb s ILE 110 Ca -0.01 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.93 3ngb s ILE 110 Cb -0.16 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 3ngb s ILE 110 CO -0.07 0.11 0.36 -0.69 0.00 0.00 0.00 174.94 174.65 3ngb s VAL 111 N 1.54 5.17 -0.11 2.92 1.01 -1.26 -1.33 120.40 128.34 3ngb s VAL 111 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 3ngb s VAL 111 Cb -0.17 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 3ngb s VAL 111 CO 0.04 -0.15 -0.10 -0.94 0.00 0.00 0.00 175.10 173.95 3ngb s SER 112 N 1.74 4.32 -0.02 3.32 1.04 -0.24 -4.55 113.70 119.31 3ngb s SER 112 Ca 0.11 -0.19 -0.16 0.00 0.48 0.00 0.00 55.95 56.19 3ngb s SER 112 Cb -0.17 -1.41 -0.05 0.00 0.10 0.00 0.00 66.02 64.48 3ngb s SER 112 CO 0.12 0.24 0.44 -0.55 0.98 0.00 0.00 173.24 174.47 3ngb s SER 113 N -0.10 6.81 0.00 7.02 0.15 -1.26 -4.11 113.70 122.21 3ngb s SER 113 Ca -0.00 0.96 0.14 0.00 0.70 0.00 0.00 55.95 57.75 3ngb s SER 113 Cb -0.13 -2.27 0.67 0.00 -1.71 0.00 0.00 66.02 62.58 3ngb s SER 113 CO 0.03 0.25 1.41 -2.65 1.20 0.00 0.00 173.24 173.48 3ngb n PRO 114 N 2.24 0.13 -3.39 5.44 -0.02 -1.26 -4.72 135.00 133.42 3ngb n PRO 114 Ca -0.12 0.19 -0.37 0.00 -2.02 0.00 0.00 63.50 61.18 3ngb n PRO 114 Cb 0.52 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.44 3ngb n PRO 114 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ngb s SER 115 N -2.73 6.61 0.37 2.55 0.15 -1.26 -5.08 113.70 114.30 3ngb s SER 115 Ca 0.11 0.72 0.04 0.00 0.70 0.00 0.00 55.95 57.52 3ngb s SER 115 Cb 0.09 -2.25 -0.05 0.00 -1.71 0.00 0.00 66.02 62.10 3ngb s SER 115 CO 0.23 0.04 0.06 0.42 1.20 0.00 0.00 173.24 175.19 3ngb s THR 116 N 0.53 1.17 -0.23 6.45 -4.23 -1.26 -4.71 115.64 113.36 3ngb s THR 116 Ca 0.23 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.65 3ngb s THR 116 Cb -0.14 -2.67 0.10 0.00 1.34 0.00 0.00 72.50 71.12 3ngb s THR 116 CO 0.08 0.00 0.50 -0.75 -0.54 0.00 0.00 174.62 173.92 3ngb s LYS 117 N -3.83 0.44 0.68 3.99 2.20 -0.21 -4.96 119.74 118.04 3ngb s LYS 117 Ca 0.31 1.13 -0.15 0.00 -0.36 0.00 0.00 55.97 56.91 3ngb s LYS 117 Cb 0.07 0.42 0.01 0.00 -1.51 0.00 0.00 37.83 36.82 3ngb s LYS 117 CO 0.14 -0.22 1.12 0.20 -0.36 0.00 0.00 175.35 176.24 3ngb s GLY 118 N 2.44 2.14 0.54 5.54 0.00 -1.26 -2.06 107.32 114.66 3ngb s GLY 118 Ca -0.05 0.57 -0.18 0.00 0.00 0.00 0.00 44.72 45.06 3ngb s GLY 118 CO -0.15 0.93 1.05 -4.14 0.00 0.00 0.00 173.10 170.78 3ngb s PRO 119 N -4.13 3.57 -0.26 2.90 0.02 -1.26 -4.54 135.00 131.29 3ngb s PRO 119 Ca 0.67 1.26 -0.08 0.00 0.02 0.00 0.00 61.00 62.88 3ngb s PRO 119 Cb -0.21 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.21 3ngb s PRO 119 CO 0.43 -0.61 0.09 -1.12 -0.33 0.00 0.00 177.00 175.45 3ngb s SER 120 N -2.44 5.24 -0.46 2.53 0.01 0.20 -4.91 113.70 113.87 3ngb s SER 120 Ca 0.65 -0.23 -0.15 0.00 1.31 0.00 0.00 55.95 57.53 3ngb s SER 120 Cb -0.16 -1.94 0.06 0.00 0.21 0.00 0.00 66.02 64.19 3ngb s SER 120 CO 0.29 -0.05 0.37 -0.69 0.41 0.00 0.00 173.24 173.57 3ngb s VAL 121 N 1.62 5.21 -0.16 3.43 1.01 -1.26 -1.34 120.40 128.91 3ngb s VAL 121 Ca 0.06 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 3ngb s VAL 121 Cb -0.15 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3ngb s VAL 121 CO 0.04 -0.52 0.02 -0.36 0.00 0.00 0.00 175.10 174.28 3ngb s PHE 122 N 1.64 3.17 0.27 5.22 0.08 -1.21 -4.90 117.98 122.26 3ngb s PHE 122 Ca 0.04 -0.01 -0.30 0.00 0.12 0.00 0.00 56.93 56.78 3ngb s PHE 122 Cb -0.23 -1.99 -0.10 0.00 -0.57 0.00 0.00 43.02 40.13 3ngb s PHE 122 CO 0.07 0.16 1.39 -2.14 -0.10 0.00 0.00 175.22 174.60 3ngb s PRO 123 N 0.12 4.30 -0.92 0.24 0.02 -1.26 -1.50 135.00 135.99 3ngb s PRO 123 Ca 0.03 2.26 -0.05 0.00 0.02 0.00 0.00 61.00 63.26 3ngb s PRO 123 Cb -0.13 -3.10 0.23 0.00 0.02 0.00 0.00 34.50 31.52 3ngb s PRO 123 CO 0.01 -0.34 0.84 -0.51 -0.33 0.00 0.00 177.00 176.67 3ngb s LEU 124 N -0.81 5.84 0.36 -5.54 1.02 0.31 -4.92 118.68 114.94 3ngb s LEU 124 Ca 0.56 -3.51 -0.28 0.00 0.02 0.00 0.00 54.13 50.91 3ngb s LEU 124 Cb -0.41 -2.01 -0.11 0.00 0.02 0.00 0.00 46.19 43.68 3ngb s LEU 124 CO 0.46 -0.26 1.50 0.00 0.02 0.00 0.00 176.35 178.07 3ngb n ALA 125 N 2.69 2.37 0.13 4.21 0.00 -1.26 -2.51 120.51 126.13 3ngb n ALA 125 Ca 0.20 0.35 -0.07 0.00 0.00 0.00 0.00 53.44 53.91 3ngb n ALA 125 Cb 0.39 -2.42 -0.04 0.00 0.00 0.00 0.00 19.45 17.37 3ngb n ALA 125 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3ngb h PRO 126 N 3.30 -0.41 0.00 0.00 0.11 -1.77 -3.46 132.00 129.77 3ngb h PRO 126 Ca -0.50 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3ngb h PRO 126 Cb 1.24 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3ngb h PRO 126 CO 0.67 -0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 177.06 3ngb n SER 127 N -3.56 0.00 0.00 -2.05 3.41 -1.26 -4.83 113.62 105.33 3ngb n SER 127 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 3ngb n SER 127 Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3ngb n SER 127 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ngb n SER 128 N 0.00 0.00 -4.72 4.04 2.88 -1.26 -0.97 113.62 113.59 3ngb n SER 128 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 3ngb n SER 128 Cb 0.00 0.08 -0.03 0.00 -0.75 0.00 0.00 64.21 63.50 3ngb n SER 128 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3ngb s LYS 129 N -1.58 4.55 0.10 -1.46 2.20 -1.26 -5.04 119.74 117.26 3ngb s LYS 129 Ca 0.00 1.58 0.09 0.00 -0.36 0.00 0.00 55.97 57.29 3ngb s LYS 129 Cb 0.00 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 3ngb s LYS 129 CO 0.00 -0.04 -0.24 -1.54 -0.36 0.00 0.00 175.35 173.17 3ngb s SER 130 N 0.63 2.93 0.12 1.43 1.04 -1.26 -5.09 113.70 113.49 3ngb s SER 130 Ca 0.53 -0.69 0.04 0.00 0.48 0.00 0.00 55.95 56.31 3ngb s SER 130 Cb -0.25 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.63 3ngb s SER 130 CO 0.30 0.14 -0.11 -0.89 0.98 0.00 0.00 173.24 173.66 3ngb s THR 131 N -1.06 1.08 0.07 2.02 2.01 -1.26 -5.00 115.64 113.51 3ngb s THR 131 Ca 0.10 -1.79 -0.19 0.00 0.31 0.00 0.00 61.69 60.12 3ngb s THR 131 Cb -0.10 -1.55 -0.10 0.00 0.01 0.00 0.00 72.50 70.76 3ngb s THR 131 CO 0.05 -0.59 1.48 0.28 -0.69 0.00 0.00 174.62 175.14 3ngb h SER 132 N 3.30 0.40 0.24 3.53 0.02 -1.97 -2.62 113.55 116.45 3ngb h SER 132 Ca -0.38 -0.35 -0.34 0.00 -0.84 0.00 0.00 61.79 59.88 3ngb h SER 132 Cb 1.19 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.58 3ngb h SER 132 CO 0.56 0.66 -1.98 0.61 -1.14 0.00 0.00 176.83 175.54 3ngb n GLY 133 N -0.19 -0.74 3.38 -3.77 0.00 -1.26 -4.49 105.19 98.11 3ngb n GLY 133 Ca -0.04 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 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 1.84 -2.13 3.30 -0.02 0.00 -1.26 -4.82 105.19 102.10 3ngb n GLY 134 Ca -0.28 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 3ngb n GLY 134 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ngb s THR 135 N -2.35 1.98 0.34 2.61 -1.32 -1.26 -1.88 115.64 113.76 3ngb s THR 135 Ca 0.57 -1.18 0.08 0.00 -1.21 0.00 0.00 61.69 59.96 3ngb s THR 135 Cb -0.18 -1.66 -0.07 0.00 -1.51 0.00 0.00 72.50 69.08 3ngb s THR 135 CO 0.67 0.45 -0.06 0.00 -2.21 0.00 0.00 174.62 173.47 3ngb s ALA 136 N -0.68 2.85 -0.01 11.08 0.00 0.17 -4.70 121.76 130.48 3ngb s ALA 136 Ca 0.10 -2.10 0.00 0.00 0.00 0.00 0.00 51.96 49.96 3ngb s ALA 136 Cb -0.10 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3ngb s ALA 136 CO 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 175.76 175.77 3ngb s ALA 137 N -2.74 0.11 0.30 0.00 0.00 -1.26 -1.28 121.76 116.88 3ngb s ALA 137 Ca 0.33 0.15 0.03 0.00 0.00 0.00 0.00 51.96 52.47 3ngb s ALA 137 Cb 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3ngb s ALA 137 CO 0.16 -0.05 0.17 -0.48 0.00 0.00 0.00 175.76 175.56 3ngb s LEU 138 N 0.62 1.63 0.00 0.00 0.05 -0.71 -4.20 118.68 116.07 3ngb s LEU 138 Ca -0.05 -1.57 0.00 0.00 0.05 0.00 0.00 54.13 52.55 3ngb s LEU 138 Cb -0.08 0.27 0.00 0.00 -2.05 0.00 0.00 46.19 44.33 3ngb s LEU 138 CO -0.02 -0.91 0.00 0.61 -0.55 0.00 0.00 176.35 175.48 3ngb n GLY 139 N -0.56 -1.31 1.32 -3.48 0.00 -1.05 -0.16 105.19 99.95 3ngb n GLY 139 Ca 0.02 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 3ngb n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngb n LEU 141 N 0.00 -1.48 -4.56 0.00 7.94 -0.56 -3.71 117.00 114.64 3ngb n LEU 141 Ca -0.03 -3.91 -0.38 0.00 -1.11 0.00 0.00 56.01 50.58 3ngb n LEU 141 Cb 0.22 0.68 -0.03 0.00 0.53 0.00 0.00 43.42 44.82 3ngb n LEU 141 CO 0.13 1.96 1.79 -0.69 -1.11 0.00 0.00 177.39 179.46 3ngb s VAL 142 N 0.06 3.20 0.02 1.96 1.01 -0.58 -3.28 120.40 122.78 3ngb s VAL 142 Ca 0.33 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.52 3ngb s VAL 142 Cb 0.10 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 3ngb s VAL 142 CO -0.15 -0.43 -0.23 -0.75 0.00 0.00 0.00 175.10 173.54 3ngb s LYS 143 N 7.38 1.67 -0.83 2.72 2.20 -0.45 -1.16 119.74 131.28 3ngb s LYS 143 Ca 0.83 -0.95 -0.04 0.00 -0.36 0.00 0.00 55.97 55.45 3ngb s LYS 143 Cb -0.17 -1.75 -0.05 0.00 -1.51 0.00 0.00 37.83 34.36 3ngb s LYS 143 CO 0.25 0.46 0.73 -0.25 -0.36 0.00 0.00 175.35 176.18 3ngb n ASP 144 N 2.06 -5.98 -4.47 1.43 8.00 -0.75 -0.63 116.55 116.22 3ngb n ASP 144 Ca -0.16 -0.51 -0.22 0.00 0.71 0.00 0.00 54.79 54.60 3ngb n ASP 144 Cb 0.52 -4.41 -0.11 0.00 -0.02 0.00 0.00 41.12 37.11 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 -3.27 2.05 -0.29 1.24 1.13 -0.93 -4.45 117.35 112.83 3ngb s TYR 145 Ca 0.32 -0.82 -0.18 0.00 -1.41 0.00 0.00 57.07 54.99 3ngb s TYR 145 Cb -0.04 -1.30 0.16 0.00 -1.10 0.00 0.00 41.96 39.67 3ngb s TYR 145 CO 0.61 0.18 1.08 0.12 -2.51 0.00 0.00 175.55 175.03 3ngb s PHE 146 N -3.10 -0.41 0.00 -3.49 2.19 -0.88 -1.05 117.98 111.24 3ngb s PHE 146 Ca 0.34 0.85 0.00 0.00 0.33 0.00 0.00 56.93 58.44 3ngb s PHE 146 Cb 0.07 0.28 0.00 0.00 -1.31 0.00 0.00 43.02 42.07 3ngb s PHE 146 CO 0.15 -0.20 0.00 -0.35 1.83 0.00 0.00 175.22 176.64 3ngb n PRO 147 N 3.25 1.30 -1.32 10.12 -0.05 -1.26 -1.05 135.00 146.00 3ngb n PRO 147 Ca -0.17 0.00 -0.30 0.00 -0.05 0.00 0.00 63.50 62.98 3ngb n PRO 147 Cb 0.57 0.00 0.10 0.00 -0.05 0.00 0.00 33.50 34.12 3ngb n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 3ngb s GLU 148 N -0.77 2.00 0.49 0.54 2.02 -1.26 -4.79 118.70 116.94 3ngb s GLU 148 Ca 0.00 0.96 0.05 0.00 0.02 0.00 0.00 54.97 56.00 3ngb s GLU 148 Cb 0.00 -1.88 0.05 0.00 0.10 0.00 0.00 34.13 32.40 3ngb s GLU 148 CO 0.00 -1.76 0.42 -0.35 0.02 0.00 0.00 175.26 173.59 3ngb n PRO 149 N -3.58 0.76 -4.38 0.39 -0.05 -1.26 -4.95 135.00 121.93 3ngb n PRO 149 Ca 0.08 -2.97 -0.20 0.00 -0.05 0.00 0.00 63.50 60.35 3ngb n PRO 149 Cb 0.54 0.23 -0.16 0.00 -0.05 0.00 0.00 33.50 34.07 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 0.78 0.02 0.52 -7.23 -1.26 -4.52 120.40 106.35 3ngb s VAL 150 Ca 0.32 -0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.14 3ngb s VAL 150 Cb -0.03 -0.70 -0.04 0.00 0.56 0.00 0.00 36.38 36.18 3ngb s VAL 150 CO 0.20 0.25 0.11 0.42 -0.31 0.00 0.00 175.10 175.77 3ngb s THR 151 N 0.23 4.87 -0.06 5.32 -4.23 -0.65 -4.95 115.64 116.16 3ngb s THR 151 Ca -0.04 -0.46 -0.03 0.00 -1.18 0.00 0.00 61.69 59.99 3ngb s THR 151 Cb -0.09 -3.28 0.04 0.00 1.34 0.00 0.00 72.50 70.50 3ngb s THR 151 CO 0.01 0.26 0.07 0.54 -0.54 0.00 0.00 174.62 174.96 3ngb s VAL 152 N -1.30 -0.12 0.40 2.29 0.11 -1.26 -0.51 120.40 120.01 3ngb s VAL 152 Ca 0.27 0.33 0.07 0.00 -2.93 0.00 0.00 61.98 59.73 3ngb s VAL 152 Cb -0.12 -0.23 -0.05 0.00 -1.53 0.00 0.00 36.38 34.45 3ngb s VAL 152 CO 0.18 0.11 0.20 -0.94 -3.33 0.00 0.00 175.10 171.32 3ngb s SER 153 N 2.18 4.53 -0.17 3.54 1.04 -0.77 -4.92 113.70 119.12 3ngb s SER 153 Ca 0.04 -1.00 0.01 0.00 0.48 0.00 0.00 55.95 55.48 3ngb s SER 153 Cb -0.13 -0.52 0.02 0.00 0.10 0.00 0.00 66.02 65.49 3ngb s SER 153 CO -0.04 -0.53 -0.19 0.26 0.98 0.00 0.00 173.24 173.72 3ngb s TRP 154 N -2.56 2.77 -1.26 5.02 0.52 -1.26 -0.45 118.94 121.72 3ngb s TRP 154 Ca 0.42 -1.52 -0.06 0.00 0.02 0.00 0.00 56.10 54.97 3ngb s TRP 154 Cb 0.02 -1.91 0.01 0.00 -1.15 0.00 0.00 33.47 30.44 3ngb s TRP 154 CO 0.23 -0.74 1.09 0.09 0.02 0.00 0.00 176.95 177.64 3ngb n ASN 155 N 4.50 -4.72 -3.27 2.95 3.02 -0.62 -1.77 115.26 115.35 3ngb n ASN 155 Ca -0.21 -0.55 -0.23 0.00 -0.03 0.00 0.00 54.58 53.56 3ngb n ASN 155 Cb 0.50 -4.94 0.05 0.00 -0.61 0.00 0.00 39.78 34.79 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 -2.95 -6.14 0.00 6.41 7.64 -1.26 -1.92 113.62 115.39 3ngb n SER 156 Ca -0.10 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.38 3ngb n SER 156 Cb 0.60 -4.91 0.00 0.00 -1.01 0.00 0.00 64.21 58.89 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 -1.71 0.58 0.13 0.23 0.00 -1.00 -4.90 105.19 98.52 3ngb n GLY 157 Ca -0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3ngb n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngb h ALA 158 N 0.00 1.00 -3.61 4.61 0.00 -0.98 -3.42 119.26 116.86 3ngb h ALA 158 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 3ngb h ALA 158 Cb 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 17.41 3ngb h ALA 158 CO 0.00 0.00 -0.80 -1.17 0.00 0.00 0.00 179.25 177.28 3ngb s LEU 159 N -4.90 2.63 0.00 0.00 0.20 -0.73 -4.94 118.68 110.94 3ngb s LEU 159 Ca 0.10 -1.12 0.00 0.00 0.69 0.00 0.00 54.13 53.79 3ngb s LEU 159 Cb 0.11 -1.26 0.00 0.00 -0.43 0.00 0.00 46.19 44.61 3ngb s LEU 159 CO 0.61 -0.20 0.00 0.35 -0.29 0.00 0.00 176.35 176.82 3ngb n THR 160 N 4.63 0.00 -2.12 3.68 -2.24 -1.26 -4.11 114.28 112.86 3ngb n THR 160 Ca -0.13 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.22 3ngb n THR 160 Cb 0.44 -0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 67.75 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 -2.99 6.41 0.00 3.42 0.01 -1.26 -2.78 113.70 116.51 3ngb s SER 161 Ca 0.00 1.66 0.00 0.00 1.31 0.00 0.00 55.95 58.92 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 -1.22 0.00 0.61 0.41 0.00 0.00 173.24 173.04 3ngb n GLY 162 N 4.60 2.16 3.72 3.44 0.00 -1.26 -4.74 105.19 113.10 3ngb n GLY 162 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.53 2.70 -0.23 1.61 1.01 -1.12 -3.66 120.40 118.18 3ngb s VAL 163 Ca 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.47 3ngb s VAL 163 Cb 0.00 -3.32 0.07 0.00 0.00 0.00 0.00 36.38 33.13 3ngb s VAL 163 CO 0.00 0.04 0.00 -1.00 0.00 0.00 0.00 175.10 174.14 3ngb s HIS 164 N 1.17 1.78 -0.40 5.22 3.76 0.42 -4.99 115.29 122.25 3ngb s HIS 164 Ca 0.70 -1.41 -0.13 0.00 -0.15 0.00 0.00 55.06 54.07 3ngb s HIS 164 Cb -0.43 -1.39 0.03 0.00 1.11 0.00 0.00 32.58 31.90 3ngb s HIS 164 CO 0.31 -0.72 0.26 0.99 -0.85 0.00 0.00 174.74 174.73 3ngb s THR 165 N 1.60 4.90 0.64 1.30 2.01 -1.26 -1.00 115.64 123.82 3ngb s THR 165 Ca -0.02 -0.83 -0.15 0.00 0.31 0.00 0.00 61.69 61.00 3ngb s THR 165 Cb -0.18 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.55 3ngb s THR 165 CO -0.09 -0.31 1.09 -0.36 -0.69 0.00 0.00 174.62 174.26 3ngb s PHE 166 N 1.61 2.75 0.32 4.92 0.40 -0.48 -4.98 117.98 122.52 3ngb s PHE 166 Ca 0.03 1.54 -0.29 0.00 -0.60 0.00 0.00 56.93 57.61 3ngb s PHE 166 Cb -0.20 -3.11 -0.11 0.00 0.51 0.00 0.00 43.02 40.11 3ngb s PHE 166 CO 0.08 -1.49 1.54 -2.14 0.70 0.00 0.00 175.22 173.90 3ngb s PRO 167 N -4.08 4.13 0.40 0.24 0.02 -1.26 -4.54 135.00 129.90 3ngb s PRO 167 Ca 0.66 2.55 -0.27 0.00 0.02 0.00 0.00 61.00 63.95 3ngb s PRO 167 Cb -0.19 -3.01 -0.10 0.00 0.02 0.00 0.00 34.50 31.22 3ngb s PRO 167 CO 0.40 -0.57 1.46 0.00 -0.33 0.00 0.00 177.00 177.96 3ngb s ALA 168 N -0.45 3.48 -0.10 -1.55 0.00 -1.26 -4.82 121.76 117.05 3ngb s ALA 168 Ca 0.59 1.53 0.03 0.00 0.00 0.00 0.00 51.96 54.11 3ngb s ALA 168 Cb -0.47 -3.60 -0.01 0.00 0.00 0.00 0.00 23.12 19.05 3ngb s ALA 168 CO 0.53 -1.08 -0.21 0.08 0.00 0.00 0.00 175.76 175.08 3ngb s VAL 169 N -1.15 2.33 -0.50 0.00 1.01 -0.44 -4.92 120.40 116.74 3ngb s VAL 169 Ca 0.55 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 3ngb s VAL 169 Cb -0.45 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.05 3ngb s VAL 169 CO 0.61 0.55 1.11 -0.22 0.00 0.00 0.00 175.10 177.15 3ngb s LEU 170 N 0.25 3.67 1.22 3.92 2.96 -1.26 -1.55 118.68 127.88 3ngb s LEU 170 Ca -0.14 0.29 -0.20 0.00 -0.22 0.00 0.00 54.13 53.85 3ngb s LEU 170 Cb -0.17 -3.37 0.30 0.00 0.50 0.00 0.00 46.19 43.45 3ngb s LEU 170 CO 0.07 -1.28 1.13 -1.10 -1.32 0.00 0.00 176.35 173.85 3ngb s GLN 171 N 4.45 -1.37 0.10 1.98 -0.21 -0.64 -4.93 119.66 119.05 3ngb s GLN 171 Ca 0.44 -0.19 0.25 0.00 0.02 0.00 0.00 55.36 55.88 3ngb s GLN 171 Cb -0.08 -1.59 0.96 0.00 1.00 0.00 0.00 33.01 33.30 3ngb s GLN 171 CO 0.29 -3.79 1.76 0.43 -2.12 0.00 0.00 175.29 171.87 3ngb n SER 172 N -4.79 0.34 -0.40 5.90 7.64 -1.26 -3.00 113.62 118.05 3ngb n SER 172 Ca 0.15 0.55 0.14 0.00 1.01 0.00 0.00 58.87 60.71 3ngb n SER 172 Cb 0.60 -0.63 0.47 0.00 -1.01 0.00 0.00 64.21 63.63 3ngb n SER 172 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3ngb n SER 173 N -1.84 1.34 0.00 6.43 3.41 -1.26 -4.90 113.62 116.80 3ngb n SER 173 Ca 0.05 -1.28 0.00 0.00 -0.26 0.00 0.00 58.87 57.38 3ngb n SER 173 Cb 0.32 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 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 1.24 0.61 3.45 5.00 0.00 -1.16 -5.04 105.19 109.29 3ngb n GLY 174 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 2.62 0.62 0.99 1.43 -1.26 -4.93 118.68 118.14 3ngb s LEU 175 Ca 0.00 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 3ngb s LEU 175 Cb 0.00 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.68 3ngb s LEU 175 CO 0.00 0.30 0.98 -0.31 0.23 0.00 0.00 176.35 177.56 3ngb s TYR 176 N -0.81 3.46 -0.28 0.29 2.02 -0.22 -1.62 117.35 120.19 3ngb s TYR 176 Ca 0.13 1.01 -0.18 0.00 -0.37 0.00 0.00 57.07 57.66 3ngb s TYR 176 Cb -0.11 -2.76 0.09 0.00 -0.40 0.00 0.00 41.96 38.79 3ngb s TYR 176 CO 0.03 -0.79 0.77 0.45 -1.57 0.00 0.00 175.55 174.43 3ngb s SER 177 N -4.24 -0.81 0.15 2.29 0.15 -0.60 -1.81 113.70 108.82 3ngb s SER 177 Ca 0.54 1.34 -0.03 0.00 0.70 0.00 0.00 55.95 58.51 3ngb s SER 177 Cb -0.11 1.34 -0.03 0.00 -1.71 0.00 0.00 66.02 65.51 3ngb s SER 177 CO 0.50 -0.22 0.11 -1.48 1.20 0.00 0.00 173.24 173.35 3ngb s LEU 178 N 1.30 1.55 0.14 3.45 0.05 -0.31 -1.33 118.68 123.52 3ngb s LEU 178 Ca -0.07 -1.16 0.10 0.00 0.05 0.00 0.00 54.13 53.04 3ngb s LEU 178 Cb -0.05 0.48 -0.04 0.00 -2.05 0.00 0.00 46.19 44.54 3ngb s LEU 178 CO -0.15 -0.77 -0.23 -0.44 -0.55 0.00 0.00 176.35 174.21 3ngb s SER 179 N -3.05 2.94 -0.27 1.48 0.01 -1.26 -1.53 113.70 112.02 3ngb s SER 179 Ca 0.24 -0.76 -0.02 0.00 1.31 0.00 0.00 55.95 56.72 3ngb s SER 179 Cb 0.07 -0.18 0.09 0.00 0.21 0.00 0.00 66.02 66.20 3ngb s SER 179 CO 0.03 0.09 0.08 -0.55 0.41 0.00 0.00 173.24 173.29 3ngb s SER 180 N -2.20 3.67 0.41 2.44 0.15 -1.24 -1.39 113.70 115.54 3ngb s SER 180 Ca 0.13 -1.36 0.07 0.00 0.70 0.00 0.00 55.95 55.48 3ngb s SER 180 Cb -0.09 -0.75 0.01 0.00 -1.71 0.00 0.00 66.02 63.48 3ngb s SER 180 CO 0.06 -0.38 0.57 0.68 1.20 0.00 0.00 173.24 175.37 3ngb s VAL 181 N 1.72 3.28 -0.23 4.45 -7.23 -0.17 -1.81 120.40 120.41 3ngb s VAL 181 Ca 0.06 -0.94 -0.19 0.00 -1.81 0.00 0.00 61.98 59.09 3ngb s VAL 181 Cb -0.17 -3.12 0.06 0.00 0.56 0.00 0.00 36.38 33.70 3ngb s VAL 181 CO -0.21 -0.05 0.60 0.54 -0.31 0.00 0.00 175.10 175.66 3ngb s VAL 182 N -2.36 -0.00 -0.13 1.32 0.11 0.78 -0.44 120.40 119.68 3ngb s VAL 182 Ca 0.52 0.01 -0.07 0.00 -2.93 0.00 0.00 61.98 59.51 3ngb s VAL 182 Cb -0.10 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3ngb s VAL 182 CO 0.33 0.00 0.12 0.42 -3.33 0.00 0.00 175.10 172.65 3ngb s THR 183 N 0.54 5.33 0.03 5.04 -4.23 -1.24 -1.74 115.64 119.38 3ngb s THR 183 Ca -0.02 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 60.53 3ngb s THR 183 Cb -0.05 -3.33 0.01 0.00 1.34 0.00 0.00 72.50 70.47 3ngb s THR 183 CO -0.02 0.59 0.22 0.68 -0.54 0.00 0.00 174.62 175.55 3ngb s VAL 184 N -0.78 0.10 0.20 2.29 -7.23 -0.40 -4.76 120.40 109.82 3ngb s VAL 184 Ca 0.13 -0.80 -0.33 0.00 -1.81 0.00 0.00 61.98 59.18 3ngb s VAL 184 Cb -0.12 -0.85 -0.13 0.00 0.56 0.00 0.00 36.38 35.84 3ngb s VAL 184 CO 0.03 -0.44 1.60 -2.65 -0.31 0.00 0.00 175.10 173.33 3ngb n PRO 185 N 0.78 2.40 0.31 4.82 -0.02 -1.26 -0.66 135.00 141.37 3ngb n PRO 185 Ca -0.19 0.86 0.19 0.00 -2.02 0.00 0.00 63.50 62.34 3ngb n PRO 185 Cb 0.58 -2.64 1.04 0.00 -0.02 0.00 0.00 33.50 32.46 3ngb n PRO 185 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3ngb h SER 186 N 5.84 0.00 -0.02 2.55 4.64 -1.58 0.38 113.55 125.35 3ngb h SER 186 Ca -0.45 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.80 3ngb h SER 186 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 3ngb h SER 186 CO 0.88 0.01 -0.20 0.77 -0.87 0.00 0.00 176.83 177.43 3ngb h SER 187 N 0.00 0.38 -0.08 4.97 4.64 -1.67 -2.84 113.55 118.95 3ngb h SER 187 Ca -0.00 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.21 3ngb h SER 187 Cb 0.07 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3ngb h SER 187 CO 0.00 0.59 0.01 -1.54 -0.87 0.00 0.00 176.83 175.02 3ngb n SER 188 N -4.18 1.81 0.05 4.97 3.41 0.12 -3.19 113.62 116.61 3ngb n SER 188 Ca -0.00 -2.13 0.12 0.00 -0.26 0.00 0.00 58.87 56.59 3ngb n SER 188 Cb 0.35 -0.53 0.19 0.00 -0.26 0.00 0.00 64.21 63.97 3ngb n SER 188 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ngb n LEU 189 N 0.11 0.65 -0.04 1.04 4.77 -1.07 -2.72 117.00 119.73 3ngb n LEU 189 Ca 0.04 0.20 0.06 0.00 -0.03 0.00 0.00 56.01 56.28 3ngb n LEU 189 Cb 0.41 -0.20 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 3ngb n LEU 189 CO 0.05 -0.02 0.01 0.61 -1.33 0.00 0.00 177.39 176.70 3ngb n GLY 190 N 1.37 -0.22 0.46 -0.72 0.00 -1.19 -4.69 105.19 100.20 3ngb n GLY 190 Ca 0.04 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.50 3ngb n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ngb n THR 191 N -1.16 0.98 -2.97 2.61 -2.24 -1.25 -5.04 114.28 105.21 3ngb n THR 191 Ca 0.03 -0.22 -0.30 0.00 -2.27 0.00 0.00 64.05 61.29 3ngb n THR 191 Cb 0.22 -1.76 -0.04 0.00 -2.10 0.00 0.00 70.33 66.65 3ngb n THR 191 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3ngb s GLN 192 N -2.33 3.79 -0.19 -0.78 -1.52 -1.10 -5.08 119.66 112.44 3ngb s GLN 192 Ca -0.24 0.43 -0.01 0.00 -1.95 0.00 0.00 55.36 53.59 3ngb s GLN 192 Cb 0.09 -2.44 0.01 0.00 -0.22 0.00 0.00 33.01 30.45 3ngb s GLN 192 CO 0.30 0.03 -0.14 -0.08 -0.25 0.00 0.00 175.29 175.16 3ngb s THR 193 N -2.27 2.60 -0.23 -0.19 -1.32 -1.26 -4.75 115.64 108.21 3ngb s THR 193 Ca 0.51 -0.76 -0.09 0.00 -1.21 0.00 0.00 61.69 60.14 3ngb s THR 193 Cb -0.10 -2.13 -0.04 0.00 -1.51 0.00 0.00 72.50 68.71 3ngb s THR 193 CO 0.29 0.49 0.11 -0.31 -2.21 0.00 0.00 174.62 172.99 3ngb s TYR 194 N 1.31 3.19 -0.06 9.09 2.02 -1.26 -4.96 117.35 126.68 3ngb s TYR 194 Ca 0.04 -0.07 0.03 0.00 -0.37 0.00 0.00 57.07 56.70 3ngb s TYR 194 Cb -0.14 -2.23 0.01 0.00 -0.40 0.00 0.00 41.96 39.20 3ngb s TYR 194 CO -0.08 -0.11 -0.16 0.42 -1.57 0.00 0.00 175.55 174.05 3ngb s ILE 195 N 1.21 1.38 -0.18 2.71 1.01 -1.26 -1.17 121.20 124.89 3ngb s ILE 195 Ca 0.06 -0.64 -0.13 0.00 0.00 0.00 0.00 60.65 59.93 3ngb s ILE 195 Cb -0.14 -1.22 -0.05 0.00 0.01 0.00 0.00 42.46 41.06 3ngb s ILE 195 CO 0.04 0.41 0.28 0.00 0.00 0.00 0.00 174.94 175.67 3ngb s ASN 197 N 0.58 5.97 -0.20 0.00 0.02 0.40 -2.09 114.94 119.61 3ngb s ASN 197 Ca 0.15 -2.12 -0.17 0.00 -1.02 0.00 0.00 52.86 49.69 3ngb s ASN 197 Cb -0.13 -2.08 -0.03 0.00 0.02 0.00 0.00 41.25 39.03 3ngb s ASN 197 CO 0.04 -0.68 0.47 -0.69 0.02 0.00 0.00 177.10 176.26 3ngb s VAL 198 N 1.05 5.14 -0.16 1.60 1.01 -0.26 -1.85 120.40 126.94 3ngb s VAL 198 Ca 0.08 0.85 0.02 0.00 0.00 0.00 0.00 61.98 62.93 3ngb s VAL 198 Cb -0.24 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.36 3ngb s VAL 198 CO -0.02 0.20 -0.21 0.21 0.00 0.00 0.00 175.10 175.29 3ngb s ASN 199 N 1.14 3.11 -0.57 3.32 2.47 0.33 -0.42 114.94 124.32 3ngb s ASN 199 Ca 0.22 -0.62 0.04 0.00 0.42 0.00 0.00 52.86 52.92 3ngb s ASN 199 Cb -0.15 -1.45 0.14 0.00 -1.45 0.00 0.00 41.25 38.34 3ngb s ASN 199 CO 0.09 0.04 0.34 -2.28 -3.72 0.00 0.00 177.10 171.57 3ngb s HIS 200 N 1.04 3.08 0.27 0.43 5.65 0.57 -1.64 115.29 124.69 3ngb s HIS 200 Ca -0.02 -3.10 -0.01 0.00 0.25 0.00 0.00 55.06 52.18 3ngb s HIS 200 Cb -0.14 -2.59 0.51 0.00 -1.18 0.00 0.00 32.58 29.18 3ngb s HIS 200 CO -0.07 -0.68 1.81 0.87 -0.65 0.00 0.00 174.74 176.01 3ngb h LYS 201 N 6.13 0.80 -0.40 2.88 1.57 -1.79 -2.25 116.57 123.52 3ngb h LYS 201 Ca 0.02 -0.05 0.12 0.00 -1.87 0.00 0.00 60.65 58.86 3ngb h LYS 201 Cb 0.85 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 3ngb h LYS 201 CO 0.66 0.53 0.42 -1.35 -0.57 0.00 0.00 179.45 179.15 3ngb h PRO 202 N 0.83 0.00 0.00 3.15 0.11 -1.92 -1.15 132.00 133.02 3ngb h PRO 202 Ca 0.46 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.57 3ngb h PRO 202 Cb 0.52 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 3ngb h PRO 202 CO -0.29 0.00 -0.08 -1.13 -0.21 0.00 0.00 178.00 176.29 3ngb n SER 203 N -3.74 2.14 -3.19 -2.05 3.41 -0.91 -4.96 113.62 104.33 3ngb n SER 203 Ca 0.07 -3.09 -0.22 0.00 -0.26 0.00 0.00 58.87 55.37 3ngb n SER 203 Cb 0.60 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 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 -1.31 -4.25 -4.68 4.04 3.02 -0.43 -4.93 115.26 106.71 3ngb n ASN 204 Ca 0.15 -0.30 -0.35 0.00 -0.03 0.00 0.00 54.58 54.04 3ngb n ASN 204 Cb 0.65 -3.50 -0.09 0.00 -0.61 0.00 0.00 39.78 36.23 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 -2.95 5.27 -0.05 3.41 2.01 -0.89 -5.01 115.64 117.43 3ngb s THR 205 Ca 0.33 0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.48 3ngb s THR 205 Cb -0.17 -3.42 0.02 0.00 0.01 0.00 0.00 72.50 68.94 3ngb s THR 205 CO 0.41 0.41 -0.04 -0.54 -0.69 0.00 0.00 174.62 174.17 3ngb s LYS 206 N 0.64 0.88 -0.06 4.92 3.01 -1.26 -0.31 119.74 127.55 3ngb s LYS 206 Ca 0.07 -0.10 -0.01 0.00 -1.01 0.00 0.00 55.97 54.92 3ngb s LYS 206 Cb -0.12 -0.93 0.03 0.00 -1.01 0.00 0.00 37.83 35.80 3ngb s LYS 206 CO 0.01 -0.12 -0.00 0.08 0.51 0.00 0.00 175.35 175.83 3ngb s VAL 207 N 1.10 0.37 -0.18 3.17 1.01 0.44 -5.00 120.40 121.30 3ngb s VAL 207 Ca -0.08 0.10 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 3ngb s VAL 207 Cb -0.14 -0.51 -0.05 0.00 0.00 0.00 0.00 36.38 35.69 3ngb s VAL 207 CO -0.01 0.25 0.15 -1.81 0.00 0.00 0.00 175.10 173.68 3ngb s ASP 208 N 1.78 6.26 -0.05 3.32 1.11 -1.26 -1.10 116.67 126.74 3ngb s ASP 208 Ca 0.02 0.29 0.01 0.00 0.18 0.00 0.00 52.55 53.06 3ngb s ASP 208 Cb -0.13 -2.10 0.02 0.00 1.07 0.00 0.00 42.92 41.79 3ngb s ASP 208 CO -0.04 0.20 -0.06 -0.75 1.18 0.00 0.00 175.17 175.70 3ngb s LYS 209 N 0.19 0.99 -0.20 8.23 2.47 -0.89 -4.97 119.74 125.55 3ngb s LYS 209 Ca 0.10 -0.16 -0.24 0.00 -1.56 0.00 0.00 55.97 54.10 3ngb s LYS 209 Cb -0.11 -0.93 -0.01 0.00 -1.46 0.00 0.00 37.83 35.31 3ngb s LYS 209 CO -0.01 -0.05 0.81 0.21 0.16 0.00 0.00 175.35 176.47 3ngb s LYS 210 N 0.84 4.24 -0.42 4.03 2.20 -1.26 -0.97 119.74 128.39 3ngb s LYS 210 Ca -0.12 0.94 -0.13 0.00 -0.36 0.00 0.00 55.97 56.30 3ngb s LYS 210 Cb -0.15 -3.61 0.05 0.00 -1.51 0.00 0.00 37.83 32.62 3ngb s LYS 210 CO 0.01 -0.40 0.28 0.00 -0.36 0.00 0.00 175.35 174.88 3ngb s ALA 211 N 2.43 3.39 0.17 3.13 0.00 -0.32 -4.95 121.76 125.61 3ngb s ALA 211 Ca 0.36 -1.91 0.07 0.00 0.00 0.00 0.00 51.96 50.47 3ngb s ALA 211 Cb -0.16 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 3ngb s ALA 211 CO 0.10 -1.55 -0.14 -1.83 0.00 0.00 0.00 175.76 172.34 3ngb s GLU 212 N 1.57 1.21 0.53 0.00 -1.05 -1.26 -4.43 118.70 115.28 3ngb s GLU 212 Ca 0.03 -1.47 -0.21 0.00 -0.15 0.00 0.00 54.97 53.17 3ngb s GLU 212 Cb -0.21 -1.00 -0.07 0.00 -0.44 0.00 0.00 34.13 32.41 3ngb s GLU 212 CO 0.06 0.17 1.08 -2.30 0.95 0.00 0.00 175.26 175.22 3ngb n PRO 213 N -0.09 1.25 -1.62 -4.83 -0.02 -1.26 -4.42 135.00 124.01 3ngb n PRO 213 Ca -0.10 0.46 -0.47 0.00 -2.02 0.00 0.00 63.50 61.37 3ngb n PRO 213 Cb 0.59 -2.24 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 3ngb n PRO 213 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3ngb n LYS 214 N -0.66 2.00 -2.08 -0.52 4.76 -0.15 -4.83 118.16 116.69 3ngb n LYS 214 Ca 0.11 0.67 -0.28 0.00 -2.87 0.00 0.00 58.31 55.95 3ngb n LYS 214 Cb 0.44 -2.78 -0.06 0.00 -1.84 0.00 0.00 35.03 30.79 3ngb n LYS 214 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3ngb s SER 215 N 5.68 5.11 0.00 4.39 1.04 -1.26 -4.75 113.70 123.91 3ngb s SER 215 Ca 0.97 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 56.01 3ngb s SER 215 Cb -0.62 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 62.92 3ngb s SER 215 CO 0.47 -2.93 0.02 0.00 0.98 0.00 0.00 173.24 171.77