#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ngb n ILE 2 N 0.00 0.00 -0.07 -3.67 5.41 -1.26 -5.07 119.36 114.70 3ngb n ILE 2 Ca 0.00 0.00 -0.05 0.00 1.00 0.00 0.00 62.75 63.70 3ngb n ILE 2 Cb 0.00 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 38.79 3ngb n ILE 2 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3ngb n VAL 3 N 0.00 1.00 -2.25 1.39 0.24 -1.26 -4.91 118.33 112.54 3ngb n VAL 3 Ca 0.00 -0.70 -0.42 0.00 -2.04 0.00 0.00 64.34 61.17 3ngb n VAL 3 Cb 0.00 -0.41 -0.03 0.00 -1.47 0.00 0.00 33.84 31.93 3ngb n VAL 3 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3ngb s LEU 4 N -5.13 4.27 -0.23 1.34 1.43 -1.26 -4.20 118.68 114.88 3ngb s LEU 4 Ca -0.09 1.98 0.02 0.00 -1.03 0.00 0.00 54.13 55.02 3ngb s LEU 4 Cb 0.07 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.79 3ngb s LEU 4 CO 0.75 -0.79 -0.14 -0.89 0.23 0.00 0.00 176.35 175.51 3ngb s THR 5 N 3.28 2.12 -0.10 5.49 2.01 -1.04 -4.72 115.64 122.68 3ngb s THR 5 Ca 0.63 -1.42 0.02 0.00 0.31 0.00 0.00 61.69 61.23 3ngb s THR 5 Cb -0.28 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 3ngb s THR 5 CO 0.23 0.14 -0.16 -1.58 -0.69 0.00 0.00 174.62 172.56 3ngb s GLN 6 N 1.16 3.11 0.05 4.92 0.74 -1.26 -1.18 119.66 127.19 3ngb s GLN 6 Ca -0.05 -0.73 -0.06 0.00 0.05 0.00 0.00 55.36 54.57 3ngb s GLN 6 Cb -0.18 -2.50 -0.01 0.00 1.10 0.00 0.00 33.01 31.42 3ngb s GLN 6 CO -0.07 0.30 0.11 -1.54 -0.55 0.00 0.00 175.29 173.53 3ngb s SER 7 N 0.10 0.18 1.00 6.67 1.04 -0.68 -4.67 113.70 117.34 3ngb s SER 7 Ca -0.07 -0.57 -0.12 0.00 0.48 0.00 0.00 55.95 55.67 3ngb s SER 7 Cb -0.15 0.25 0.16 0.00 0.10 0.00 0.00 66.02 66.38 3ngb s SER 7 CO 0.05 -0.55 0.94 -2.65 0.98 0.00 0.00 173.24 172.01 3ngb n PRO 8 N 0.58 -0.92 0.03 4.02 -0.02 -1.26 -1.47 135.00 135.96 3ngb n PRO 8 Ca -0.18 -1.47 -0.07 0.00 -2.02 0.00 0.00 63.50 59.76 3ngb n PRO 8 Cb 0.59 -0.97 -0.12 0.00 -0.02 0.00 0.00 33.50 32.98 3ngb n PRO 8 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3ngb h GLY 9 N -1.24 0.00 -4.84 -1.23 0.00 -1.83 -3.41 103.07 90.52 3ngb h GLY 9 Ca -0.31 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.84 3ngb h GLY 9 CO 0.22 0.00 -0.71 -1.59 0.00 0.00 0.00 176.54 174.46 3ngb s THR 10 N -2.68 0.20 -0.20 4.70 2.01 -1.26 -1.58 115.64 116.83 3ngb s THR 10 Ca -0.02 -0.99 -0.04 0.00 0.31 0.00 0.00 61.69 60.95 3ngb s THR 10 Cb 0.09 -0.39 0.08 0.00 0.01 0.00 0.00 72.50 72.28 3ngb s THR 10 CO 0.82 -0.50 0.14 -0.22 -0.69 0.00 0.00 174.62 174.17 3ngb s LEU 11 N -1.56 0.21 -0.73 4.42 2.96 0.29 -4.87 118.68 119.39 3ngb s LEU 11 Ca -0.14 -0.59 -0.17 0.00 -0.22 0.00 0.00 54.13 53.02 3ngb s LEU 11 Cb -0.09 -0.04 0.15 0.00 0.50 0.00 0.00 46.19 46.72 3ngb s LEU 11 CO -0.01 -0.36 0.77 -0.44 -1.32 0.00 0.00 176.35 174.99 3ngb s SER 12 N 2.20 6.47 0.19 3.68 0.01 -1.26 0.04 113.70 125.03 3ngb s SER 12 Ca 0.05 -2.06 0.11 0.00 1.31 0.00 0.00 55.95 55.35 3ngb s SER 12 Cb -0.16 -2.27 -0.04 0.00 0.21 0.00 0.00 66.02 63.76 3ngb s SER 12 CO -0.15 -0.87 -0.22 -0.76 0.41 0.00 0.00 173.24 171.65 3ngb s LEU 13 N 1.59 2.44 -0.09 2.44 1.43 -0.62 -4.79 118.68 121.09 3ngb s LEU 13 Ca 0.16 -0.87 -0.11 0.00 -1.03 0.00 0.00 54.13 52.28 3ngb s LEU 13 Cb -0.17 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.94 3ngb s LEU 13 CO -0.03 0.07 0.25 -0.44 0.23 0.00 0.00 176.35 176.43 3ngb s SER 14 N -2.71 6.53 -0.38 2.29 0.01 -1.26 -1.49 113.70 116.70 3ngb s SER 14 Ca 0.20 0.63 -0.37 0.00 1.31 0.00 0.00 55.95 57.72 3ngb s SER 14 Cb -0.07 -2.14 -0.13 0.00 0.21 0.00 0.00 66.02 63.88 3ngb s SER 14 CO 0.09 0.33 2.17 -2.65 0.41 0.00 0.00 173.24 173.60 3ngb n PRO 15 N 2.18 0.86 0.00 12.44 -0.02 -1.26 -1.07 135.00 148.13 3ngb n PRO 15 Ca -0.17 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3ngb n PRO 15 Cb 0.54 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 3ngb n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ngb n GLY 16 N 6.69 1.34 3.89 -1.23 0.00 -1.19 -4.92 105.19 109.78 3ngb n GLY 16 Ca 0.44 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.16 3ngb n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ngb s GLU 17 N 0.00 2.44 -0.23 1.61 2.02 -0.24 -4.61 118.70 119.70 3ngb s GLU 17 Ca 0.00 0.25 -0.11 0.00 0.02 0.00 0.00 54.97 55.13 3ngb s GLU 17 Cb 0.00 -2.01 -0.05 0.00 0.10 0.00 0.00 34.13 32.17 3ngb s GLU 17 CO 0.00 -1.27 0.18 0.95 0.02 0.00 0.00 175.26 175.14 3ngb s THR 18 N -3.43 5.35 -0.26 3.63 -4.23 -1.26 -2.96 115.64 112.48 3ngb s THR 18 Ca 0.60 0.24 -0.15 0.00 -1.18 0.00 0.00 61.69 61.19 3ngb s THR 18 Cb -0.11 -3.52 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 3ngb s THR 18 CO 0.50 0.36 0.40 0.00 -0.54 0.00 0.00 174.62 175.33 3ngb s ALA 19 N 0.93 3.57 -0.28 3.99 0.00 -0.25 -4.93 121.76 124.79 3ngb s ALA 19 Ca 0.09 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.33 3ngb s ALA 19 Cb -0.13 -2.73 0.07 0.00 0.00 0.00 0.00 23.12 20.33 3ngb s ALA 19 CO 0.04 -0.62 -0.06 0.42 0.00 0.00 0.00 175.76 175.54 3ngb s ILE 20 N 2.00 2.34 -0.04 0.00 1.01 -1.26 -0.68 121.20 124.57 3ngb s ILE 20 Ca 0.16 -1.74 0.05 0.00 0.00 0.00 0.00 60.65 59.12 3ngb s ILE 20 Cb -0.16 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 3ngb s ILE 20 CO 0.09 -0.16 -0.18 -0.51 0.00 0.00 0.00 174.94 174.19 3ngb s ILE 21 N 1.09 2.76 0.25 2.92 2.07 -0.62 -4.78 121.20 124.89 3ngb s ILE 21 Ca -0.04 -0.84 0.08 0.00 -1.41 0.00 0.00 60.65 58.44 3ngb s ILE 21 Cb -0.20 -2.05 -0.05 0.00 0.13 0.00 0.00 42.46 40.29 3ngb s ILE 21 CO -0.05 0.59 -0.12 -0.94 -1.91 0.00 0.00 174.94 172.51 3ngb s SER 22 N -0.68 2.91 -0.23 4.50 1.04 -0.54 -0.45 113.70 120.24 3ngb s SER 22 Ca 0.11 -1.09 -0.03 0.00 0.48 0.00 0.00 55.95 55.41 3ngb s SER 22 Cb -0.11 -0.19 0.12 0.00 0.10 0.00 0.00 66.02 65.94 3ngb s SER 22 CO 0.00 -0.19 0.36 0.00 0.98 0.00 0.00 173.24 174.38 3ngb s ARG 24 N 2.52 4.03 -0.11 0.00 3.52 -0.32 -1.56 118.95 127.02 3ngb s ARG 24 Ca 0.10 -0.06 -0.02 0.00 -0.13 0.00 0.00 55.73 55.62 3ngb s ARG 24 Cb -0.15 -3.63 -0.03 0.00 -1.56 0.00 0.00 34.95 29.58 3ngb s ARG 24 CO -0.15 -0.18 -0.03 -0.08 -0.81 0.00 0.00 175.30 174.05 3ngb s THR 25 N 1.76 3.97 -0.53 4.11 -1.32 0.07 -2.49 115.64 121.22 3ngb s THR 25 Ca 0.13 -0.36 0.01 0.00 -1.21 0.00 0.00 61.69 60.26 3ngb s THR 25 Cb -0.15 -2.68 0.45 0.00 -1.51 0.00 0.00 72.50 68.60 3ngb s THR 25 CO 0.09 0.56 1.71 -1.20 -2.21 0.00 0.00 174.62 173.57 3ngb n SER 26 N 2.73 6.64 -3.46 8.08 7.64 -1.26 -4.60 113.62 129.39 3ngb n SER 26 Ca -0.18 -3.78 -0.12 0.00 1.01 0.00 0.00 58.87 55.80 3ngb n SER 26 Cb 0.53 -0.74 -0.03 0.00 -1.01 0.00 0.00 64.21 62.96 3ngb n SER 26 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3ngb s GLN 27 N -3.75 1.23 0.06 1.43 2.00 -1.26 -5.10 119.66 114.26 3ngb s GLN 27 Ca 0.59 -0.43 -0.30 0.00 -2.00 0.00 0.00 55.36 53.22 3ngb s GLN 27 Cb 0.47 0.56 -0.05 0.00 0.80 0.00 0.00 33.01 34.79 3ngb s GLN 27 CO -0.00 -0.52 1.11 -0.47 -0.50 0.00 0.00 175.29 174.91 3ngb s TYR 28 N -3.49 3.54 0.00 1.67 5.04 -1.26 -4.97 117.35 117.88 3ngb s TYR 28 Ca -0.00 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.11 3ngb s TYR 28 Cb -0.01 -3.30 0.00 0.00 0.35 0.00 0.00 41.96 39.01 3ngb s TYR 28 CO -0.10 -0.76 0.00 0.41 -1.34 0.00 0.00 175.55 173.76 3ngb n GLY 29 N 2.95 4.14 3.76 8.97 0.00 -1.26 -5.02 105.19 118.72 3ngb n GLY 29 Ca 0.07 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 3ngb n GLY 29 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ngb s SER 30 N 0.00 6.48 -0.12 1.61 0.01 -1.26 -4.96 113.70 115.47 3ngb s SER 30 Ca 0.00 2.87 -0.03 0.00 1.31 0.00 0.00 55.95 60.10 3ngb s SER 30 Cb 0.00 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.56 3ngb s SER 30 CO 0.00 -0.81 -0.01 -0.22 0.41 0.00 0.00 173.24 172.61 3ngb s LEU 33 N -0.96 3.47 0.24 2.44 0.20 -1.26 -4.19 118.68 118.62 3ngb s LEU 33 Ca 0.58 0.04 0.08 0.00 0.69 0.00 0.00 54.13 55.52 3ngb s LEU 33 Cb -0.45 -1.81 -0.05 0.00 -0.43 0.00 0.00 46.19 43.45 3ngb s LEU 33 CO 0.51 0.29 -0.14 0.00 -0.29 0.00 0.00 176.35 176.72 3ngb s ALA 34 N -0.34 2.23 -0.02 5.97 0.00 0.48 -0.88 121.76 129.20 3ngb s ALA 34 Ca 0.07 -1.76 0.07 0.00 0.00 0.00 0.00 51.96 50.34 3ngb s ALA 34 Cb -0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 3ngb s ALA 34 CO 0.02 0.08 -0.24 -1.58 0.00 0.00 0.00 175.76 174.04 3ngb s TRP 35 N -2.89 2.11 0.06 0.00 0.52 0.51 -0.10 118.94 119.15 3ngb s TRP 35 Ca 0.25 -0.40 0.08 0.00 0.02 0.00 0.00 56.10 56.05 3ngb s TRP 35 Cb -0.01 -1.36 -0.03 0.00 -1.15 0.00 0.00 33.47 30.93 3ngb s TRP 35 CO 0.09 -0.03 -0.21 0.71 0.02 0.00 0.00 176.95 177.53 3ngb s TYR 36 N -0.56 1.84 -0.15 -1.98 1.51 0.38 -0.94 117.35 117.45 3ngb s TYR 36 Ca 0.09 -0.38 -0.01 0.00 -1.01 0.00 0.00 57.07 55.76 3ngb s TYR 36 Cb -0.09 -1.08 -0.01 0.00 -0.11 0.00 0.00 41.96 40.67 3ngb s TYR 36 CO -0.01 0.12 -0.12 -1.14 -1.11 0.00 0.00 175.55 173.28 3ngb s GLN 37 N -1.33 3.33 -0.27 -0.62 0.74 0.55 -1.65 119.66 120.40 3ngb s GLN 37 Ca 0.08 -0.70 0.03 0.00 0.05 0.00 0.00 55.36 54.82 3ngb s GLN 37 Cb -0.09 -2.69 0.07 0.00 1.10 0.00 0.00 33.01 31.40 3ngb s GLN 37 CO 0.02 0.08 -0.08 -1.14 -0.55 0.00 0.00 175.29 173.62 3ngb s GLN 38 N 0.69 2.04 0.50 1.67 0.74 -0.33 -0.59 119.66 124.38 3ngb s GLN 38 Ca -0.06 -1.38 -0.14 0.00 0.05 0.00 0.00 55.36 53.83 3ngb s GLN 38 Cb -0.15 -2.89 -0.07 0.00 1.10 0.00 0.00 33.01 31.00 3ngb s GLN 38 CO 0.02 -0.63 0.93 1.03 -0.55 0.00 0.00 175.29 176.09 3ngb s ARG 39 N 1.11 3.83 -0.33 1.67 0.52 -1.26 -1.96 118.95 122.54 3ngb s ARG 39 Ca -0.05 0.77 -0.35 0.00 -0.52 0.00 0.00 55.73 55.57 3ngb s ARG 39 Cb -0.20 -2.20 -0.11 0.00 0.52 0.00 0.00 34.95 32.96 3ngb s ARG 39 CO -0.06 -0.26 2.16 -2.30 0.02 0.00 0.00 175.30 174.86 3ngb n PRO 40 N -1.73 1.13 0.00 3.54 -0.02 -1.26 -2.22 135.00 134.43 3ngb n PRO 40 Ca 0.05 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3ngb n PRO 40 Cb 0.54 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 3ngb n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ngb n GLY 41 N 6.37 3.06 3.73 -1.23 0.00 -1.26 -5.04 105.19 110.81 3ngb n GLY 41 Ca 0.40 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 3ngb n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ngb s GLN 42 N 0.00 -0.53 0.36 1.61 -0.21 -0.94 -5.05 119.66 114.89 3ngb s GLN 42 Ca 0.00 -0.23 -0.10 0.00 0.02 0.00 0.00 55.36 55.05 3ngb s GLN 42 Cb 0.00 -1.69 -0.06 0.00 1.00 0.00 0.00 33.01 32.25 3ngb s GLN 42 CO 0.00 -3.22 0.70 0.00 -2.12 0.00 0.00 175.29 170.65 3ngb s ALA 43 N -3.38 3.42 0.88 6.09 0.00 -1.26 -4.69 121.76 122.83 3ngb s ALA 43 Ca 0.73 -0.26 -0.14 0.00 0.00 0.00 0.00 51.96 52.29 3ngb s ALA 43 Cb -0.07 -2.60 0.02 0.00 0.00 0.00 0.00 23.12 20.47 3ngb s ALA 43 CO 0.55 0.13 0.49 -2.30 0.00 0.00 0.00 175.76 174.63 3ngb n PRO 44 N -1.01 -0.10 -4.05 0.00 -0.02 -1.26 -4.68 135.00 123.86 3ngb n PRO 44 Ca 0.01 0.02 -0.17 0.00 -2.02 0.00 0.00 63.50 61.34 3ngb n PRO 44 Cb 0.54 -1.89 -0.15 0.00 -0.02 0.00 0.00 33.50 31.98 3ngb n PRO 44 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3ngb s ARG 45 N -3.44 0.43 -0.16 -0.52 3.52 0.25 -4.92 118.95 114.10 3ngb s ARG 45 Ca 0.60 -0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.85 3ngb s ARG 45 Cb -0.25 -0.49 -0.01 0.00 -1.56 0.00 0.00 34.95 32.63 3ngb s ARG 45 CO 0.64 -0.03 1.27 -1.17 -0.81 0.00 0.00 175.30 175.20 3ngb s LEU 46 N 0.52 4.18 -0.20 -0.88 2.96 -1.26 -0.33 118.68 123.68 3ngb s LEU 46 Ca -0.06 1.70 -0.13 0.00 -0.22 0.00 0.00 54.13 55.43 3ngb s LEU 46 Cb -0.09 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 42.98 3ngb s LEU 46 CO -0.01 -0.77 -0.29 0.52 -1.32 0.00 0.00 176.35 174.48 3ngb n VAL 47 N 5.38 1.33 -4.37 1.68 0.31 -0.11 -4.73 118.33 117.82 3ngb n VAL 47 Ca 0.14 -0.14 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 3ngb n VAL 47 Cb 0.45 -1.96 -0.15 0.00 -0.91 0.00 0.00 33.84 31.27 3ngb n VAL 47 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3ngb s ILE 48 N -2.54 0.74 0.07 2.52 -1.09 -1.17 -2.07 121.20 117.67 3ngb s ILE 48 Ca -0.29 -0.45 0.04 0.00 -2.23 0.00 0.00 60.65 57.71 3ngb s ILE 48 Cb 0.09 -0.63 -0.03 0.00 -1.58 0.00 0.00 42.46 40.31 3ngb s ILE 48 CO 0.39 0.18 -0.10 -0.72 -1.23 0.00 0.00 174.94 173.45 3ngb s TYR 49 N -0.29 0.97 -1.78 3.97 1.13 -0.27 -0.36 117.35 120.72 3ngb s TYR 49 Ca 0.03 -0.55 0.00 0.00 -1.41 0.00 0.00 57.07 55.14 3ngb s TYR 49 Cb -0.04 -0.55 0.00 0.00 -1.10 0.00 0.00 41.96 40.27 3ngb s TYR 49 CO -0.00 -0.01 0.00 0.45 -2.51 0.00 0.00 175.55 173.47 3ngb n SER 50 N 1.07 -5.12 0.00 -0.18 2.88 -1.11 -2.31 113.62 108.85 3ngb n SER 50 Ca -0.20 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 3ngb n SER 50 Cb 0.56 -4.18 0.00 0.00 -0.75 0.00 0.00 64.21 59.84 3ngb n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ngb n GLY 51 N -0.87 2.60 0.00 0.46 0.00 -0.06 -4.54 105.19 102.78 3ngb n GLY 51 Ca -0.18 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.16 3ngb n GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ngb n SER 52 N 2.41 0.45 -4.64 1.61 3.41 -1.25 -3.97 113.62 111.64 3ngb n SER 52 Ca 0.00 -1.19 -0.41 0.00 -0.26 0.00 0.00 58.87 57.01 3ngb n SER 52 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 3ngb n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3ngb s THR 53 N -0.19 4.90 0.33 6.66 2.01 -0.98 -4.52 115.64 123.84 3ngb s THR 53 Ca 0.00 1.42 -0.27 0.00 0.31 0.00 0.00 61.69 63.15 3ngb s THR 53 Cb 0.00 -4.05 -0.09 0.00 0.01 0.00 0.00 72.50 68.36 3ngb s THR 53 CO 0.00 -0.02 1.05 -0.60 -0.69 0.00 0.00 174.62 174.35 3ngb s ARG 54 N 2.63 4.48 0.77 4.92 3.52 -1.26 -1.11 118.95 132.90 3ngb s ARG 54 Ca 0.32 1.61 -0.05 0.00 -0.13 0.00 0.00 55.73 57.48 3ngb s ARG 54 Cb -0.15 -2.91 0.13 0.00 -1.56 0.00 0.00 34.95 30.46 3ngb s ARG 54 CO 0.08 0.12 1.07 0.00 -0.81 0.00 0.00 175.30 175.75 3ngb s ALA 55 N -1.40 3.31 0.18 6.12 0.00 -0.88 -4.90 121.76 124.20 3ngb s ALA 55 Ca 0.50 -1.52 -0.30 0.00 0.00 0.00 0.00 51.96 50.64 3ngb s ALA 55 Cb -0.26 -2.24 -0.08 0.00 0.00 0.00 0.00 23.12 20.53 3ngb s ALA 55 CO 0.33 -1.65 1.27 0.00 0.00 0.00 0.00 175.76 175.71 3ngb s ALA 56 N -3.31 3.49 0.00 0.00 0.00 -1.26 -2.63 121.76 118.05 3ngb s ALA 56 Ca 0.67 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.67 3ngb s ALA 56 Cb -0.06 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3ngb s ALA 56 CO 0.46 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.15 3ngb n GLY 57 N 2.40 1.77 3.62 0.00 0.00 -1.26 -5.00 105.19 106.71 3ngb n GLY 57 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3ngb n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ngb s ILE 58 N -3.39 4.79 0.63 -0.61 -1.09 -1.08 -5.03 121.20 115.42 3ngb s ILE 58 Ca 0.00 1.21 -0.18 0.00 -2.23 0.00 0.00 60.65 59.45 3ngb s ILE 58 Cb 0.00 -4.15 -0.02 0.00 -1.58 0.00 0.00 42.46 36.71 3ngb s ILE 58 CO 0.00 -0.24 1.21 -2.65 -1.23 0.00 0.00 174.94 172.02 3ngb n PRO 59 N 6.20 1.09 0.00 2.79 -0.02 -1.26 -4.80 135.00 139.00 3ngb n PRO 59 Ca 0.04 0.42 0.05 0.00 -2.02 0.00 0.00 63.50 61.99 3ngb n PRO 59 Cb 0.48 -2.43 0.31 0.00 -0.02 0.00 0.00 33.50 31.84 3ngb n PRO 59 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3ngb n ASP 60 N -1.54 0.00 0.16 2.55 5.68 -1.26 -2.45 116.55 119.70 3ngb n ASP 60 Ca 0.15 -0.71 0.03 0.00 -0.50 0.00 0.00 54.79 53.76 3ngb n ASP 60 Cb 0.48 0.00 0.25 0.00 -1.14 0.00 0.00 41.12 40.70 3ngb n ASP 60 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 3ngb h ARG 61 N 0.00 0.00 -6.55 0.11 3.08 -1.95 -3.42 114.38 105.65 3ngb h ARG 61 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 3ngb h ARG 61 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3ngb h ARG 61 CO 0.00 0.48 0.20 -0.06 -1.07 0.00 0.00 179.97 179.52 3ngb s PHE 62 N -3.51 3.92 -0.18 3.04 0.40 -1.03 -2.22 117.98 118.40 3ngb s PHE 62 Ca 0.00 1.67 -0.13 0.00 -0.60 0.00 0.00 56.93 57.87 3ngb s PHE 62 Cb 0.11 -2.79 0.05 0.00 0.51 0.00 0.00 43.02 40.90 3ngb s PHE 62 CO 0.72 0.51 0.45 -1.54 0.70 0.00 0.00 175.22 176.06 3ngb s SER 63 N -1.14 -0.53 0.08 1.36 1.04 -0.95 -4.98 113.70 108.58 3ngb s SER 63 Ca 0.36 0.95 0.03 0.00 0.48 0.00 0.00 55.95 57.78 3ngb s SER 63 Cb -0.23 0.89 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 3ngb s SER 63 CO 0.27 -0.18 0.08 -0.83 0.98 0.00 0.00 173.24 173.56 3ngb s GLY 64 N 0.89 2.00 0.02 7.32 0.00 -1.26 -1.40 107.32 114.89 3ngb s GLY 64 Ca -0.05 -1.03 -0.02 0.00 0.00 0.00 0.00 44.72 43.62 3ngb s GLY 64 CO -0.07 -1.01 0.01 -1.35 0.00 0.00 0.00 173.10 170.68 3ngb s SER 65 N -2.43 0.22 -0.04 1.64 1.04 -0.14 -4.44 113.70 109.54 3ngb s SER 65 Ca 0.29 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.28 3ngb s SER 65 Cb -0.12 0.13 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 3ngb s SER 65 CO 0.22 -0.35 -0.18 -0.60 0.98 0.00 0.00 173.24 173.31 3ngb s ARG 66 N -1.71 1.84 -0.43 4.02 3.52 -1.26 -1.10 118.95 123.83 3ngb s ARG 66 Ca -0.13 -0.63 0.08 0.00 -0.13 0.00 0.00 55.73 54.91 3ngb s ARG 66 Cb -0.08 -1.60 0.26 0.00 -1.56 0.00 0.00 34.95 31.98 3ngb s ARG 66 CO -0.01 0.26 0.59 1.87 -0.81 0.00 0.00 175.30 177.19 3ngb n TRP 67 N 3.12 0.46 0.00 5.12 -0.00 0.00 -5.03 117.44 121.12 3ngb n TRP 67 Ca -0.18 -3.70 0.00 0.00 -0.00 0.00 0.00 57.50 53.62 3ngb n TRP 67 Cb 0.53 -0.40 0.00 0.00 -0.00 0.00 0.00 31.31 31.44 3ngb n TRP 67 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3ngb n GLY 68 N 1.17 1.99 0.20 5.87 0.00 -1.26 -3.31 105.19 109.85 3ngb n GLY 68 Ca 0.23 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.92 3ngb n GLY 68 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ngb h PRO 69 N 0.00 0.00 -5.80 1.61 0.11 -1.97 -3.46 132.00 122.49 3ngb h PRO 69 Ca 0.00 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.53 3ngb h PRO 69 Cb 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.04 3ngb h PRO 69 CO 0.00 0.10 -0.12 -0.51 -0.21 0.00 0.00 178.00 177.27 3ngb s ASP 70 N -6.23 6.73 0.09 -2.05 1.01 -1.21 -0.75 116.67 114.26 3ngb s ASP 70 Ca 0.06 0.87 0.10 0.00 0.71 0.00 0.00 52.55 54.29 3ngb s ASP 70 Cb 0.06 -2.30 -0.04 0.00 1.01 0.00 0.00 42.92 41.65 3ngb s ASP 70 CO 0.69 0.01 -0.24 -0.31 0.21 0.00 0.00 175.17 175.53 3ngb s TYR 71 N 0.50 2.38 -0.10 4.23 1.51 -0.60 -0.82 117.35 124.45 3ngb s TYR 71 Ca 0.27 -0.35 0.01 0.00 -1.01 0.00 0.00 57.07 55.99 3ngb s TYR 71 Cb -0.16 -1.34 0.02 0.00 -0.11 0.00 0.00 41.96 40.37 3ngb s TYR 71 CO 0.11 0.26 -0.13 -0.80 -1.11 0.00 0.00 175.55 173.89 3ngb s ASN 72 N -1.70 2.20 -0.33 2.29 0.01 -0.26 -1.16 114.94 115.99 3ngb s ASN 72 Ca 0.14 -0.36 -0.08 0.00 -0.71 0.00 0.00 52.86 51.84 3ngb s ASN 72 Cb -0.10 -0.96 0.02 0.00 0.41 0.00 0.00 41.25 40.61 3ngb s ASN 72 CO 0.05 -0.01 0.13 -0.22 -1.51 0.00 0.00 177.10 175.54 3ngb s LEU 73 N 1.07 4.21 -0.17 0.60 2.96 0.40 -0.96 118.68 126.80 3ngb s LEU 73 Ca -0.06 -0.82 0.01 0.00 -0.22 0.00 0.00 54.13 53.04 3ngb s LEU 73 Cb -0.15 -1.94 0.03 0.00 0.50 0.00 0.00 46.19 44.63 3ngb s LEU 73 CO -0.02 -0.27 -0.15 0.28 -1.32 0.00 0.00 176.35 174.88 3ngb s THR 74 N 1.52 1.70 0.04 3.68 -1.32 -0.49 -1.59 115.64 119.18 3ngb s THR 74 Ca 0.02 -0.80 -0.19 0.00 -1.21 0.00 0.00 61.69 59.51 3ngb s THR 74 Cb -0.18 -1.62 -0.06 0.00 -1.51 0.00 0.00 72.50 69.12 3ngb s THR 74 CO 0.04 0.41 0.56 -0.63 -2.21 0.00 0.00 174.62 172.79 3ngb s ILE 75 N 1.42 4.81 -1.53 5.08 1.09 0.14 -2.23 121.20 129.99 3ngb s ILE 75 Ca 0.03 1.19 0.16 0.00 -1.10 0.00 0.00 60.65 60.94 3ngb s ILE 75 Cb -0.14 -3.89 0.01 0.00 -1.06 0.00 0.00 42.46 37.38 3ngb s ILE 75 CO -0.11 0.51 0.87 -1.20 -0.10 0.00 0.00 174.94 174.92 3ngb n SER 76 N 2.04 1.70 -2.74 3.58 7.64 -0.94 -1.09 113.62 123.81 3ngb n SER 76 Ca -0.10 -1.35 -0.06 0.00 1.01 0.00 0.00 58.87 58.37 3ngb n SER 76 Cb 0.51 0.43 0.04 0.00 -1.01 0.00 0.00 64.21 64.18 3ngb n SER 76 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3ngb n ASN 77 N -0.03 -2.78 -4.46 6.43 5.15 -1.26 -4.59 115.26 113.72 3ngb n ASN 77 Ca 0.07 -2.90 -0.46 0.00 -0.60 0.00 0.00 54.58 50.69 3ngb n ASN 77 Cb 0.35 1.62 -0.02 0.00 -0.53 0.00 0.00 39.78 41.20 3ngb n ASN 77 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3ngb n LEU 78 N 2.02 -0.24 -4.33 1.20 4.32 -1.16 -4.71 117.00 114.10 3ngb n LEU 78 Ca 0.11 1.12 -0.17 0.00 -0.02 0.00 0.00 56.01 57.05 3ngb n LEU 78 Cb 0.62 -1.07 -0.10 0.00 -1.62 0.00 0.00 43.42 41.25 3ngb n LEU 78 CO -0.00 -2.50 -0.25 -1.61 -1.22 0.00 0.00 177.39 171.81 3ngb s GLU 79 N -1.21 1.45 0.29 3.23 2.02 -1.26 -3.15 118.70 120.08 3ngb s GLU 79 Ca 0.62 -1.80 0.04 0.00 0.02 0.00 0.00 54.97 53.85 3ngb s GLU 79 Cb -0.83 -0.27 0.76 0.00 0.10 0.00 0.00 34.13 33.89 3ngb s GLU 79 CO 0.58 -0.32 1.66 0.77 0.02 0.00 0.00 175.26 177.97 3ngb h SER 80 N 2.34 0.12 -0.52 -0.19 0.02 -1.99 0.16 113.55 113.49 3ngb h SER 80 Ca -0.38 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 3ngb h SER 80 Cb 1.25 0.23 0.00 0.00 0.14 0.00 0.00 62.40 64.02 3ngb h SER 80 CO 0.60 -0.13 0.00 0.61 -1.14 0.00 0.00 176.83 176.77 3ngb n GLY 81 N -1.36 1.46 0.05 -3.77 0.00 -1.26 -3.93 105.19 96.37 3ngb n GLY 81 Ca 0.23 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.78 3ngb n GLY 81 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ngb n ASP 82 N 1.05 0.52 -4.76 1.61 9.92 0.56 -4.92 116.55 120.53 3ngb n ASP 82 Ca 0.18 -0.06 -0.39 0.00 -0.53 0.00 0.00 54.79 53.99 3ngb n ASP 82 Cb 0.45 1.04 -0.06 0.00 -0.64 0.00 0.00 41.12 41.90 3ngb n ASP 82 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 3ngb s PHE 83 N -3.32 3.94 -4.24 1.24 0.08 -1.22 -4.91 117.98 109.54 3ngb s PHE 83 Ca -0.00 1.88 0.00 0.00 0.12 0.00 0.00 56.93 58.93 3ngb s PHE 83 Cb 0.13 -2.96 0.00 0.00 -0.57 0.00 0.00 43.02 39.62 3ngb s PHE 83 CO 0.83 0.42 0.00 0.41 -0.10 0.00 0.00 175.22 176.78 3ngb n GLY 84 N 1.34 -0.50 3.42 4.36 0.00 -0.97 -4.74 105.19 108.09 3ngb n GLY 84 Ca -0.01 -1.01 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 3ngb n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ngb s VAL 85 N -3.09 3.61 -0.12 1.61 0.11 -0.83 -1.05 120.40 120.64 3ngb s VAL 85 Ca 0.00 -0.44 -0.04 0.00 -2.93 0.00 0.00 61.98 58.57 3ngb s VAL 85 Cb 0.00 -2.59 -0.03 0.00 -1.53 0.00 0.00 36.38 32.23 3ngb s VAL 85 CO 0.00 0.47 0.01 -0.31 -3.33 0.00 0.00 175.10 171.95 3ngb s TYR 86 N 0.70 3.17 0.01 1.54 1.51 0.41 -1.19 117.35 123.51 3ngb s TYR 86 Ca -0.03 0.08 0.09 0.00 -1.01 0.00 0.00 57.07 56.20 3ngb s TYR 86 Cb -0.15 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 3ngb s TYR 86 CO 0.02 0.31 -0.26 0.71 -1.11 0.00 0.00 175.55 175.22 3ngb s TYR 87 N -0.35 2.33 0.12 2.71 2.02 -0.66 -0.66 117.35 122.85 3ngb s TYR 87 Ca 0.07 -0.43 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 3ngb s TYR 87 Cb -0.12 -1.45 -0.04 0.00 -0.40 0.00 0.00 41.96 39.95 3ngb s TYR 87 CO 0.02 0.04 0.27 0.00 -1.57 0.00 0.00 175.55 174.31 3ngb s GLN 89 N -2.93 0.13 -0.16 0.00 0.74 0.86 -0.35 119.66 117.96 3ngb s GLN 89 Ca 0.35 0.26 -0.02 0.00 0.05 0.00 0.00 55.36 56.01 3ngb s GLN 89 Cb -0.12 -0.02 0.05 0.00 1.10 0.00 0.00 33.01 34.02 3ngb s GLN 89 CO 0.28 -0.08 0.01 -1.14 -0.55 0.00 0.00 175.29 173.81 3ngb s GLN 90 N 0.50 0.84 6.59 1.67 0.74 -0.50 -0.39 119.66 129.10 3ngb s GLN 90 Ca -0.04 -0.32 0.00 0.00 0.05 0.00 0.00 55.36 55.06 3ngb s GLN 90 Cb -0.05 -1.81 0.00 0.00 1.10 0.00 0.00 33.01 32.25 3ngb s GLN 90 CO -0.02 -0.51 0.00 0.66 -0.55 0.00 0.00 175.29 174.87 3ngb n TYR 91 N 5.03 0.00 1.29 1.67 0.53 -1.26 -2.01 117.16 122.40 3ngb n TYR 91 Ca -0.09 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 56.92 3ngb n TYR 91 Cb 0.48 0.00 0.38 0.00 -1.03 0.00 0.00 39.34 39.17 3ngb n TYR 91 CO 0.00 0.00 0.00 -0.85 -1.02 0.00 0.00 176.86 174.99 3ngb n GLU 96 N 14.00 1.21 -4.10 -0.72 0.00 -1.26 -4.90 120.64 124.87 3ngb n GLU 96 Ca 0.00 -0.76 -0.35 0.00 0.00 0.00 0.00 57.16 56.05 3ngb n GLU 96 Cb 0.00 -1.48 -0.07 0.00 0.00 0.00 0.00 31.44 29.88 3ngb n GLU 96 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 3ngb s PHE 97 N -2.32 3.37 0.37 -1.84 0.40 -0.85 -5.11 117.98 112.00 3ngb s PHE 97 Ca 0.28 0.32 0.08 0.00 -0.60 0.00 0.00 56.93 57.02 3ngb s PHE 97 Cb 0.20 -1.83 -0.06 0.00 0.51 0.00 0.00 43.02 41.84 3ngb s PHE 97 CO 0.46 0.60 0.05 -0.06 0.70 0.00 0.00 175.22 176.96 3ngb s PHE 98 N -1.05 2.55 0.63 0.36 0.40 -1.26 -1.42 117.98 118.19 3ngb s PHE 98 Ca 0.17 -0.52 -0.03 0.00 -0.60 0.00 0.00 56.93 55.95 3ngb s PHE 98 Cb -0.12 -1.65 0.05 0.00 0.51 0.00 0.00 43.02 41.81 3ngb s PHE 98 CO 0.07 0.41 0.90 0.20 0.70 0.00 0.00 175.22 177.50 3ngb s GLY 99 N -3.75 1.75 0.28 4.36 0.00 0.53 -4.81 107.32 105.67 3ngb s GLY 99 Ca 0.36 -1.11 0.24 0.00 0.00 0.00 0.00 44.72 44.22 3ngb s GLY 99 CO 0.20 -0.76 1.73 0.06 0.00 0.00 0.00 173.10 174.33 3ngb h GLN 100 N -0.28 0.00 0.00 2.90 -0.00 -1.87 -3.44 115.11 112.42 3ngb h GLN 100 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 3ngb h GLN 100 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.79 3ngb h GLN 100 CO 0.57 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.81 3ngb n GLY 101 N 0.04 1.22 2.75 0.06 0.00 -1.26 -5.05 105.19 102.95 3ngb n GLY 101 Ca 0.02 -1.80 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 3ngb n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ngb s THR 102 N -2.97 0.06 -0.56 2.61 2.01 0.16 -4.61 115.64 112.34 3ngb s THR 102 Ca 0.00 0.24 -0.16 0.00 0.31 0.00 0.00 61.69 62.08 3ngb s THR 102 Cb 0.00 -0.23 0.14 0.00 0.01 0.00 0.00 72.50 72.41 3ngb s THR 102 CO 0.00 0.16 0.52 -0.75 -0.69 0.00 0.00 174.62 173.86 3ngb s LYS 103 N 1.58 3.04 -0.09 4.92 2.20 -0.62 -0.45 119.74 130.31 3ngb s LYS 103 Ca -0.02 -1.77 -0.28 0.00 -0.36 0.00 0.00 55.97 53.54 3ngb s LYS 103 Cb -0.13 -4.31 -0.02 0.00 -1.51 0.00 0.00 37.83 31.87 3ngb s LYS 103 CO -0.03 -1.33 0.93 0.14 -0.36 0.00 0.00 175.35 174.70 3ngb s VAL 104 N 1.49 4.85 0.05 4.02 -7.23 -0.22 -0.55 120.40 122.81 3ngb s VAL 104 Ca 0.04 1.89 0.02 0.00 -1.81 0.00 0.00 61.98 62.12 3ngb s VAL 104 Cb -0.28 -4.25 -0.03 0.00 0.56 0.00 0.00 36.38 32.38 3ngb s VAL 104 CO 0.02 0.07 -0.08 0.00 -0.31 0.00 0.00 175.10 174.80 3ngb s GLN 105 N 1.71 0.58 0.47 4.82 -2.07 0.11 -2.30 119.66 122.98 3ngb s GLN 105 Ca 0.46 -0.85 -0.24 0.00 -1.82 0.00 0.00 55.36 52.90 3ngb s GLN 105 Cb -0.18 -0.27 -0.08 0.00 -1.09 0.00 0.00 33.01 31.39 3ngb s GLN 105 CO 0.19 0.04 1.40 1.33 -1.32 0.00 0.00 175.29 176.92 3ngb n VAL 106 N 1.21 3.03 -3.50 3.63 0.24 -1.26 -1.59 118.33 120.10 3ngb n VAL 106 Ca -0.21 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.30 3ngb n VAL 106 Cb 0.56 -1.77 -0.13 0.00 -1.47 0.00 0.00 33.84 31.02 3ngb n VAL 106 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3ngb s ASP 107 N -0.58 3.21 0.10 -1.34 3.68 -0.55 -4.71 116.67 116.47 3ngb s ASP 107 Ca 0.64 -1.66 -0.31 0.00 2.13 0.00 0.00 52.55 53.35 3ngb s ASP 107 Cb -0.45 -0.33 -0.10 0.00 -1.45 0.00 0.00 42.92 40.59 3ngb s ASP 107 CO 0.55 -0.38 1.89 -0.38 0.13 0.00 0.00 175.17 176.99 3ngb n ILE 108 N 4.73 0.52 -2.58 4.11 5.41 -1.26 -4.15 119.36 126.14 3ngb n ILE 108 Ca 0.02 -0.09 -0.40 0.00 1.00 0.00 0.00 62.75 63.28 3ngb n ILE 108 Cb 0.40 -2.21 -0.05 0.00 -0.71 0.00 0.00 39.64 37.07 3ngb n ILE 108 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3ngb s LYS 109 N 3.37 4.65 0.24 0.38 1.02 -1.26 -5.02 119.74 123.11 3ngb s LYS 109 Ca 0.84 1.66 -0.02 0.00 0.02 0.00 0.00 55.97 58.47 3ngb s LYS 109 Cb -0.46 -3.12 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 3ngb s LYS 109 CO 0.39 0.26 0.35 2.89 -0.92 0.00 0.00 175.35 178.32 3ngb n ARG 110 N 1.10 0.51 -2.18 1.68 1.85 -1.26 -5.13 116.66 113.22 3ngb n ARG 110 Ca -0.01 -1.82 -0.41 0.00 -1.00 0.00 0.00 57.85 54.61 3ngb n ARG 110 Cb 0.46 1.80 -0.03 0.00 -1.05 0.00 0.00 32.46 33.65 3ngb n ARG 110 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3ngb s THR 111 N -2.65 3.13 -0.18 8.89 -4.23 -1.26 -4.91 115.64 114.42 3ngb s THR 111 Ca 0.18 0.93 -0.36 0.00 -1.18 0.00 0.00 61.69 61.26 3ngb s THR 111 Cb -0.01 -3.59 -0.13 0.00 1.34 0.00 0.00 72.50 70.11 3ngb s THR 111 CO 0.13 0.14 1.88 0.52 -0.54 0.00 0.00 174.62 176.75 3ngb n VAL 112 N 2.62 0.45 -3.28 2.29 0.31 -1.26 -4.88 118.33 114.58 3ngb n VAL 112 Ca 0.06 -0.11 -0.19 0.00 -0.01 0.00 0.00 64.34 64.09 3ngb n VAL 112 Cb 0.42 -1.65 -0.00 0.00 -0.91 0.00 0.00 33.84 31.70 3ngb n VAL 112 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ngb s ALA 113 N 4.35 4.35 -0.08 3.52 0.00 -0.84 -4.91 121.76 128.15 3ngb s ALA 113 Ca 0.97 -1.79 0.03 0.00 0.00 0.00 0.00 51.96 51.17 3ngb s ALA 113 Cb -0.83 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 3ngb s ALA 113 CO 0.56 -0.31 -0.17 0.00 0.00 0.00 0.00 175.76 175.84 3ngb s ALA 114 N -2.45 2.51 -0.77 0.00 0.00 -1.26 -3.86 121.76 115.93 3ngb s ALA 114 Ca 0.52 -0.96 -0.27 0.00 0.00 0.00 0.00 51.96 51.25 3ngb s ALA 114 Cb -0.06 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.10 3ngb s ALA 114 CO 0.31 0.39 1.32 -2.14 0.00 0.00 0.00 175.76 175.64 3ngb s PRO 115 N -0.13 3.22 -0.44 0.00 0.02 -1.25 -4.47 135.00 131.95 3ngb s PRO 115 Ca -0.02 -0.31 -0.27 0.00 0.02 0.00 0.00 61.00 60.41 3ngb s PRO 115 Cb -0.14 -4.32 -0.04 0.00 0.02 0.00 0.00 34.50 30.03 3ngb s PRO 115 CO 0.04 -2.18 2.09 -1.54 -0.33 0.00 0.00 177.00 175.08 3ngb s SER 116 N 4.00 5.17 0.19 2.53 1.04 -1.09 -4.80 113.70 120.74 3ngb s SER 116 Ca 0.37 1.07 -0.25 0.00 0.48 0.00 0.00 55.95 57.62 3ngb s SER 116 Cb -0.07 -2.52 -0.08 0.00 0.10 0.00 0.00 66.02 63.45 3ngb s SER 116 CO 0.12 -2.32 0.80 -0.69 0.98 0.00 0.00 173.24 172.13 3ngb s VAL 117 N 9.48 4.35 0.10 5.02 1.01 -1.26 -3.04 120.40 136.06 3ngb s VAL 117 Ca 0.86 1.71 0.01 0.00 0.00 0.00 0.00 61.98 64.55 3ngb s VAL 117 Cb -0.20 -4.12 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 3ngb s VAL 117 CO 0.28 0.47 0.02 0.49 0.00 0.00 0.00 175.10 176.36 3ngb n PHE 118 N 1.44 0.13 -3.65 5.22 3.72 -0.60 -5.02 117.46 118.70 3ngb n PHE 118 Ca -0.05 -0.60 -0.01 0.00 -0.05 0.00 0.00 57.45 56.74 3ngb n PHE 118 Cb 0.49 -0.03 -0.06 0.00 -0.94 0.00 0.00 39.48 38.93 3ngb n PHE 118 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 3ngb s ILE 119 N -1.70 0.00 -0.14 4.37 2.07 -1.26 -3.78 121.20 120.75 3ngb s ILE 119 Ca 0.03 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.29 3ngb s ILE 119 Cb 0.00 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.60 3ngb s ILE 119 CO 0.02 0.00 -0.20 -0.36 -1.91 0.00 0.00 174.94 172.49 3ngb s PHE 120 N 1.18 2.69 0.65 3.50 0.08 -1.12 -5.03 117.98 119.93 3ngb s PHE 120 Ca -0.08 -1.25 -0.15 0.00 0.12 0.00 0.00 56.93 55.58 3ngb s PHE 120 Cb -0.03 -1.83 -0.00 0.00 -0.57 0.00 0.00 43.02 40.59 3ngb s PHE 120 CO -0.13 -0.56 1.09 -2.14 -0.10 0.00 0.00 175.22 173.38 3ngb s PRO 121 N 0.78 2.89 0.22 0.24 0.02 -1.26 -3.06 135.00 134.82 3ngb s PRO 121 Ca -0.07 1.30 -0.32 0.00 0.02 0.00 0.00 61.00 61.93 3ngb s PRO 121 Cb -0.16 -1.97 -0.12 0.00 0.02 0.00 0.00 34.50 32.28 3ngb s PRO 121 CO -0.01 -1.17 1.68 -2.14 -0.33 0.00 0.00 177.00 175.04 3ngb s PRO 122 N -4.21 4.14 0.46 5.54 0.02 -1.26 -4.91 135.00 134.77 3ngb s PRO 122 Ca 0.65 2.57 -0.22 0.00 0.02 0.00 0.00 61.00 64.02 3ngb s PRO 122 Cb -0.19 -3.08 -0.08 0.00 0.02 0.00 0.00 34.50 31.18 3ngb s PRO 122 CO 0.42 -0.71 1.10 -1.54 -0.33 0.00 0.00 177.00 175.94 3ngb s SER 123 N 1.06 6.32 0.33 2.53 1.04 -1.26 -4.91 113.70 118.81 3ngb s SER 123 Ca 0.72 2.14 0.03 0.00 0.48 0.00 0.00 55.95 59.33 3ngb s SER 123 Cb -0.49 -2.59 0.63 0.00 0.10 0.00 0.00 66.02 63.68 3ngb s SER 123 CO 0.34 -0.80 1.94 0.44 0.98 0.00 0.00 173.24 176.14 3ngb h ASP 124 N 1.99 0.79 -0.14 7.02 3.45 -2.00 -0.67 116.42 126.86 3ngb h ASP 124 Ca -0.49 0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.01 3ngb h ASP 124 Cb 1.23 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.83 3ngb h ASP 124 CO 0.60 0.51 0.10 -0.08 -1.57 0.00 0.00 179.24 178.81 3ngb h GLU 125 N 0.90 0.00 0.10 3.56 4.81 -2.01 -2.34 114.58 119.60 3ngb h GLU 125 Ca 0.35 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.38 3ngb h GLU 125 Cb 0.21 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.60 3ngb h GLU 125 CO -0.12 0.00 -0.93 0.37 -0.73 0.00 0.00 179.01 177.60 3ngb h GLN 126 N 0.00 0.22 -0.63 1.92 4.15 -1.50 -3.34 115.11 115.94 3ngb h GLN 126 Ca 0.07 -0.38 0.11 0.00 0.77 0.00 0.00 58.65 59.22 3ngb h GLN 126 Cb 0.27 0.14 -0.04 0.00 0.21 0.00 0.00 27.48 28.06 3ngb h GLN 126 CO -0.00 1.18 0.42 -0.07 -1.93 0.00 0.00 178.83 178.43 3ngb h LEU 127 N -0.48 0.34 -1.76 -2.39 3.38 -1.05 -1.61 115.31 111.76 3ngb h LEU 127 Ca -0.19 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3ngb h LEU 127 Cb 1.57 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 3ngb h LEU 127 CO 0.08 0.20 -0.06 0.11 0.09 0.00 0.00 178.44 178.85 3ngb h LYS 128 N 0.38 0.07 -2.79 1.13 1.57 -1.55 -3.34 116.57 112.04 3ngb h LYS 128 Ca 0.30 -0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 58.45 3ngb h LYS 128 Cb 0.65 -0.01 -0.42 0.00 0.08 0.00 0.00 32.23 32.52 3ngb h LYS 128 CO -0.08 0.14 -0.59 -1.13 -0.57 0.00 0.00 179.45 177.22 3ngb n SER 129 N -4.42 3.15 0.00 0.86 3.41 -0.60 -5.04 113.62 110.97 3ngb n SER 129 Ca -0.02 -3.26 0.00 0.00 -0.26 0.00 0.00 58.87 55.33 3ngb n SER 129 Cb 0.17 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 3ngb n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ngb n GLY 130 N 1.64 1.07 3.73 5.00 0.00 -1.25 -4.98 105.19 110.40 3ngb n GLY 130 Ca 0.23 -0.84 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 3ngb n GLY 130 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ngb n THR 131 N 0.00 0.00 -4.35 2.61 -2.24 -1.26 -3.58 114.28 105.45 3ngb n THR 131 Ca 0.00 -1.74 -0.19 0.00 -2.27 0.00 0.00 64.05 59.85 3ngb n THR 131 Cb 0.00 -0.66 -0.15 0.00 -2.10 0.00 0.00 70.33 67.42 3ngb n THR 131 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ngb s ALA 132 N -2.83 0.75 -0.13 6.98 0.00 0.86 -4.23 121.76 123.16 3ngb s ALA 132 Ca 0.60 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.23 3ngb s ALA 132 Cb -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.86 3ngb s ALA 132 CO 0.39 0.16 -0.22 -1.12 0.00 0.00 0.00 175.76 174.97 3ngb s SER 133 N -0.07 3.20 -0.40 0.00 0.01 -1.26 -0.33 113.70 114.85 3ngb s SER 133 Ca 0.01 -0.57 -0.09 0.00 1.31 0.00 0.00 55.95 56.61 3ngb s SER 133 Cb -0.05 -1.45 0.07 0.00 0.21 0.00 0.00 66.02 64.79 3ngb s SER 133 CO -0.00 0.11 0.24 -0.69 0.41 0.00 0.00 173.24 173.30 3ngb s VAL 134 N 0.66 4.25 0.52 3.43 1.01 0.93 -3.98 120.40 127.22 3ngb s VAL 134 Ca -0.11 -1.27 -0.08 0.00 0.00 0.00 0.00 61.98 60.52 3ngb s VAL 134 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3ngb s VAL 134 CO 0.02 -0.43 0.88 -0.69 0.00 0.00 0.00 175.10 174.88 3ngb s VAL 135 N 1.45 4.81 -0.28 2.92 1.01 -1.17 -0.31 120.40 128.83 3ngb s VAL 135 Ca 0.02 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.53 3ngb s VAL 135 Cb -0.22 -3.85 0.15 0.00 0.00 0.00 0.00 36.38 32.46 3ngb s VAL 135 CO 0.03 -0.91 0.37 0.00 0.00 0.00 0.00 175.10 174.59 3ngb s LEU 137 N 2.49 4.51 -0.43 0.00 2.96 -1.25 -1.66 118.68 125.30 3ngb s LEU 137 Ca 0.10 1.26 0.02 0.00 -0.22 0.00 0.00 54.13 55.29 3ngb s LEU 137 Cb -0.13 -2.95 0.13 0.00 0.50 0.00 0.00 46.19 43.74 3ngb s LEU 137 CO -0.28 0.26 0.23 -0.76 -1.32 0.00 0.00 176.35 174.47 3ngb s LEU 138 N -1.19 2.68 0.12 -0.68 1.02 0.92 -1.56 118.68 119.98 3ngb s LEU 138 Ca 0.30 -2.59 -0.18 0.00 0.02 0.00 0.00 54.13 51.68 3ngb s LEU 138 Cb -0.19 -1.03 -0.07 0.00 0.02 0.00 0.00 46.19 44.92 3ngb s LEU 138 CO 0.19 -0.27 0.59 0.21 0.02 0.00 0.00 176.35 177.09 3ngb s ASN 139 N 0.40 7.01 -0.09 2.29 2.47 -1.17 -1.48 114.94 124.37 3ngb s ASN 139 Ca 0.17 1.25 -0.03 0.00 0.42 0.00 0.00 52.86 54.67 3ngb s ASN 139 Cb -0.24 -2.35 0.01 0.00 -1.45 0.00 0.00 41.25 37.21 3ngb s ASN 139 CO -0.00 0.20 0.05 0.59 -3.72 0.00 0.00 177.10 174.22 3ngb n ASN 140 N 1.34 -5.94 -3.81 -4.21 4.13 -1.07 -2.66 115.26 103.03 3ngb n ASN 140 Ca -0.08 0.96 -0.10 0.00 1.68 0.00 0.00 54.58 57.04 3ngb n ASN 140 Cb 0.51 -2.97 -0.04 0.00 -1.54 0.00 0.00 39.78 35.74 3ngb n ASN 140 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3ngb s PHE 141 N -0.72 0.40 -0.29 3.10 -0.71 -0.86 -3.89 117.98 115.02 3ngb s PHE 141 Ca -0.06 -0.78 -0.25 0.00 -1.04 0.00 0.00 56.93 54.81 3ngb s PHE 141 Cb 0.00 0.23 0.14 0.00 -1.21 0.00 0.00 43.02 42.19 3ngb s PHE 141 CO 0.30 -1.07 1.15 -0.47 -1.34 0.00 0.00 175.22 173.79 3ngb s TYR 142 N -3.76 -0.35 0.41 3.49 5.04 -1.25 -1.57 117.35 119.36 3ngb s TYR 142 Ca 0.22 0.85 -0.07 0.00 -2.44 0.00 0.00 57.07 55.64 3ngb s TYR 142 Cb -0.01 0.40 0.10 0.00 0.35 0.00 0.00 41.96 42.79 3ngb s TYR 142 CO 0.11 -0.17 0.41 -2.30 -1.34 0.00 0.00 175.55 172.26 3ngb n PRO 143 N 2.06 -1.42 0.23 4.97 -0.02 -1.26 -1.98 135.00 137.57 3ngb n PRO 143 Ca -0.12 -0.65 0.10 0.00 -2.02 0.00 0.00 63.50 60.81 3ngb n PRO 143 Cb 0.56 -0.56 0.48 0.00 -0.02 0.00 0.00 33.50 33.96 3ngb n PRO 143 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3ngb h ARG 144 N 0.00 0.00 -6.52 -0.52 2.43 -1.95 -3.44 114.38 104.38 3ngb h ARG 144 Ca -0.15 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.48 3ngb h ARG 144 Cb 0.44 0.00 0.04 0.00 -0.42 0.00 0.00 29.97 30.04 3ngb h ARG 144 CO 0.10 0.21 1.07 0.39 -1.51 0.00 0.00 179.97 180.24 3ngb n GLU 145 N -3.39 2.71 -3.63 0.20 4.71 -1.26 -4.97 120.64 115.00 3ngb n GLU 145 Ca 0.00 0.98 -0.11 0.00 -0.01 0.00 0.00 57.16 58.03 3ngb n GLU 145 Cb 0.42 -2.86 -0.07 0.00 -1.01 0.00 0.00 31.44 27.92 3ngb n GLU 145 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ngb s ALA 146 N 2.44 -1.87 -0.51 0.62 0.00 -1.26 -4.71 121.76 116.46 3ngb s ALA 146 Ca 0.81 2.13 -0.05 0.00 0.00 0.00 0.00 51.96 54.86 3ngb s ALA 146 Cb -0.51 -1.32 0.13 0.00 0.00 0.00 0.00 23.12 21.42 3ngb s ALA 146 CO 0.37 -0.34 0.34 0.21 0.00 0.00 0.00 175.76 176.35 3ngb s LYS 147 N 0.78 2.37 -0.38 0.00 2.20 -1.08 -4.97 119.74 118.66 3ngb s LYS 147 Ca -0.03 -2.06 -0.18 0.00 -0.36 0.00 0.00 55.97 53.34 3ngb s LYS 147 Cb -0.05 -3.76 0.01 0.00 -1.51 0.00 0.00 37.83 32.52 3ngb s LYS 147 CO -0.07 -1.15 0.47 0.08 -0.36 0.00 0.00 175.35 174.33 3ngb s VAL 148 N 0.77 5.05 -0.22 4.02 1.01 -1.26 -2.02 120.40 127.76 3ngb s VAL 148 Ca 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 3ngb s VAL 148 Cb -0.22 -3.98 0.01 0.00 0.00 0.00 0.00 36.38 32.18 3ngb s VAL 148 CO -0.03 -0.29 -0.09 -1.10 0.00 0.00 0.00 175.10 173.58 3ngb s GLN 149 N 2.29 3.12 0.18 2.72 -0.21 -0.15 -4.94 119.66 122.67 3ngb s GLN 149 Ca 0.16 -0.78 -0.30 0.00 0.02 0.00 0.00 55.36 54.46 3ngb s GLN 149 Cb -0.16 -2.88 -0.08 0.00 1.00 0.00 0.00 33.01 30.90 3ngb s GLN 149 CO 0.14 -0.26 1.13 -1.58 -2.12 0.00 0.00 175.29 172.60 3ngb s TRP 150 N 1.38 3.54 -0.14 0.91 0.52 -1.26 0.41 118.94 124.30 3ngb s TRP 150 Ca 0.04 1.55 -0.01 0.00 0.02 0.00 0.00 56.10 57.70 3ngb s TRP 150 Cb -0.15 -3.32 0.04 0.00 -1.15 0.00 0.00 33.47 28.90 3ngb s TRP 150 CO -0.06 -0.78 -0.02 0.15 0.02 0.00 0.00 176.95 176.26 3ngb s LYS 151 N -0.38 1.05 -0.39 4.98 1.02 0.59 -1.01 119.74 125.60 3ngb s LYS 151 Ca 0.50 -0.32 -0.08 0.00 0.02 0.00 0.00 55.97 56.10 3ngb s LYS 151 Cb -0.30 -1.74 0.07 0.00 -0.52 0.00 0.00 37.83 35.34 3ngb s LYS 151 CO 0.36 -0.43 0.20 0.08 -0.92 0.00 0.00 175.35 174.63 3ngb s VAL 152 N 1.78 3.97 -1.38 3.17 1.01 -1.22 -1.80 120.40 125.93 3ngb s VAL 152 Ca 0.02 -1.37 -0.07 0.00 0.00 0.00 0.00 61.98 60.56 3ngb s VAL 152 Cb -0.15 -3.39 0.03 0.00 0.00 0.00 0.00 36.38 32.87 3ngb s VAL 152 CO -0.07 -0.41 0.98 0.47 0.00 0.00 0.00 175.10 176.07 3ngb n ASP 153 N 4.84 -3.97 -1.88 3.32 9.92 0.22 -1.37 116.55 127.63 3ngb n ASP 153 Ca -0.10 -0.69 -0.19 0.00 -0.53 0.00 0.00 54.79 53.28 3ngb n ASP 153 Cb 0.43 -4.47 -0.05 0.00 -0.64 0.00 0.00 41.12 36.39 3ngb n ASP 153 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3ngb n ASN 154 N -2.99 -5.22 -4.30 -2.24 4.13 -1.26 -4.93 115.26 98.45 3ngb n ASN 154 Ca -0.10 0.30 -0.45 0.00 1.68 0.00 0.00 54.58 56.01 3ngb n ASN 154 Cb 0.59 -4.53 -0.02 0.00 -1.54 0.00 0.00 39.78 34.28 3ngb n ASN 154 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ngb s ALA 155 N -2.75 4.28 -0.45 5.41 0.00 -0.47 -5.02 121.76 122.77 3ngb s ALA 155 Ca 0.00 -3.53 -0.41 0.00 0.00 0.00 0.00 51.96 48.02 3ngb s ALA 155 Cb 0.00 -3.44 -0.16 0.00 0.00 0.00 0.00 23.12 19.52 3ngb s ALA 155 CO 0.00 -2.24 2.14 -0.11 0.00 0.00 0.00 175.76 175.55 3ngb n LEU 156 N 3.41 1.23 -4.86 0.00 7.94 -1.26 -3.42 117.00 120.04 3ngb n LEU 156 Ca 0.17 0.61 -0.31 0.00 -1.11 0.00 0.00 56.01 55.37 3ngb n LEU 156 Cb 0.43 -1.02 0.02 0.00 0.53 0.00 0.00 43.42 43.38 3ngb n LEU 156 CO 0.38 -0.75 0.72 -1.10 -1.11 0.00 0.00 177.39 175.53 3ngb s GLN 157 N 5.97 3.36 -0.30 1.96 -1.52 -0.18 -5.00 119.66 123.94 3ngb s GLN 157 Ca 1.16 0.73 -0.14 0.00 -1.95 0.00 0.00 55.36 55.16 3ngb s GLN 157 Cb -1.28 -2.05 0.18 0.00 -0.22 0.00 0.00 33.01 29.63 3ngb s GLN 157 CO 0.61 -0.74 1.05 -1.54 -0.25 0.00 0.00 175.29 174.42 3ngb s SER 158 N -4.14 -0.47 0.00 5.90 1.04 -1.26 -4.65 113.70 110.11 3ngb s SER 158 Ca 0.56 0.42 0.00 0.00 0.48 0.00 0.00 55.95 57.41 3ngb s SER 158 Cb -0.12 1.45 0.00 0.00 0.10 0.00 0.00 66.02 67.45 3ngb s SER 158 CO 0.54 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.28 3ngb n GLY 159 N 5.22 3.61 0.82 7.32 0.00 -1.26 -4.90 105.19 116.01 3ngb n GLY 159 Ca -0.07 -1.03 0.11 0.00 0.00 0.00 0.00 46.02 45.03 3ngb n GLY 159 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ngb n ASN 160 N 0.00 2.46 -4.90 1.61 0.23 -1.26 -4.92 115.26 108.48 3ngb n ASN 160 Ca 0.00 -1.84 -0.28 0.00 -0.53 0.00 0.00 54.58 51.93 3ngb n ASN 160 Cb 0.00 -0.15 -0.01 0.00 -2.08 0.00 0.00 39.78 37.54 3ngb n ASN 160 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3ngb s SER 161 N -1.57 6.31 -0.30 0.53 0.15 -1.26 -2.66 113.70 114.90 3ngb s SER 161 Ca 0.35 1.02 -0.10 0.00 0.70 0.00 0.00 55.95 57.92 3ngb s SER 161 Cb 0.20 -2.29 0.17 0.00 -1.71 0.00 0.00 66.02 62.39 3ngb s SER 161 CO 0.29 -0.58 0.83 -1.58 1.20 0.00 0.00 173.24 173.40 3ngb s GLN 162 N -4.62 0.41 0.52 5.44 0.74 -1.16 -4.99 119.66 115.99 3ngb s GLN 162 Ca 0.49 0.88 0.07 0.00 0.05 0.00 0.00 55.36 56.85 3ngb s GLN 162 Cb -0.10 0.51 0.05 0.00 1.10 0.00 0.00 33.01 34.57 3ngb s GLN 162 CO 0.43 -0.28 0.72 -1.21 -0.55 0.00 0.00 175.29 174.40 3ngb s GLU 163 N 2.76 2.48 -0.29 1.67 2.02 -1.26 -1.09 118.70 124.99 3ngb s GLU 163 Ca 0.03 -1.34 -0.15 0.00 0.02 0.00 0.00 54.97 53.53 3ngb s GLU 163 Cb -0.11 -2.65 0.13 0.00 0.10 0.00 0.00 34.13 31.61 3ngb s GLU 163 CO -0.17 -0.66 0.88 0.45 0.02 0.00 0.00 175.26 175.78 3ngb s SER 164 N -4.52 -0.67 -0.02 -0.19 0.15 -0.47 -4.95 113.70 103.03 3ngb s SER 164 Ca 0.59 1.04 0.07 0.00 0.70 0.00 0.00 55.95 58.35 3ngb s SER 164 Cb -0.08 1.40 -0.02 0.00 -1.71 0.00 0.00 66.02 65.61 3ngb s SER 164 CO 0.37 -0.16 -0.22 -0.69 1.20 0.00 0.00 173.24 173.74 3ngb s VAL 165 N 1.69 1.75 0.32 4.45 1.01 -1.26 -1.26 120.40 127.11 3ngb s VAL 165 Ca -0.08 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 3ngb s VAL 165 Cb -0.05 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.78 3ngb s VAL 165 CO -0.17 0.50 0.75 0.42 0.00 0.00 0.00 175.10 176.60 3ngb s THR 166 N -0.50 4.65 0.49 3.92 -4.23 -0.84 -5.01 115.64 114.12 3ngb s THR 166 Ca 0.08 1.02 -0.22 0.00 -1.18 0.00 0.00 61.69 61.38 3ngb s THR 166 Cb -0.09 -3.63 -0.08 0.00 1.34 0.00 0.00 72.50 70.04 3ngb s THR 166 CO -0.01 -0.17 1.02 -0.62 -0.54 0.00 0.00 174.62 174.30 3ngb n GLU 167 N -0.31 1.27 -1.52 3.99 -0.58 -1.26 -4.40 120.64 117.82 3ngb n GLU 167 Ca 0.03 0.46 -0.48 0.00 -0.42 0.00 0.00 57.16 56.76 3ngb n GLU 167 Cb 0.53 -2.13 -0.05 0.00 -0.57 0.00 0.00 31.44 29.22 3ngb n GLU 167 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 3ngb n GLN 168 N -0.25 1.48 -1.50 3.49 7.27 -1.26 -4.83 117.38 121.77 3ngb n GLN 168 Ca 0.10 0.42 -0.49 0.00 0.07 0.00 0.00 57.00 57.10 3ngb n GLN 168 Cb 0.42 -2.75 -0.03 0.00 2.41 0.00 0.00 30.24 30.28 3ngb n GLN 168 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 3ngb n ASP 169 N 10.25 0.19 -0.13 1.69 4.64 -0.76 -4.79 116.55 127.64 3ngb n ASP 169 Ca 0.36 1.15 -0.11 0.00 -1.38 0.00 0.00 54.79 54.81 3ngb n ASP 169 Cb 0.31 -1.10 -0.02 0.00 -1.04 0.00 0.00 41.12 39.28 3ngb n ASP 169 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 3ngb h SER 170 N 2.08 0.66 0.05 1.67 4.64 -1.91 -1.81 113.55 118.93 3ngb h SER 170 Ca -0.37 -0.31 -0.00 0.00 -0.47 0.00 0.00 61.79 60.63 3ngb h SER 170 Cb 1.39 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3ngb h SER 170 CO 0.62 0.81 -0.03 0.50 -0.87 0.00 0.00 176.83 177.86 3ngb h LYS 171 N 0.49 -0.07 -0.00 4.77 3.64 -1.99 -3.37 116.57 120.04 3ngb h LYS 171 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3ngb h LYS 171 Cb 0.48 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3ngb h LYS 171 CO 0.02 -0.05 -0.12 -0.40 -2.27 0.00 0.00 179.45 176.63 3ngb n ASP 172 N -3.08 0.43 -3.67 4.20 5.68 -1.26 -4.95 116.55 113.90 3ngb n ASP 172 Ca -0.01 -0.47 -0.21 0.00 -0.50 0.00 0.00 54.79 53.60 3ngb n ASP 172 Cb 0.03 -0.09 0.04 0.00 -1.14 0.00 0.00 41.12 39.96 3ngb n ASP 172 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3ngb n SER 173 N -1.03 -1.39 -4.22 -1.12 7.64 -0.68 -5.00 113.62 107.82 3ngb n SER 173 Ca 0.13 -0.80 -0.21 0.00 1.01 0.00 0.00 58.87 59.00 3ngb n SER 173 Cb 0.28 -4.16 -0.12 0.00 -1.01 0.00 0.00 64.21 59.20 3ngb n SER 173 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3ngb s THR 174 N -3.63 1.35 0.39 0.44 -4.23 -1.25 -4.82 115.64 103.88 3ngb s THR 174 Ca 0.02 -1.39 0.04 0.00 -1.18 0.00 0.00 61.69 59.17 3ngb s THR 174 Cb -0.00 -1.26 -0.00 0.00 1.34 0.00 0.00 72.50 72.57 3ngb s THR 174 CO 0.80 -0.16 0.56 -0.31 -0.54 0.00 0.00 174.62 174.98 3ngb s TYR 175 N -1.22 3.13 -0.03 3.99 2.02 -0.61 -1.82 117.35 122.80 3ngb s TYR 175 Ca 0.01 -0.05 -0.01 0.00 -0.37 0.00 0.00 57.07 56.66 3ngb s TYR 175 Cb -0.10 -2.17 0.03 0.00 -0.40 0.00 0.00 41.96 39.32 3ngb s TYR 175 CO 0.03 -0.20 0.03 -1.12 -1.57 0.00 0.00 175.55 172.72 3ngb s SER 176 N -4.21 0.56 -0.01 2.29 0.01 -1.26 -2.02 113.70 109.06 3ngb s SER 176 Ca 0.47 0.02 0.06 0.00 1.31 0.00 0.00 55.95 57.82 3ngb s SER 176 Cb -0.10 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.95 3ngb s SER 176 CO 0.34 -0.16 -0.20 -0.22 0.41 0.00 0.00 173.24 173.41 3ngb s LEU 177 N 1.42 2.41 -0.08 2.44 0.20 -0.55 -1.98 118.68 122.54 3ngb s LEU 177 Ca -0.05 -0.37 0.01 0.00 0.69 0.00 0.00 54.13 54.41 3ngb s LEU 177 Cb -0.13 -1.45 0.02 0.00 -0.43 0.00 0.00 46.19 44.21 3ngb s LEU 177 CO -0.03 0.31 -0.09 -0.94 -0.29 0.00 0.00 176.35 175.32 3ngb s SER 178 N -0.86 1.72 -0.33 3.68 1.04 -0.39 -0.06 113.70 118.51 3ngb s SER 178 Ca 0.12 -0.25 -0.01 0.00 0.48 0.00 0.00 55.95 56.28 3ngb s SER 178 Cb -0.10 -0.73 0.07 0.00 0.10 0.00 0.00 66.02 65.35 3ngb s SER 178 CO 0.01 -0.04 0.05 -0.55 0.98 0.00 0.00 173.24 173.68 3ngb s SER 179 N 1.10 4.93 -0.37 7.02 0.15 -0.66 -1.37 113.70 124.50 3ngb s SER 179 Ca -0.07 -1.57 -0.18 0.00 0.70 0.00 0.00 55.95 54.84 3ngb s SER 179 Cb -0.14 -1.72 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 3ngb s SER 179 CO -0.01 -0.34 0.49 -0.89 1.20 0.00 0.00 173.24 173.69 3ngb s THR 180 N 1.17 5.03 -0.52 6.45 2.01 -0.25 -2.12 115.64 127.41 3ngb s THR 180 Ca -0.00 0.14 -0.19 0.00 0.31 0.00 0.00 61.69 61.95 3ngb s THR 180 Cb -0.20 -3.98 0.07 0.00 0.01 0.00 0.00 72.50 68.39 3ngb s THR 180 CO -0.03 -0.27 0.65 -0.22 -0.69 0.00 0.00 174.62 174.05 3ngb s LEU 181 N 2.33 5.01 -0.26 4.42 1.98 0.58 -3.01 118.68 129.74 3ngb s LEU 181 Ca 0.17 -0.99 -0.13 0.00 -2.89 0.00 0.00 54.13 50.29 3ngb s LEU 181 Cb -0.16 -2.43 -0.04 0.00 0.66 0.00 0.00 46.19 44.22 3ngb s LEU 181 CO 0.14 -0.94 0.28 -0.89 -1.89 0.00 0.00 176.35 173.05 3ngb s THR 182 N 2.67 5.25 0.39 3.68 2.01 -1.09 -0.05 115.64 128.50 3ngb s THR 182 Ca 0.15 0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.58 3ngb s THR 182 Cb -0.20 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 3ngb s THR 182 CO 0.11 0.23 0.10 -0.76 -0.69 0.00 0.00 174.62 173.61 3ngb s LEU 183 N 1.73 2.04 0.13 4.42 1.43 0.56 -4.87 118.68 124.12 3ngb s LEU 183 Ca 0.12 -1.59 0.03 0.00 -1.03 0.00 0.00 54.13 51.66 3ngb s LEU 183 Cb -0.15 -0.20 -0.04 0.00 0.03 0.00 0.00 46.19 45.83 3ngb s LEU 183 CO 0.09 -0.84 0.16 -0.94 0.23 0.00 0.00 176.35 175.05 3ngb s SER 184 N -3.58 5.78 0.52 2.29 1.04 -1.26 -0.10 113.70 118.39 3ngb s SER 184 Ca 0.27 0.01 0.23 0.00 0.48 0.00 0.00 55.95 56.94 3ngb s SER 184 Cb 0.04 -1.60 1.42 0.00 0.10 0.00 0.00 66.02 65.98 3ngb s SER 184 CO 0.14 0.10 2.11 0.50 0.98 0.00 0.00 173.24 177.08 3ngb h LYS 185 N 2.66 0.00 -1.00 4.02 3.64 -1.86 0.15 116.57 124.19 3ngb h LYS 185 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3ngb h LYS 185 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 3ngb h LYS 185 CO 0.66 0.09 0.00 0.00 -2.27 0.00 0.00 179.45 177.93 3ngb n ALA 186 N -2.38 2.49 0.00 5.00 0.00 -1.26 -3.38 120.51 120.99 3ngb n ALA 186 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3ngb n ALA 186 Cb 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3ngb n ALA 186 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3ngb n ASP 187 N 0.18 0.00 0.21 0.00 4.64 -0.57 -4.91 116.55 116.10 3ngb n ASP 187 Ca 0.00 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.51 3ngb n ASP 187 Cb 0.34 0.00 0.29 0.00 -1.04 0.00 0.00 41.12 40.71 3ngb n ASP 187 CO 0.00 0.00 0.00 0.22 -0.82 0.00 0.00 177.20 176.60 3ngb h TYR 188 N 0.00 0.00 -0.01 -0.67 3.20 -0.75 -2.88 116.97 115.86 3ngb h TYR 188 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3ngb h TYR 188 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 3ngb h TYR 188 CO 0.00 0.20 0.00 0.39 -1.64 0.00 0.00 178.16 177.11 3ngb n GLU 189 N -3.22 1.06 0.02 1.82 -0.58 -1.23 -3.60 120.64 114.91 3ngb n GLU 189 Ca 0.02 -0.08 0.13 0.00 -0.42 0.00 0.00 57.16 56.80 3ngb n GLU 189 Cb 0.52 -1.34 0.37 0.00 -0.57 0.00 0.00 31.44 30.42 3ngb n GLU 189 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ngb n LYS 190 N -0.75 0.07 -2.96 3.49 4.76 -1.09 -4.94 118.16 116.75 3ngb n LYS 190 Ca 0.16 0.03 -0.09 0.00 -2.87 0.00 0.00 58.31 55.55 3ngb n LYS 190 Cb 0.09 -1.55 -0.02 0.00 -1.84 0.00 0.00 35.03 31.71 3ngb n LYS 190 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3ngb n HIS 191 N -1.66 -0.87 0.00 2.13 8.25 -1.24 -5.09 115.22 116.75 3ngb n HIS 191 Ca 0.06 -1.34 0.00 0.00 -0.26 0.00 0.00 57.72 56.18 3ngb n HIS 191 Cb 0.36 0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.74 3ngb n HIS 191 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 3ngb n LYS 192 N -0.32 2.93 -3.09 -0.41 2.85 -1.26 -4.87 118.16 113.99 3ngb n LYS 192 Ca 0.01 0.00 -0.44 0.00 -1.05 0.00 0.00 58.31 56.83 3ngb n LYS 192 Cb 0.32 -0.28 -0.05 0.00 -0.65 0.00 0.00 35.03 34.37 3ngb n LYS 192 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3ngb s VAL 193 N -0.13 4.77 -0.12 0.58 1.01 -1.26 0.04 120.40 125.28 3ngb s VAL 193 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3ngb s VAL 193 Cb 0.00 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.91 3ngb s VAL 193 CO 0.00 -1.07 -0.16 -0.31 0.00 0.00 0.00 175.10 173.56 3ngb s TYR 194 N 2.86 2.75 0.05 5.22 1.51 -1.01 -0.61 117.35 128.12 3ngb s TYR 194 Ca 0.14 -0.71 -0.17 0.00 -1.01 0.00 0.00 57.07 55.32 3ngb s TYR 194 Cb -0.22 -1.80 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 3ngb s TYR 194 CO 0.09 -0.24 0.40 0.00 -1.11 0.00 0.00 175.55 174.69 3ngb s ALA 195 N 0.29 -0.97 -0.26 3.71 0.00 -0.74 -1.49 121.76 122.30 3ngb s ALA 195 Ca -0.12 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.10 3ngb s ALA 195 Cb -0.16 0.39 0.06 0.00 0.00 0.00 0.00 23.12 23.41 3ngb s ALA 195 CO 0.06 -0.48 -0.07 0.00 0.00 0.00 0.00 175.76 175.27 3ngb s GLU 197 N 1.21 3.10 -0.28 0.00 2.56 0.16 -4.35 118.70 121.11 3ngb s GLU 197 Ca -0.06 1.46 -0.11 0.00 0.00 0.00 0.00 54.97 56.27 3ngb s GLU 197 Cb -0.19 -4.29 -0.05 0.00 2.00 0.00 0.00 34.13 31.60 3ngb s GLU 197 CO -0.06 -2.13 0.19 0.08 -0.56 0.00 0.00 175.26 172.77 3ngb s VAL 198 N 7.90 5.25 0.05 3.70 1.01 0.07 -0.97 120.40 137.40 3ngb s VAL 198 Ca 0.84 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.99 3ngb s VAL 198 Cb -0.23 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 3ngb s VAL 198 CO 0.32 0.23 -0.10 -0.89 0.00 0.00 0.00 175.10 174.66 3ngb s THR 199 N 1.75 3.40 0.20 3.92 2.01 -0.85 -1.75 115.64 124.31 3ngb s THR 199 Ca 0.07 -1.04 -0.22 0.00 0.31 0.00 0.00 61.69 60.81 3ngb s THR 199 Cb -0.16 -2.52 0.07 0.00 0.01 0.00 0.00 72.50 69.91 3ngb s THR 199 CO 0.11 0.27 1.01 -2.28 -0.69 0.00 0.00 174.62 173.04 3ngb s HIS 200 N -1.07 0.05 -0.05 4.92 2.46 -1.26 -2.63 115.29 117.71 3ngb s HIS 200 Ca 0.18 -0.47 -0.02 0.00 0.47 0.00 0.00 55.06 55.22 3ngb s HIS 200 Cb -0.11 0.71 -0.27 0.00 -0.13 0.00 0.00 32.58 32.78 3ngb s HIS 200 CO 0.10 -0.97 0.64 0.37 -2.47 0.00 0.00 174.74 172.41 3ngb h GLN 201 N 2.00 0.23 -0.13 2.88 4.15 -1.88 -3.32 115.11 119.04 3ngb h GLN 201 Ca -0.28 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 58.75 3ngb h GLN 201 Cb 1.22 0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.06 3ngb h GLN 201 CO 0.35 1.06 0.00 0.41 -1.93 0.00 0.00 178.83 178.72 3ngb n GLY 202 N 1.78 -0.51 3.02 2.39 0.00 -1.26 -4.65 105.19 105.96 3ngb n GLY 202 Ca -0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 3ngb n GLY 202 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ngb s LEU 203 N -0.84 1.59 0.15 0.99 1.43 -1.25 -4.69 118.68 116.07 3ngb s LEU 203 Ca 0.00 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 3ngb s LEU 203 Cb 0.00 -0.96 0.00 0.00 0.03 0.00 0.00 46.19 45.27 3ngb s LEU 203 CO 0.00 -0.00 1.55 0.08 0.23 0.00 0.00 176.35 178.20 3ngb h ARG 204 N 7.42 0.97 -4.60 1.70 -0.00 -1.87 -3.44 114.38 114.56 3ngb h ARG 204 Ca -0.31 -0.41 -0.36 0.00 -0.00 0.00 0.00 59.98 58.91 3ngb h ARG 204 Cb 1.17 -0.04 -0.28 0.00 -0.00 0.00 0.00 29.97 30.83 3ngb h ARG 204 CO 0.47 1.08 -0.77 -1.54 -0.00 0.00 0.00 179.97 179.21 3ngb s SER 205 N -6.66 0.92 -0.21 0.08 1.04 -1.26 -5.11 113.70 102.50 3ngb s SER 205 Ca -0.12 -0.19 -0.37 0.00 0.48 0.00 0.00 55.95 55.75 3ngb s SER 205 Cb 0.12 -0.08 -0.13 0.00 0.10 0.00 0.00 66.02 66.02 3ngb s SER 205 CO 0.86 0.06 1.89 -2.65 0.98 0.00 0.00 173.24 174.38 3ngb n PRO 206 N 2.70 1.58 -2.51 4.02 -0.02 -1.26 -4.94 135.00 134.57 3ngb n PRO 206 Ca -0.14 0.56 -0.36 0.00 -2.02 0.00 0.00 63.50 61.54 3ngb n PRO 206 Cb 0.57 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 3ngb n PRO 206 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ngb s VAL 207 N 4.47 3.66 -0.36 -1.45 1.01 -0.72 -4.83 120.40 122.19 3ngb s VAL 207 Ca 0.98 1.18 0.14 0.00 0.00 0.00 0.00 61.98 64.28 3ngb s VAL 207 Cb -0.87 -3.57 0.43 0.00 0.00 0.00 0.00 36.38 32.38 3ngb s VAL 207 CO 0.57 -0.08 0.96 0.41 0.00 0.00 0.00 175.10 176.96 3ngb n THR 208 N -0.45 1.23 -1.52 3.92 -1.04 -1.26 -0.75 114.28 114.41 3ngb n THR 208 Ca 0.07 -3.73 -0.51 0.00 -2.04 0.00 0.00 64.05 57.83 3ngb n THR 208 Cb 0.50 0.07 -0.07 0.00 -1.82 0.00 0.00 70.33 69.01 3ngb n THR 208 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 3ngb n LYS 209 N -0.12 1.28 -4.53 -2.82 3.00 -1.26 -4.74 118.16 108.97 3ngb n LYS 209 Ca 0.18 0.39 -0.25 0.00 -0.00 0.00 0.00 58.31 58.64 3ngb n LYS 209 Cb 0.75 -2.46 -0.10 0.00 0.00 0.00 0.00 35.03 33.21 3ngb n LYS 209 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 3ngb s SER 210 N 6.32 2.99 -0.03 3.14 1.04 -1.26 -3.59 113.70 122.31 3ngb s SER 210 Ca 1.05 -1.43 -0.14 0.00 0.48 0.00 0.00 55.95 55.91 3ngb s SER 210 Cb -0.85 -0.06 0.02 0.00 0.10 0.00 0.00 66.02 65.24 3ngb s SER 210 CO 0.51 -0.62 0.31 0.72 0.98 0.00 0.00 173.24 175.15 3ngb s PHE 211 N -3.09 -0.21 -0.26 5.02 -0.12 -0.56 -5.01 117.98 113.76 3ngb s PHE 211 Ca 0.32 0.37 -0.09 0.00 -0.05 0.00 0.00 56.93 57.47 3ngb s PHE 211 Cb 0.08 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 3ngb s PHE 211 CO 0.15 -0.36 0.14 -0.80 -0.05 0.00 0.00 175.22 174.30 3ngb s ASN 212 N -1.08 5.71 0.31 1.98 -0.87 -1.26 -2.41 114.94 117.31 3ngb s ASN 212 Ca -0.11 -0.05 -0.29 0.00 -1.57 0.00 0.00 52.86 50.83 3ngb s ASN 212 Cb -0.05 -2.04 -0.12 0.00 -0.02 0.00 0.00 41.25 39.02 3ngb s ASN 212 CO 0.04 -0.01 1.36 -1.14 -2.57 0.00 0.00 177.10 174.78 3ngb n ARG 213 N 4.79 2.18 0.00 -0.60 0.63 0.11 -3.47 116.66 120.29 3ngb n ARG 213 Ca -0.15 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 57.55 3ngb n ARG 213 Cb 0.52 -2.40 0.00 0.00 0.45 0.00 0.00 32.46 31.03 3ngb n ARG 213 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3ngb n GLY 214 N 1.29 2.07 3.56 5.14 0.00 -1.26 -4.91 105.19 111.07 3ngb n GLY 214 Ca 0.07 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 3ngb n GLY 214 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ngb s GLU 215 N 0.00 2.68 0.00 1.61 -6.30 -1.23 -5.30 118.70 110.16 3ngb s GLU 215 Ca 0.00 0.75 0.00 0.00 -2.50 0.00 0.00 54.97 53.22 3ngb s GLU 215 Cb 0.00 -4.38 0.00 0.00 0.00 0.00 0.00 34.13 29.75 3ngb s GLU 215 CO 0.00 -2.66 0.40 0.00 0.02 0.00 0.00 175.26 173.02