#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ngp s VAL 2 N 0.00 4.60 -0.09 1.69 0.11 -1.26 -4.09 120.40 121.36 1ngp s VAL 2 Ca 0.00 1.91 -0.10 0.00 -2.93 0.00 0.00 61.98 60.86 1ngp s VAL 2 Cb 0.00 -4.25 0.03 0.00 -1.53 0.00 0.00 36.38 30.63 1ngp s VAL 2 CO 0.00 0.33 0.28 -1.10 -3.33 0.00 0.00 175.10 171.28 1ngp s GLN 3 N 0.03 0.38 -0.17 1.54 -0.21 -0.98 -5.02 119.66 115.24 1ngp s GLN 3 Ca 0.44 0.28 -0.00 0.00 0.02 0.00 0.00 55.36 56.10 1ngp s GLN 3 Cb -0.22 0.18 0.04 0.00 1.00 0.00 0.00 33.01 34.01 1ngp s GLN 3 CO 0.27 -0.06 -0.06 -0.51 -2.12 0.00 0.00 175.29 172.82 1ngp s LEU 4 N -0.10 1.66 -0.19 2.90 2.01 -1.26 -1.20 118.68 122.50 1ngp s LEU 4 Ca -0.02 -0.68 -0.05 0.00 0.01 0.00 0.00 54.13 53.39 1ngp s LEU 4 Cb -0.03 -0.94 -0.03 0.00 0.01 0.00 0.00 46.19 45.21 1ngp s LEU 4 CO 0.01 -0.18 -0.01 -1.10 1.01 0.00 0.00 176.35 176.08 1ngp s GLN 5 N 1.62 3.65 0.04 1.70 -0.21 0.00 -4.35 119.66 122.11 1ngp s GLN 5 Ca 0.01 -0.51 0.06 0.00 0.02 0.00 0.00 55.36 54.94 1ngp s GLN 5 Cb -0.15 -3.04 -0.02 0.00 1.00 0.00 0.00 33.01 30.79 1ngp s GLN 5 CO -0.08 0.09 -0.17 -0.65 -2.12 0.00 0.00 175.29 172.36 1ngp s GLN 6 N 0.79 1.18 0.86 2.91 -0.21 -1.26 -1.59 119.66 122.34 1ngp s GLN 6 Ca 0.00 -0.82 -0.12 0.00 0.02 0.00 0.00 55.36 54.44 1ngp s GLN 6 Cb -0.14 -1.23 0.10 0.00 1.00 0.00 0.00 33.01 32.74 1ngp s GLN 6 CO 0.02 0.31 1.11 -2.30 -2.12 0.00 0.00 175.29 172.32 1ngp n PRO 7 N 1.95 -0.09 0.08 2.91 -0.02 -1.26 -4.84 135.00 133.73 1ngp n PRO 7 Ca -0.17 0.05 -0.19 0.00 -2.02 0.00 0.00 63.50 61.16 1ngp n PRO 7 Cb 0.54 -2.36 -0.15 0.00 -0.02 0.00 0.00 33.50 31.51 1ngp n PRO 7 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ngp h GLY 8 N -1.32 0.37 -4.54 -1.23 0.00 -1.96 -3.35 103.07 91.04 1ngp h GLY 8 Ca -0.45 -0.95 -0.10 0.00 0.00 0.00 0.00 47.33 45.83 1ngp h GLY 8 CO 0.43 0.83 -0.14 0.00 0.00 0.00 0.00 176.54 177.66 1ngp s ALA 9 N -2.61 -1.10 0.06 3.60 0.00 -1.26 -1.45 121.76 119.00 1ngp s ALA 9 Ca -0.10 0.78 0.04 0.00 0.00 0.00 0.00 51.96 52.68 1ngp s ALA 9 Cb 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1ngp s ALA 9 CO 0.87 -0.28 -0.11 -1.21 0.00 0.00 0.00 175.76 175.04 1ngp s GLU 10 N -0.95 0.70 -0.10 0.00 0.41 -0.71 -4.93 118.70 113.13 1ngp s GLU 10 Ca -0.10 -0.91 -0.01 0.00 -0.41 0.00 0.00 54.97 53.54 1ngp s GLU 10 Cb -0.03 -0.54 0.03 0.00 -1.78 0.00 0.00 34.13 31.81 1ngp s GLU 10 CO 0.05 0.11 -0.01 -1.17 -0.49 0.00 0.00 175.26 173.75 1ngp s LEU 11 N -1.80 0.80 0.16 1.80 0.20 -1.26 -1.92 118.68 116.66 1ngp s LEU 11 Ca -0.04 -0.24 0.03 0.00 0.69 0.00 0.00 54.13 54.57 1ngp s LEU 11 Cb -0.09 -0.55 -0.05 0.00 -0.43 0.00 0.00 46.19 45.08 1ngp s LEU 11 CO 0.01 -0.19 -0.04 0.68 -0.29 0.00 0.00 176.35 176.51 1ngp s VAL 12 N 1.90 0.88 0.34 1.68 -7.23 -0.71 -5.00 120.40 112.26 1ngp s VAL 12 Ca 0.04 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.10 1ngp s VAL 12 Cb -0.13 -1.97 -0.07 0.00 0.56 0.00 0.00 36.38 34.77 1ngp s VAL 12 CO -0.06 -0.62 0.71 -0.54 -0.31 0.00 0.00 175.10 174.27 1ngp s LYS 13 N -3.84 3.84 0.43 4.82 -0.14 -1.26 -1.65 119.74 121.93 1ngp s LYS 13 Ca 0.20 0.46 -0.26 0.00 -1.36 0.00 0.00 55.97 55.01 1ngp s LYS 13 Cb 0.05 -2.47 -0.09 0.00 -1.68 0.00 0.00 37.83 33.65 1ngp s LYS 13 CO 0.02 0.10 1.37 -2.14 -0.76 0.00 0.00 175.35 173.94 1ngp s PRO 14 N -3.38 3.84 0.00 -1.68 0.02 -1.26 -3.32 135.00 129.22 1ngp s PRO 14 Ca 0.51 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.83 1ngp s PRO 14 Cb -0.10 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.70 1ngp s PRO 14 CO 0.25 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 1ngp n GLY 15 N 0.62 1.45 0.00 0.52 0.00 0.12 -4.96 105.19 102.94 1ngp n GLY 15 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ngp n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngp n ALA 16 N -1.98 0.00 -2.20 4.61 0.00 -1.21 -4.48 120.51 115.26 1ngp n ALA 16 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ngp n ALA 16 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1ngp n ALA 16 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ngp s SER 17 N -1.00 0.56 0.04 0.00 1.04 -1.26 -1.51 113.70 111.57 1ngp s SER 17 Ca 0.00 -1.26 0.02 0.00 0.48 0.00 0.00 55.95 55.19 1ngp s SER 17 Cb 0.00 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 1ngp s SER 17 CO 0.00 -0.72 -0.07 -0.69 0.98 0.00 0.00 173.24 172.74 1ngp s VAL 18 N -3.96 0.47 -0.28 5.02 1.01 -1.03 -4.99 120.40 116.64 1ngp s VAL 18 Ca 0.28 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1ngp s VAL 18 Cb 0.07 -0.61 0.04 0.00 0.00 0.00 0.00 36.38 35.88 1ngp s VAL 18 CO 0.06 -0.43 -0.01 -0.75 0.00 0.00 0.00 175.10 173.97 1ngp s LYS 19 N -1.69 2.65 0.20 2.72 2.20 -1.26 -2.15 119.74 122.40 1ngp s LYS 19 Ca -0.10 -1.12 -0.07 0.00 -0.36 0.00 0.00 55.97 54.33 1ngp s LYS 19 Cb -0.09 -3.15 -0.06 0.00 -1.51 0.00 0.00 37.83 33.01 1ngp s LYS 19 CO -0.00 -0.53 0.47 -0.51 -0.36 0.00 0.00 175.35 174.42 1ngp s LEU 20 N 1.32 4.20 0.16 5.43 1.43 -0.38 -4.95 118.68 125.88 1ngp s LEU 20 Ca -0.02 0.74 0.10 0.00 -1.03 0.00 0.00 54.13 53.91 1ngp s LEU 20 Cb -0.18 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 1ngp s LEU 20 CO -0.02 -0.04 -0.22 -0.94 0.23 0.00 0.00 176.35 175.37 1ngp s SER 21 N -2.52 3.04 -0.29 2.29 1.04 -1.26 -1.97 113.70 114.03 1ngp s SER 21 Ca 0.44 -0.81 -0.01 0.00 0.48 0.00 0.00 55.95 56.05 1ngp s SER 21 Cb -0.11 -0.20 0.13 0.00 0.10 0.00 0.00 66.02 65.94 1ngp s SER 21 CO 0.24 0.07 0.28 0.00 0.98 0.00 0.00 173.24 174.82 1ngp s LYS 23 N 2.35 3.82 0.18 0.00 2.47 -0.62 0.15 119.74 128.08 1ngp s LYS 23 Ca 0.09 -0.24 -0.08 0.00 -1.56 0.00 0.00 55.97 54.18 1ngp s LYS 23 Cb -0.14 -3.72 -0.06 0.00 -1.46 0.00 0.00 37.83 32.45 1ngp s LYS 23 CO -0.32 -0.35 0.46 0.00 0.16 0.00 0.00 175.35 175.30 1ngp s ALA 24 N 1.95 3.68 -0.00 3.13 0.00 0.11 -0.82 121.76 129.81 1ngp s ALA 24 Ca 0.11 -0.40 -0.19 0.00 0.00 0.00 0.00 51.96 51.49 1ngp s ALA 24 Cb -0.16 -2.29 0.04 0.00 0.00 0.00 0.00 23.12 20.70 1ngp s ALA 24 CO 0.11 0.58 0.41 -1.54 0.00 0.00 0.00 175.76 175.32 1ngp s SER 25 N -2.31 -0.30 0.00 0.00 1.04 -0.34 -4.81 113.70 106.98 1ngp s SER 25 Ca 0.43 0.17 0.00 0.00 0.48 0.00 0.00 55.95 57.03 1ngp s SER 25 Cb -0.12 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1ngp s SER 25 CO 0.22 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.51 1ngp n GLY 26 N 0.98 0.72 3.82 7.32 0.00 -1.26 -2.31 105.19 114.46 1ngp n GLY 26 Ca -0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.76 1ngp n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ngp s TYR 27 N -2.19 -0.13 -0.66 1.61 1.13 -1.26 -4.29 117.35 111.57 1ngp s TYR 27 Ca 0.00 -0.29 -0.28 0.00 -1.41 0.00 0.00 57.07 55.09 1ngp s TYR 27 Cb 0.00 0.69 0.03 0.00 -1.10 0.00 0.00 41.96 41.58 1ngp s TYR 27 CO 0.00 -1.09 1.29 0.99 -2.51 0.00 0.00 175.55 174.23 1ngp s THR 28 N -3.45 3.82 0.30 -3.49 2.01 -1.26 -4.87 115.64 108.70 1ngp s THR 28 Ca 0.12 0.60 0.12 0.00 0.31 0.00 0.00 61.69 62.85 1ngp s THR 28 Cb -0.04 -4.76 0.32 0.00 0.01 0.00 0.00 72.50 68.03 1ngp s THR 28 CO 0.05 -1.56 1.35 0.33 -0.69 0.00 0.00 174.62 174.10 1ngp n PHE 29 N 9.21 0.85 0.96 4.92 7.35 -1.26 -0.78 117.46 138.70 1ngp n PHE 29 Ca 0.07 1.02 0.13 0.00 -0.76 0.00 0.00 57.45 57.91 1ngp n PHE 29 Cb 0.49 -1.33 0.43 0.00 0.35 0.00 0.00 39.48 39.42 1ngp n PHE 29 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1ngp n THR 30 N -5.05 0.04 1.47 -2.13 -2.24 -1.26 -3.73 114.28 101.38 1ngp n THR 30 Ca 0.28 -0.03 0.11 0.00 -2.27 0.00 0.00 64.05 62.15 1ngp n THR 30 Cb 0.95 -0.16 0.47 0.00 -2.10 0.00 0.00 70.33 69.50 1ngp n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1ngp n SER 31 N -1.56 1.24 -4.06 3.42 7.64 0.04 -4.47 113.62 115.86 1ngp n SER 31 Ca 0.06 -1.57 -0.13 0.00 1.01 0.00 0.00 58.87 58.25 1ngp n SER 31 Cb 0.35 -0.06 -0.11 0.00 -1.01 0.00 0.00 64.21 63.38 1ngp n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1ngp s TYR 32 N -1.88 0.65 0.58 1.43 1.51 -1.24 -4.72 117.35 113.67 1ngp s TYR 32 Ca 0.34 -0.50 -0.08 0.00 -1.01 0.00 0.00 57.07 55.82 1ngp s TYR 32 Cb 0.18 -0.39 -0.02 0.00 -0.11 0.00 0.00 41.96 41.62 1ngp s TYR 32 CO 0.28 -0.09 0.93 -1.58 -1.11 0.00 0.00 175.55 173.98 1ngp s TRP 33 N -1.38 3.46 -0.06 2.71 0.52 -0.67 -4.50 118.94 119.02 1ngp s TRP 33 Ca -0.10 0.93 0.04 0.00 0.02 0.00 0.00 56.10 56.99 1ngp s TRP 33 Cb -0.10 -2.65 -0.00 0.00 -1.15 0.00 0.00 33.47 29.57 1ngp s TRP 33 CO 0.00 -0.67 -0.19 1.41 0.02 0.00 0.00 176.95 177.53 1ngp s MET 34 N -5.02 2.12 0.21 4.98 1.75 -0.73 -0.65 119.30 121.97 1ngp s MET 34 Ca 0.53 -0.67 0.11 0.00 -1.25 0.00 0.00 55.69 54.41 1ngp s MET 34 Cb -0.11 -1.76 -0.05 0.00 2.84 0.00 0.00 34.83 35.76 1ngp s MET 34 CO 0.48 0.21 -0.20 -1.01 -0.65 0.00 0.00 175.02 173.85 1ngp s HIS 35 N 0.19 2.36 -0.02 4.11 3.76 0.63 -0.85 115.29 125.49 1ngp s HIS 35 Ca -0.09 -0.33 0.07 0.00 -0.15 0.00 0.00 55.06 54.56 1ngp s HIS 35 Cb -0.14 -1.13 -0.02 0.00 1.11 0.00 0.00 32.58 32.40 1ngp s HIS 35 CO 0.04 0.55 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.67 1ngp s TRP 36 N -1.87 2.07 0.02 1.40 0.52 -0.97 -1.02 118.94 119.09 1ngp s TRP 36 Ca 0.24 -0.39 0.01 0.00 0.02 0.00 0.00 56.10 55.97 1ngp s TRP 36 Cb -0.07 -1.33 -0.02 0.00 -1.15 0.00 0.00 33.47 30.90 1ngp s TRP 36 CO 0.12 -0.03 -0.04 0.08 0.02 0.00 0.00 176.95 177.10 1ngp s VAL 37 N -0.54 0.21 -0.06 4.03 1.01 -0.17 -2.27 120.40 122.61 1ngp s VAL 37 Ca 0.09 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.19 1ngp s VAL 37 Cb -0.09 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 1ngp s VAL 37 CO -0.01 -0.45 -0.16 -0.75 0.00 0.00 0.00 175.10 173.74 1ngp s LYS 38 N -1.42 2.64 -0.10 2.72 2.20 0.28 -1.30 119.74 124.76 1ngp s LYS 38 Ca -0.14 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.75 1ngp s LYS 38 Cb -0.10 -2.39 0.02 0.00 -1.51 0.00 0.00 37.83 33.86 1ngp s LYS 38 CO -0.01 0.53 -0.10 -1.14 -0.36 0.00 0.00 175.35 174.28 1ngp s GLN 39 N -0.48 1.65 -0.21 4.03 0.74 -0.14 -1.11 119.66 124.13 1ngp s GLN 39 Ca 0.06 -0.33 -0.13 0.00 0.05 0.00 0.00 55.36 55.01 1ngp s GLN 39 Cb -0.12 -1.58 -0.04 0.00 1.10 0.00 0.00 33.01 32.37 1ngp s GLN 39 CO 0.02 -0.18 0.27 1.03 -0.55 0.00 0.00 175.29 175.88 1ngp s ARG 40 N 1.38 4.14 -0.31 1.67 1.81 -1.20 -1.74 118.95 124.71 1ngp s ARG 40 Ca -0.01 -0.03 -0.40 0.00 -1.72 0.00 0.00 55.73 53.57 1ngp s ARG 40 Cb -0.14 -3.52 -0.16 0.00 -0.45 0.00 0.00 34.95 30.69 1ngp s ARG 40 CO -0.05 0.06 1.78 -2.30 -0.68 0.00 0.00 175.30 174.10 1ngp n PRO 41 N 4.23 1.05 -1.15 3.54 -0.02 -1.26 -1.61 135.00 139.78 1ngp n PRO 41 Ca -0.12 0.38 -0.05 0.00 -2.02 0.00 0.00 63.50 61.69 1ngp n PRO 41 Cb 0.52 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 1ngp n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngp n GLY 42 N 4.42 0.78 0.00 -1.23 0.00 -1.26 -4.91 105.19 103.00 1ngp n GLY 42 Ca 0.28 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1ngp n GLY 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ngp n ARG 43 N -2.80 -0.11 0.00 1.61 0.00 -0.63 -5.14 116.66 109.58 1ngp n ARG 43 Ca -0.05 -0.22 0.00 0.00 -0.00 0.00 0.00 57.85 57.58 1ngp n ARG 43 Cb 0.18 -0.70 0.00 0.00 0.00 0.00 0.00 32.46 31.94 1ngp n ARG 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ngp n GLY 44 N 0.05 1.62 3.88 5.14 0.00 -1.25 -4.94 105.19 109.69 1ngp n GLY 44 Ca 0.00 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.59 1ngp n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ngp s LEU 45 N 0.00 4.36 -0.06 0.99 1.43 -1.26 -3.26 118.68 120.89 1ngp s LEU 45 Ca 0.00 0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.69 1ngp s LEU 45 Cb 0.00 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.50 1ngp s LEU 45 CO 0.00 0.23 -0.03 -1.61 0.23 0.00 0.00 176.35 175.17 1ngp s GLU 46 N -1.81 0.80 0.18 1.70 2.02 -0.27 -4.96 118.70 116.36 1ngp s GLU 46 Ca 0.29 -0.04 -0.30 0.00 0.02 0.00 0.00 54.97 54.94 1ngp s GLU 46 Cb -0.13 -0.94 -0.08 0.00 0.10 0.00 0.00 34.13 33.08 1ngp s GLU 46 CO 0.17 -0.18 1.19 -0.46 0.02 0.00 0.00 175.26 176.00 1ngp s TRP 47 N 1.36 3.44 -0.19 1.61 -0.00 -1.26 -0.55 118.94 123.34 1ngp s TRP 47 Ca -0.04 1.43 -0.15 0.00 -0.00 0.00 0.00 56.10 57.34 1ngp s TRP 47 Cb -0.13 -3.42 -0.08 0.00 -0.00 0.00 0.00 33.47 29.84 1ngp s TRP 47 CO -0.03 -1.16 -0.23 -0.89 -0.00 0.00 0.00 176.95 174.65 1ngp n ILE 48 N 2.51 1.49 0.00 5.86 5.41 -0.96 -4.70 119.36 128.96 1ngp n ILE 48 Ca 0.04 0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.84 1ngp n ILE 48 Cb 0.45 -2.24 0.00 0.00 -0.71 0.00 0.00 39.64 37.14 1ngp n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ngp n GLY 49 N 1.46 -0.89 3.14 7.39 0.00 -1.25 -0.56 105.19 114.48 1ngp n GLY 49 Ca -0.22 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 1ngp n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ngp s ARG 50 N -2.00 0.74 0.02 1.61 1.04 0.88 -2.30 118.95 118.95 1ngp s ARG 50 Ca 0.00 -1.12 0.05 0.00 -1.04 0.00 0.00 55.73 53.62 1ngp s ARG 50 Cb 0.00 -0.29 -0.02 0.00 -2.04 0.00 0.00 34.95 32.60 1ngp s ARG 50 CO 0.00 0.02 -0.15 -1.50 -0.04 0.00 0.00 175.30 173.64 1ngp s ILE 51 N -2.70 1.15 -0.40 4.99 2.07 -0.03 -1.40 121.20 124.90 1ngp s ILE 51 Ca 0.04 -0.90 -0.16 0.00 -1.41 0.00 0.00 60.65 58.22 1ngp s ILE 51 Cb -0.01 -1.02 0.01 0.00 0.13 0.00 0.00 42.46 41.57 1ngp s ILE 51 CO -0.02 0.11 0.37 -0.62 -1.91 0.00 0.00 174.94 172.87 1ngp s ASP 52 N -0.90 6.16 0.00 4.50 2.15 0.17 -1.77 116.67 126.98 1ngp s ASP 52 Ca 0.03 -0.62 0.08 0.00 0.43 0.00 0.00 52.55 52.48 1ngp s ASP 52 Cb -0.07 -2.20 0.36 0.00 -0.30 0.00 0.00 42.92 40.72 1ngp s ASP 52 CO 0.01 -0.47 1.27 -0.81 -0.17 0.00 0.00 175.17 175.00 1ngp n PRO 53 N 5.40 0.00 0.00 4.34 -0.04 -1.26 -0.28 135.00 143.17 1ngp n PRO 53 Ca -0.09 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1ngp n PRO 53 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1ngp n PRO 53 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ngp n ASN 54 N -1.49 0.00 0.01 3.54 5.15 -1.26 -4.38 115.26 116.83 1ngp n ASN 54 Ca 0.02 0.45 0.13 0.00 -0.60 0.00 0.00 54.58 54.58 1ngp n ASN 54 Cb 0.10 -0.30 0.48 0.00 -0.53 0.00 0.00 39.78 39.52 1ngp n ASN 54 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1ngp n SER 55 N -1.40 0.23 0.00 1.20 3.41 -1.24 -4.95 113.62 110.88 1ngp n SER 55 Ca 0.00 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1ngp n SER 55 Cb 0.00 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 1ngp n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ngp n GLY 56 N 1.48 0.58 3.77 5.00 0.00 0.61 -5.02 105.19 111.61 1ngp n GLY 56 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1ngp n GLY 56 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ngp s GLY 57 N -2.00 2.92 0.24 -0.02 0.00 -1.24 -4.71 107.32 102.51 1ngp s GLY 57 Ca 0.00 0.66 0.07 0.00 0.00 0.00 0.00 44.72 45.45 1ngp s GLY 57 CO 0.00 1.17 -0.09 -0.51 0.00 0.00 0.00 173.10 173.67 1ngp s THR 58 N -1.43 1.62 -0.05 0.90 -4.23 -1.26 0.43 115.64 111.62 1ngp s THR 58 Ca 0.48 -2.15 -0.02 0.00 -1.18 0.00 0.00 61.69 58.83 1ngp s THR 58 Cb -0.24 -2.28 0.04 0.00 1.34 0.00 0.00 72.50 71.36 1ngp s THR 58 CO 0.30 -0.42 0.10 -0.54 -0.54 0.00 0.00 174.62 173.52 1ngp s LYS 59 N -3.71 0.03 0.32 3.99 1.02 -0.49 -4.96 119.74 115.93 1ngp s LYS 59 Ca 0.27 0.33 0.10 0.00 0.02 0.00 0.00 55.97 56.69 1ngp s LYS 59 Cb 0.02 -0.24 -0.05 0.00 -0.52 0.00 0.00 37.83 37.04 1ngp s LYS 59 CO 0.10 -0.20 -0.05 0.71 -0.92 0.00 0.00 175.35 174.99 1ngp s TYR 60 N 1.36 2.50 -0.14 3.18 1.51 -1.26 -0.08 117.35 124.41 1ngp s TYR 60 Ca -0.06 -0.39 -0.25 0.00 -1.01 0.00 0.00 57.07 55.35 1ngp s TYR 60 Cb -0.12 -1.33 -0.02 0.00 -0.11 0.00 0.00 41.96 40.38 1ngp s TYR 60 CO -0.05 0.56 0.81 1.21 -1.11 0.00 0.00 175.55 176.98 1ngp s ASN 61 N -3.65 6.98 0.59 2.29 3.84 0.28 -4.89 114.94 120.37 1ngp s ASN 61 Ca 0.33 1.20 0.29 0.00 0.21 0.00 0.00 52.86 54.89 1ngp s ASN 61 Cb -0.02 -2.45 1.39 0.00 -0.55 0.00 0.00 41.25 39.63 1ngp s ASN 61 CO 0.18 -0.34 1.78 -0.33 -2.79 0.00 0.00 177.10 175.61 1ngp h GLU 62 N 7.20 0.00 0.00 0.43 4.39 -1.95 0.45 114.58 125.10 1ngp h GLU 62 Ca -0.32 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.27 1ngp h GLU 62 Cb 1.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.78 1ngp h GLU 62 CO 0.81 0.00 -0.52 -0.22 -1.16 0.00 0.00 179.01 177.93 1ngp h LYS 63 N 0.00 0.00 -0.02 2.33 3.64 -1.94 -3.19 116.57 117.39 1ngp h LYS 63 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1ngp h LYS 63 Cb 1.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 1ngp h LYS 63 CO -0.00 0.52 -0.13 1.19 -2.27 0.00 0.00 179.45 178.75 1ngp n PHE 64 N -3.80 0.00 -0.33 1.91 3.72 0.12 -4.68 117.46 114.40 1ngp n PHE 64 Ca -0.01 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.62 1ngp n PHE 64 Cb 0.55 0.00 0.46 0.00 -0.94 0.00 0.00 39.48 39.55 1ngp n PHE 64 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1ngp h LYS 65 N 3.77 0.24 -0.19 -1.08 1.57 -1.47 0.31 116.57 119.71 1ngp h LYS 65 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1ngp h LYS 65 Cb 0.87 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1ngp h LYS 65 CO 0.00 0.16 0.00 -1.13 -0.57 0.00 0.00 179.45 177.91 1ngp n SER 66 N -5.13 3.03 -0.07 0.86 3.41 -1.26 -4.52 113.62 109.94 1ngp n SER 66 Ca 0.31 -1.91 -0.09 0.00 -0.26 0.00 0.00 58.87 56.91 1ngp n SER 66 Cb 0.99 -0.12 -0.07 0.00 -0.26 0.00 0.00 64.21 64.75 1ngp n SER 66 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1ngp n LYS 67 N 1.25 0.48 -4.14 4.33 3.00 0.80 -4.80 118.16 119.08 1ngp n LYS 67 Ca 0.15 0.07 -0.31 0.00 -0.00 0.00 0.00 58.31 58.22 1ngp n LYS 67 Cb 0.54 -1.28 -0.08 0.00 0.00 0.00 0.00 35.03 34.22 1ngp n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ngp s ALA 68 N -2.28 3.42 -0.14 3.14 0.00 0.36 -2.07 121.76 124.19 1ngp s ALA 68 Ca -0.18 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 1ngp s ALA 68 Cb 0.05 -1.36 0.04 0.00 0.00 0.00 0.00 23.12 21.84 1ngp s ALA 68 CO 0.33 0.70 -0.01 0.99 0.00 0.00 0.00 175.76 177.78 1ngp s THR 69 N -1.26 0.67 0.02 0.00 2.01 -0.10 -4.80 115.64 112.18 1ngp s THR 69 Ca 0.25 -0.34 -0.16 0.00 0.31 0.00 0.00 61.69 61.74 1ngp s THR 69 Cb -0.12 -0.95 -0.06 0.00 0.01 0.00 0.00 72.50 71.39 1ngp s THR 69 CO 0.17 0.07 0.45 -0.76 -0.69 0.00 0.00 174.62 173.86 1ngp s LEU 70 N 1.82 4.48 0.23 4.42 1.43 -1.26 0.06 118.68 129.86 1ngp s LEU 70 Ca 0.02 1.04 -0.09 0.00 -1.03 0.00 0.00 54.13 54.07 1ngp s LEU 70 Cb -0.15 -2.67 -0.01 0.00 0.03 0.00 0.00 46.19 43.38 1ngp s LEU 70 CO -0.07 0.30 0.36 0.42 0.23 0.00 0.00 176.35 177.59 1ngp s THR 71 N -1.02 0.01 -0.01 5.49 -4.23 -0.56 -4.99 115.64 110.33 1ngp s THR 71 Ca 0.25 -1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1ngp s THR 71 Cb -0.17 -2.25 0.01 0.00 1.34 0.00 0.00 72.50 71.43 1ngp s THR 71 CO 0.15 -0.03 0.24 0.54 -0.54 0.00 0.00 174.62 174.98 1ngp s VAL 72 N -4.05 0.07 -0.35 2.29 0.11 -1.26 -1.34 120.40 115.87 1ngp s VAL 72 Ca 0.27 -0.56 0.01 0.00 -2.93 0.00 0.00 61.98 58.77 1ngp s VAL 72 Cb 0.02 -0.54 0.11 0.00 -1.53 0.00 0.00 36.38 34.44 1ngp s VAL 72 CO 0.09 -0.31 0.12 -0.62 -3.33 0.00 0.00 175.10 171.05 1ngp s ASP 73 N -1.35 4.14 0.18 3.54 -1.08 -0.69 -4.99 116.67 116.43 1ngp s ASP 73 Ca -0.14 -1.98 -0.13 0.00 -0.52 0.00 0.00 52.55 49.78 1ngp s ASP 73 Cb -0.06 -1.10 0.17 0.00 -1.46 0.00 0.00 42.92 40.47 1ngp s ASP 73 CO 0.03 -0.38 1.73 0.50 0.52 0.00 0.00 175.17 177.58 1ngp h LYS 74 N 7.69 0.28 -0.29 4.34 3.64 -1.88 -2.69 116.57 127.66 1ngp h LYS 74 Ca -0.09 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.34 1ngp h LYS 74 Cb 1.00 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.69 1ngp h LYS 74 CO 0.49 0.18 -0.16 -1.35 -2.27 0.00 0.00 179.45 176.35 1ngp h PRO 75 N 0.29 -0.12 -0.40 1.90 0.11 -1.97 -2.59 132.00 129.22 1ngp h PRO 75 Ca 0.24 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.35 1ngp h PRO 75 Cb 0.28 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1ngp h PRO 75 CO -0.28 -0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 176.30 1ngp n SER 76 N -5.33 2.04 -4.12 -2.05 3.41 -1.18 -4.96 113.62 101.44 1ngp n SER 76 Ca 0.00 -2.04 -0.34 0.00 -0.26 0.00 0.00 58.87 56.23 1ngp n SER 76 Cb 0.24 -0.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.91 1ngp n SER 76 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ngp n SER 77 N 0.52 -3.54 -4.22 4.04 7.64 -0.98 -4.74 113.62 112.34 1ngp n SER 77 Ca 0.12 -0.94 -0.28 0.00 1.01 0.00 0.00 58.87 58.78 1ngp n SER 77 Cb 0.34 -3.11 -0.16 0.00 -1.01 0.00 0.00 64.21 60.27 1ngp n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ngp s THR 78 N -3.34 1.70 0.04 0.44 2.01 -1.18 0.06 115.64 115.37 1ngp s THR 78 Ca 0.67 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.77 1ngp s THR 78 Cb -0.36 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 1ngp s THR 78 CO 0.90 0.48 0.13 0.00 -0.69 0.00 0.00 174.62 175.44 1ngp s ALA 79 N -0.36 3.75 0.15 7.40 0.00 0.40 -1.70 121.76 131.39 1ngp s ALA 79 Ca 0.04 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.17 1ngp s ALA 79 Cb -0.10 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 1ngp s ALA 79 CO 0.00 0.75 -0.11 0.71 0.00 0.00 0.00 175.76 177.12 1ngp s TYR 80 N -1.35 1.29 -0.07 0.00 1.51 -0.45 -0.72 117.35 117.57 1ngp s TYR 80 Ca 0.29 -0.73 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1ngp s TYR 80 Cb -0.12 -0.66 0.04 0.00 -0.11 0.00 0.00 41.96 41.11 1ngp s TYR 80 CO 0.21 0.10 0.12 1.41 -1.11 0.00 0.00 175.55 176.28 1ngp s MET 81 N -3.64 0.00 0.19 -0.62 -2.45 -0.83 -1.50 119.30 110.46 1ngp s MET 81 Ca 0.16 0.47 -0.01 0.00 -1.25 0.00 0.00 55.69 55.06 1ngp s MET 81 Cb 0.02 -0.33 -0.04 0.00 1.25 0.00 0.00 34.83 35.72 1ngp s MET 81 CO 0.01 -0.29 0.39 -1.14 1.05 0.00 0.00 175.02 175.04 1ngp s GLN 82 N 2.10 3.54 -0.04 4.11 0.74 0.11 -1.25 119.66 128.96 1ngp s GLN 82 Ca 0.02 -0.29 0.00 0.00 0.05 0.00 0.00 55.36 55.14 1ngp s GLN 82 Cb -0.12 -2.84 0.02 0.00 1.10 0.00 0.00 33.01 31.17 1ngp s GLN 82 CO -0.05 0.41 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.57 1ngp s LEU 83 N -3.21 1.17 0.31 3.68 1.43 -0.92 -0.93 118.68 120.22 1ngp s LEU 83 Ca 0.39 -0.10 0.09 0.00 -1.03 0.00 0.00 54.13 53.48 1ngp s LEU 83 Cb -0.11 -0.39 -0.04 0.00 0.03 0.00 0.00 46.19 45.67 1ngp s LEU 83 CO 0.28 -0.09 0.07 -0.94 0.23 0.00 0.00 176.35 175.90 1ngp s SER 84 N 1.11 4.53 -1.37 2.29 1.04 -0.88 -2.48 113.70 117.95 1ngp s SER 84 Ca -0.08 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.46 1ngp s SER 84 Cb -0.14 -0.73 0.01 0.00 0.10 0.00 0.00 66.02 65.26 1ngp s SER 84 CO -0.01 -0.18 0.40 -1.20 0.98 0.00 0.00 173.24 173.22 1ngp n SER 85 N -1.02 -1.47 -4.74 7.02 7.64 -1.04 -4.85 113.62 115.15 1ngp n SER 85 Ca -0.04 -1.17 -0.36 0.00 1.01 0.00 0.00 58.87 58.31 1ngp n SER 85 Cb 0.61 -2.30 0.05 0.00 -1.01 0.00 0.00 64.21 61.55 1ngp n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ngp s LEU 86 N -7.15 3.59 0.14 -3.43 1.43 -0.57 -4.71 118.68 107.98 1ngp s LEU 86 Ca 0.18 2.42 -0.00 0.00 -1.03 0.00 0.00 54.13 55.70 1ngp s LEU 86 Cb -0.09 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 1ngp s LEU 86 CO 0.94 -1.78 0.04 0.42 0.23 0.00 0.00 176.35 176.21 1ngp s THR 87 N -1.63 0.25 0.44 5.49 -4.23 -1.26 0.13 115.64 114.82 1ngp s THR 87 Ca 0.78 -1.93 0.30 0.00 -1.18 0.00 0.00 61.69 59.66 1ngp s THR 87 Cb -0.31 -2.06 0.48 0.00 1.34 0.00 0.00 72.50 71.94 1ngp s THR 87 CO 0.36 -0.47 1.62 0.28 -0.54 0.00 0.00 174.62 175.87 1ngp h SER 88 N 2.82 0.24 0.56 3.99 0.02 -1.98 0.14 113.55 119.34 1ngp h SER 88 Ca -0.35 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1ngp h SER 88 Cb 1.20 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1ngp h SER 88 CO 0.60 -0.20 0.00 -0.33 -1.14 0.00 0.00 176.83 175.77 1ngp h GLU 89 N 0.08 0.00 -0.00 3.45 4.39 -1.96 -2.58 114.58 117.96 1ngp h GLU 89 Ca 0.83 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.53 1ngp h GLU 89 Cb 2.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 31.23 1ngp h GLU 89 CO -0.43 0.00 -0.02 -0.25 -1.16 0.00 0.00 179.01 177.14 1ngp n ASP 90 N -2.65 0.03 -4.69 1.42 8.00 0.48 -4.82 116.55 114.31 1ngp n ASP 90 Ca 0.00 0.34 -0.44 0.00 0.71 0.00 0.00 54.79 55.40 1ngp n ASP 90 Cb 0.19 -0.43 -0.04 0.00 -0.02 0.00 0.00 41.12 40.83 1ngp n ASP 90 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ngp n SER 91 N -1.45 3.46 0.00 -2.24 7.64 -0.97 -4.87 113.62 115.19 1ngp n SER 91 Ca 0.08 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1ngp n SER 91 Cb 0.32 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.03 1ngp n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ngp n ALA 92 N 3.60 0.00 -2.91 -0.43 0.00 -0.96 -4.93 120.51 114.88 1ngp n ALA 92 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.27 1ngp n ALA 92 Cb 0.31 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.64 1ngp n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ngp s VAL 93 N -2.30 3.53 -0.23 0.00 1.01 -0.71 -0.40 120.40 121.30 1ngp s VAL 93 Ca 0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.48 1ngp s VAL 93 Cb 0.00 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 33.90 1ngp s VAL 93 CO 0.00 0.53 -0.11 -0.31 0.00 0.00 0.00 175.10 175.21 1ngp s TYR 94 N 0.10 2.99 0.15 5.22 2.02 -0.34 -0.97 117.35 126.52 1ngp s TYR 94 Ca -0.03 -1.64 0.02 0.00 -0.37 0.00 0.00 57.07 55.05 1ngp s TYR 94 Cb -0.14 -2.00 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 1ngp s TYR 94 CO 0.04 -0.76 0.29 0.71 -1.57 0.00 0.00 175.55 174.26 1ngp s TYR 95 N 1.30 3.49 -0.03 2.71 2.02 -0.42 -1.72 117.35 124.70 1ngp s TYR 95 Ca 0.01 0.14 0.07 0.00 -0.37 0.00 0.00 57.07 56.91 1ngp s TYR 95 Cb -0.16 -1.68 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 1ngp s TYR 95 CO -0.07 0.51 -0.23 0.00 -1.57 0.00 0.00 175.55 174.18 1ngp s ALA 97 N -0.43 0.29 0.03 0.00 0.00 -0.19 -0.10 121.76 121.37 1ngp s ALA 97 Ca 0.05 -0.43 -0.12 0.00 0.00 0.00 0.00 51.96 51.47 1ngp s ALA 97 Cb -0.10 0.03 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 1ngp s ALA 97 CO 0.00 -0.02 0.39 0.50 0.00 0.00 0.00 175.76 176.63 1ngp s ARG 98 N -0.87 3.82 -0.12 0.00 3.52 -0.72 -0.26 118.95 124.31 1ngp s ARG 98 Ca -0.07 0.28 0.01 0.00 -0.13 0.00 0.00 55.73 55.82 1ngp s ARG 98 Cb -0.06 -3.12 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 1ngp s ARG 98 CO -0.00 0.64 -0.12 -0.47 -0.81 0.00 0.00 175.30 174.54 1ngp s TYR 99 N -1.21 1.86 -1.35 5.12 5.04 0.18 -2.88 117.35 124.10 1ngp s TYR 99 Ca 0.27 -0.95 -0.16 0.00 -2.44 0.00 0.00 57.07 53.79 1ngp s TYR 99 Cb -0.15 -1.41 0.03 0.00 0.35 0.00 0.00 41.96 40.79 1ngp s TYR 99 CO 0.15 -0.55 2.03 -3.47 -1.34 0.00 0.00 175.55 172.37 1ngp n ASP 100 N 4.62 4.15 -0.19 4.32 2.03 -0.70 -1.67 116.55 129.10 1ngp n ASP 100 Ca -0.17 -2.85 -0.07 0.00 0.52 0.00 0.00 54.79 52.22 1ngp n ASP 100 Cb 0.50 -1.66 0.02 0.00 -0.72 0.00 0.00 41.12 39.26 1ngp n ASP 100 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1ngp h TYR 101 N 6.80 0.78 0.00 -0.67 3.20 -1.88 -1.06 116.97 124.14 1ngp h TYR 101 Ca 0.51 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.35 1ngp h TYR 101 Cb 0.73 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.76 1ngp h TYR 101 CO 1.43 0.58 0.00 0.66 -1.64 0.00 0.00 178.16 179.19 1ngp n TYR 102 N -4.59 0.32 0.00 -3.82 4.01 -1.26 -4.68 117.16 107.14 1ngp n TYR 102 Ca 0.03 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 1ngp n TYR 102 Cb 0.10 -0.66 0.00 0.00 -0.31 0.00 0.00 39.34 38.46 1ngp n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ngp n GLY 103 N 1.10 0.81 0.61 2.72 0.00 -1.11 -5.01 105.19 104.30 1ngp n GLY 103 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 1ngp n GLY 103 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ngp n SER 104 N 0.00 1.98 -2.29 1.61 7.64 -1.23 -5.00 113.62 116.32 1ngp n SER 104 Ca 0.00 -1.59 -0.11 0.00 1.01 0.00 0.00 58.87 58.18 1ngp n SER 104 Cb 0.00 0.06 0.05 0.00 -1.01 0.00 0.00 64.21 63.31 1ngp n SER 104 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ngp n SER 105 N 0.44 -2.97 -4.20 6.43 7.64 -0.42 -5.05 113.62 115.49 1ngp n SER 105 Ca 0.16 -0.33 -0.18 0.00 1.01 0.00 0.00 58.87 59.53 1ngp n SER 105 Cb 0.44 -3.04 -0.12 0.00 -1.01 0.00 0.00 64.21 60.49 1ngp n SER 105 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1ngp s TYR 106 N -3.19 1.31 -1.29 1.43 -0.85 -1.26 -4.90 117.35 108.59 1ngp s TYR 106 Ca 0.13 -0.51 -0.16 0.00 -0.52 0.00 0.00 57.07 56.02 1ngp s TYR 106 Cb -0.06 -0.71 0.11 0.00 0.38 0.00 0.00 41.96 41.68 1ngp s TYR 106 CO 0.40 0.09 1.71 1.19 -1.52 0.00 0.00 175.55 177.43 1ngp n PHE 107 N 0.94 4.51 0.18 -3.49 3.72 -1.26 -1.72 117.46 120.34 1ngp n PHE 107 Ca -0.19 -3.02 -0.07 0.00 -0.05 0.00 0.00 57.45 54.13 1ngp n PHE 107 Cb 0.55 -2.44 -0.03 0.00 -0.94 0.00 0.00 39.48 36.62 1ngp n PHE 107 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 1ngp h ASP 108 N 7.12 -0.39 -3.11 4.37 3.04 -1.93 -3.46 116.42 122.05 1ngp h ASP 108 Ca 0.42 0.01 -0.67 0.00 -3.24 0.00 0.00 57.03 53.55 1ngp h ASP 108 Cb 0.83 0.10 -0.12 0.00 -1.04 0.00 0.00 39.33 39.10 1ngp h ASP 108 CO 1.45 -0.20 -0.58 -0.31 -2.04 0.00 0.00 179.24 177.57 1ngp s TYR 109 N -3.45 3.30 0.21 4.15 2.02 -1.26 -5.00 117.35 117.33 1ngp s TYR 109 Ca -0.07 0.28 0.10 0.00 -0.37 0.00 0.00 57.07 57.01 1ngp s TYR 109 Cb 0.01 -1.82 -0.05 0.00 -0.40 0.00 0.00 41.96 39.70 1ngp s TYR 109 CO 0.20 0.55 -0.18 -1.58 -1.57 0.00 0.00 175.55 172.98 1ngp s TRP 110 N -0.98 1.97 0.72 2.71 0.52 -1.26 -1.76 118.94 120.86 1ngp s TRP 110 Ca 0.15 -0.45 -0.09 0.00 0.02 0.00 0.00 56.10 55.73 1ngp s TRP 110 Cb -0.12 -0.92 0.05 0.00 -1.15 0.00 0.00 33.47 31.33 1ngp s TRP 110 CO 0.05 0.47 1.07 0.20 0.02 0.00 0.00 176.95 178.76 1ngp s GLY 111 N -3.12 1.63 0.00 0.98 0.00 0.86 -4.69 107.32 102.97 1ngp s GLY 111 Ca 0.22 -0.66 0.30 0.00 0.00 0.00 0.00 44.72 44.59 1ngp s GLY 111 CO 0.09 -0.25 2.02 0.61 0.00 0.00 0.00 173.10 175.57 1ngp n GLN 112 N -3.02 0.87 -0.38 2.90 10.64 -1.26 -4.74 117.38 122.39 1ngp n GLN 112 Ca 0.07 -0.19 0.00 0.00 -1.83 0.00 0.00 57.00 55.05 1ngp n GLN 112 Cb 0.59 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.48 1ngp n GLN 112 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ngp n GLY 113 N 1.16 -3.13 3.28 2.61 0.00 -1.26 -4.97 105.19 102.89 1ngp n GLY 113 Ca 0.18 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 1ngp n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ngp s THR 114 N -4.19 2.89 -0.50 2.61 2.01 -0.70 -4.66 115.64 113.11 1ngp s THR 114 Ca 0.00 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 61.08 1ngp s THR 114 Cb 0.00 -2.25 0.03 0.00 0.01 0.00 0.00 72.50 70.29 1ngp s THR 114 CO 0.00 0.49 0.91 -0.89 -0.69 0.00 0.00 174.62 174.44 1ngp s THR 115 N 1.00 4.46 -0.10 -0.82 2.01 -0.53 -1.20 115.64 120.46 1ngp s THR 115 Ca -0.01 0.47 -0.13 0.00 0.31 0.00 0.00 61.69 62.33 1ngp s THR 115 Cb -0.15 -4.47 -0.05 0.00 0.01 0.00 0.00 72.50 67.85 1ngp s THR 115 CO -0.02 -0.95 0.29 -0.22 -0.69 0.00 0.00 174.62 173.04 1ngp s LEU 116 N 3.77 4.35 -0.15 4.42 2.96 0.46 -1.74 118.68 132.75 1ngp s LEU 116 Ca 0.33 0.64 0.02 0.00 -0.22 0.00 0.00 54.13 54.89 1ngp s LEU 116 Cb -0.12 -2.37 0.01 0.00 0.50 0.00 0.00 46.19 44.22 1ngp s LEU 116 CO 0.22 0.24 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.40 1ngp s THR 117 N -0.34 1.99 -0.27 3.68 2.01 -0.81 -2.25 115.64 119.65 1ngp s THR 117 Ca 0.18 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.23 1ngp s THR 117 Cb -0.14 -1.78 0.02 0.00 0.01 0.00 0.00 72.50 70.61 1ngp s THR 117 CO 0.07 0.53 0.00 -0.69 -0.69 0.00 0.00 174.62 173.84 1ngp s VAL 118 N 1.03 3.34 -0.03 3.82 1.01 -1.26 -1.73 120.40 126.58 1ngp s VAL 118 Ca -0.02 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1ngp s VAL 118 Cb -0.14 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.54 1ngp s VAL 118 CO -0.06 0.13 0.26 -0.55 0.00 0.00 0.00 175.10 174.88 1ngp s SER 119 N 1.39 -0.15 0.00 3.32 0.15 -0.66 -4.28 113.70 113.47 1ngp s SER 119 Ca 0.01 0.11 0.24 0.00 0.70 0.00 0.00 55.95 57.01 1ngp s SER 119 Cb -0.17 0.34 0.15 0.00 -1.71 0.00 0.00 66.02 64.63 1ngp s SER 119 CO -0.01 -0.35 1.21 -1.54 1.20 0.00 0.00 173.24 173.75 1ngp n SER 120 N 1.68 2.45 -4.77 5.45 3.41 -1.26 -4.28 113.62 116.30 1ngp n SER 120 Ca -0.20 -1.73 -0.38 0.00 -0.26 0.00 0.00 58.87 56.30 1ngp n SER 120 Cb 0.56 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.71 1ngp n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ngp s ALA 121 N -2.23 3.16 0.47 7.33 0.00 -1.26 -5.06 121.76 124.17 1ngp s ALA 121 Ca 0.24 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1ngp s ALA 121 Cb 0.19 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1ngp s ALA 121 CO 0.43 -0.44 0.70 0.15 0.00 0.00 0.00 175.76 176.60 1ngp s LYS 122 N -2.28 2.95 -0.14 0.00 -0.14 -1.26 -4.98 119.74 113.89 1ngp s LYS 122 Ca 0.56 -0.54 -0.34 0.00 -1.36 0.00 0.00 55.97 54.29 1ngp s LYS 122 Cb -0.29 -2.54 -0.11 0.00 -1.68 0.00 0.00 37.83 33.21 1ngp s LYS 122 CO 0.36 -0.37 1.94 2.41 -0.76 0.00 0.00 175.35 178.94 1ngp n THR 123 N -2.14 0.51 -4.42 2.17 -1.04 -1.26 -4.69 114.28 103.40 1ngp n THR 123 Ca 0.03 -0.15 -0.20 0.00 -2.04 0.00 0.00 64.05 61.69 1ngp n THR 123 Cb 0.58 -1.87 -0.15 0.00 -1.82 0.00 0.00 70.33 67.07 1ngp n THR 123 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ngp s THR 124 N 4.79 0.80 0.19 12.58 2.01 0.14 -4.97 115.64 131.18 1ngp s THR 124 Ca 0.96 -0.41 -0.10 0.00 0.31 0.00 0.00 61.69 62.45 1ngp s THR 124 Cb -0.70 -0.69 -0.07 0.00 0.01 0.00 0.00 72.50 71.05 1ngp s THR 124 CO 0.51 0.24 0.51 -2.16 -0.69 0.00 0.00 174.62 173.02 1ngp s PRO 125 N -0.07 3.79 0.80 4.92 0.04 -1.26 -1.02 135.00 142.21 1ngp s PRO 125 Ca 0.01 0.24 -0.11 0.00 0.04 0.00 0.00 61.00 61.18 1ngp s PRO 125 Cb -0.06 -2.75 0.08 0.00 0.04 0.00 0.00 34.50 31.81 1ngp s PRO 125 CO -0.00 0.39 1.11 -1.25 0.04 0.00 0.00 177.00 177.29 1ngp s PRO 126 N -2.59 1.97 -0.24 0.56 0.04 -1.26 -4.66 135.00 128.82 1ngp s PRO 126 Ca 0.44 1.30 -0.04 0.00 0.04 0.00 0.00 61.00 62.74 1ngp s PRO 126 Cb -0.12 -1.85 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 1ngp s PRO 126 CO 0.21 -1.88 -0.02 -1.12 0.04 0.00 0.00 177.00 174.24 1ngp s SER 127 N -3.10 4.51 -0.09 6.66 0.01 -0.52 -4.95 113.70 116.22 1ngp s SER 127 Ca 0.63 -0.51 -0.17 0.00 1.31 0.00 0.00 55.95 57.21 1ngp s SER 127 Cb -0.19 -1.77 -0.05 0.00 0.21 0.00 0.00 66.02 64.23 1ngp s SER 127 CO 0.55 -0.07 0.46 -0.69 0.41 0.00 0.00 173.24 173.90 1ngp s VAL 128 N 1.47 5.14 -0.05 3.43 1.01 -1.26 -2.03 120.40 128.11 1ngp s VAL 128 Ca 0.04 0.93 0.05 0.00 0.00 0.00 0.00 61.98 63.00 1ngp s VAL 128 Cb -0.15 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 1ngp s VAL 128 CO -0.02 0.39 -0.19 -0.31 0.00 0.00 0.00 175.10 174.96 1ngp s TYR 129 N 0.21 1.96 0.34 5.22 2.02 -0.47 -4.96 117.35 121.67 1ngp s TYR 129 Ca 0.25 -0.61 -0.28 0.00 -0.37 0.00 0.00 57.07 56.06 1ngp s TYR 129 Cb -0.16 -1.31 -0.10 0.00 -0.40 0.00 0.00 41.96 39.99 1ngp s TYR 129 CO 0.11 -0.21 1.30 -1.25 -1.57 0.00 0.00 175.55 173.93 1ngp s PRO 130 N 0.06 4.32 -0.53 -1.71 0.04 -1.26 -1.49 135.00 134.44 1ngp s PRO 130 Ca -0.06 2.20 0.03 0.00 0.04 0.00 0.00 61.00 63.22 1ngp s PRO 130 Cb -0.13 -3.04 0.13 0.00 0.04 0.00 0.00 34.50 31.50 1ngp s PRO 130 CO 0.03 -0.21 0.27 -0.51 0.04 0.00 0.00 177.00 176.63 1ngp s LEU 131 N -1.86 4.43 0.05 -3.56 1.43 -0.33 -4.88 118.68 113.96 1ngp s LEU 131 Ca 0.50 -2.97 -0.00 0.00 -1.03 0.00 0.00 54.13 50.62 1ngp s LEU 131 Cb -0.39 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1ngp s LEU 131 CO 0.52 -0.25 0.20 0.00 0.23 0.00 0.00 176.35 177.05 1ngp s ALA 132 N -0.23 3.99 0.71 4.21 0.00 -1.26 -1.06 121.76 128.12 1ngp s ALA 132 Ca 0.17 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.29 1ngp s ALA 132 Cb -0.25 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1ngp s ALA 132 CO -0.01 0.81 0.00 -2.30 0.00 0.00 0.00 175.76 174.27 1ngp n PRO 133 N 0.40 2.33 0.00 0.00 -0.02 -1.26 -4.95 135.00 131.50 1ngp n PRO 133 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1ngp n PRO 133 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 1ngp n PRO 133 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngp n GLY 134 N 0.19 -1.85 0.00 -1.23 0.00 -1.26 -4.84 105.19 96.19 1ngp n GLY 134 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 46.02 46.87 1ngp n GLY 134 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ngp n SER 135 N 0.00 0.00 0.00 1.61 2.88 -1.26 -5.23 113.62 111.62 1ngp n SER 135 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ngp n SER 135 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ngp n SER 135 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ngp n SER 141 N 0.00 0.00 -4.87 -3.46 2.88 -1.26 -5.25 113.62 101.66 1ngp n SER 141 Ca 0.00 0.14 -0.24 0.00 -1.33 0.00 0.00 58.87 57.44 1ngp n SER 141 Cb 0.00 -0.05 -0.04 0.00 -0.75 0.00 0.00 64.21 63.37 1ngp n SER 141 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1ngp s MET 142 N -2.15 3.13 -0.04 -1.46 -1.94 -1.26 -2.63 119.30 112.95 1ngp s MET 142 Ca 0.00 -0.84 0.03 0.00 -1.71 0.00 0.00 55.69 53.17 1ngp s MET 142 Cb 0.00 -2.74 0.00 0.00 2.01 0.00 0.00 34.83 34.10 1ngp s MET 142 CO 0.00 0.46 -0.13 0.54 -0.01 0.00 0.00 175.02 175.88 1ngp s VAL 143 N -1.91 1.12 -0.02 -6.03 0.11 0.44 -4.80 120.40 109.31 1ngp s VAL 143 Ca 0.33 -0.53 -0.14 0.00 -2.93 0.00 0.00 61.98 58.71 1ngp s VAL 143 Cb -0.09 -0.99 -0.05 0.00 -1.53 0.00 0.00 36.38 33.71 1ngp s VAL 143 CO 0.26 0.34 0.37 -0.89 -3.33 0.00 0.00 175.10 171.85 1ngp s THR 144 N 0.24 5.10 0.24 5.04 2.01 -1.26 -2.11 115.64 124.89 1ngp s THR 144 Ca -0.06 0.76 0.08 0.00 0.31 0.00 0.00 61.69 62.78 1ngp s THR 144 Cb -0.11 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 1ngp s THR 144 CO 0.02 0.57 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.63 1ngp s LEU 145 N -0.98 2.54 0.00 4.42 1.43 0.16 -4.59 118.68 121.67 1ngp s LEU 145 Ca 0.23 -1.07 -0.10 0.00 -1.03 0.00 0.00 54.13 52.16 1ngp s LEU 145 Cb -0.16 -0.73 0.04 0.00 0.03 0.00 0.00 46.19 45.37 1ngp s LEU 145 CO 0.12 -0.18 0.61 0.61 0.23 0.00 0.00 176.35 177.73 1ngp n GLY 146 N -0.47 1.40 3.53 -3.19 0.00 -0.22 -0.13 105.19 106.11 1ngp n GLY 146 Ca -0.07 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 1ngp n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngp s LEU 148 N 0.56 4.09 -0.67 0.00 2.96 -0.55 -1.95 118.68 123.11 1ngp s LEU 148 Ca -0.02 0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 53.98 1ngp s LEU 148 Cb -0.05 -2.17 0.17 0.00 0.50 0.00 0.00 46.19 44.65 1ngp s LEU 148 CO -0.03 0.01 0.51 -0.69 -1.32 0.00 0.00 176.35 174.84 1ngp s VAL 149 N 1.30 4.05 -0.13 1.68 1.01 0.24 -1.37 120.40 127.18 1ngp s VAL 149 Ca 0.09 -2.95 -0.06 0.00 0.00 0.00 0.00 61.98 59.06 1ngp s VAL 149 Cb -0.14 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1ngp s VAL 149 CO 0.07 -0.91 0.10 -0.75 0.00 0.00 0.00 175.10 173.60 1ngp s LYS 150 N -0.11 3.50 -0.62 2.72 2.20 -0.86 -0.40 119.74 126.17 1ngp s LYS 150 Ca 0.18 -0.22 -0.08 0.00 -0.36 0.00 0.00 55.97 55.49 1ngp s LYS 150 Cb -0.18 -3.14 0.01 0.00 -1.51 0.00 0.00 37.83 33.01 1ngp s LYS 150 CO -0.04 0.65 0.66 0.41 -0.36 0.00 0.00 175.35 176.66 1ngp n GLY 151 N 2.38 -1.22 3.39 5.54 0.00 0.19 -1.44 105.19 114.04 1ngp n GLY 151 Ca -0.19 0.81 -0.20 0.00 0.00 0.00 0.00 46.02 46.44 1ngp n GLY 151 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ngp s TYR 152 N -2.80 1.84 -0.29 1.61 -0.85 -0.45 -4.32 117.35 112.10 1ngp s TYR 152 Ca 0.11 -0.68 -0.18 0.00 -0.52 0.00 0.00 57.07 55.79 1ngp s TYR 152 Cb -0.03 -1.00 0.14 0.00 0.38 0.00 0.00 41.96 41.45 1ngp s TYR 152 CO 0.77 0.27 0.98 0.12 -1.52 0.00 0.00 175.55 176.17 1ngp s PHE 153 N -3.04 -0.57 0.00 -3.49 2.19 -0.19 -1.29 117.98 111.59 1ngp s PHE 153 Ca 0.27 1.19 0.00 0.00 0.33 0.00 0.00 56.93 58.72 1ngp s PHE 153 Cb 0.03 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.10 1ngp s PHE 153 CO 0.10 -0.28 0.00 -0.35 1.83 0.00 0.00 175.22 176.52 1ngp n PRO 154 N 3.36 1.91 -3.49 10.12 -0.05 -1.26 0.27 135.00 145.86 1ngp n PRO 154 Ca -0.17 0.00 -0.33 0.00 -0.05 0.00 0.00 63.50 62.95 1ngp n PRO 154 Cb 0.57 0.00 -0.05 0.00 -0.05 0.00 0.00 33.50 33.97 1ngp n PRO 154 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 1ngp s GLU 155 N 0.50 3.78 0.31 0.54 0.41 -1.26 -4.77 118.70 118.21 1ngp s GLU 155 Ca 0.00 0.21 0.01 0.00 -0.41 0.00 0.00 54.97 54.78 1ngp s GLU 155 Cb 0.00 -2.77 0.01 0.00 -1.78 0.00 0.00 34.13 29.59 1ngp s GLU 155 CO 0.00 0.40 0.11 -0.35 -0.49 0.00 0.00 175.26 174.93 1ngp n PRO 156 N 0.17 1.15 -4.42 0.39 -0.04 -1.26 -4.96 135.00 126.03 1ngp n PRO 156 Ca -0.02 -2.13 -0.24 0.00 -0.04 0.00 0.00 63.50 61.07 1ngp n PRO 156 Cb 0.52 0.42 -0.11 0.00 -0.04 0.00 0.00 33.50 34.29 1ngp n PRO 156 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ngp s VAL 157 N -1.87 2.26 -0.11 0.52 -7.23 -1.26 -4.35 120.40 108.37 1ngp s VAL 157 Ca 0.08 -2.19 0.03 0.00 -1.81 0.00 0.00 61.98 58.09 1ngp s VAL 157 Cb -0.01 -2.15 -0.00 0.00 0.56 0.00 0.00 36.38 34.78 1ngp s VAL 157 CO 0.05 -0.31 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.43 1ngp s THR 158 N -2.21 2.37 -0.05 5.32 2.01 0.25 -4.95 115.64 118.38 1ngp s THR 158 Ca 0.24 -0.91 0.06 0.00 0.31 0.00 0.00 61.69 61.39 1ngp s THR 158 Cb -0.06 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.51 1ngp s THR 158 CO 0.11 0.55 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.67 1ngp s VAL 159 N 0.34 1.86 0.06 3.82 1.01 -1.26 -0.59 120.40 125.64 1ngp s VAL 159 Ca -0.16 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 60.87 1ngp s VAL 159 Cb -0.17 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 1ngp s VAL 159 CO 0.08 0.52 -0.07 -0.89 0.00 0.00 0.00 175.10 174.74 1ngp s THR 160 N -0.15 0.53 -0.12 3.92 2.01 -0.76 -4.97 115.64 116.10 1ngp s THR 160 Ca -0.02 -1.42 0.01 0.00 0.31 0.00 0.00 61.69 60.57 1ngp s THR 160 Cb -0.13 -1.03 -0.01 0.00 0.01 0.00 0.00 72.50 71.34 1ngp s THR 160 CO 0.03 -0.61 -0.17 0.26 -0.69 0.00 0.00 174.62 173.44 1ngp s TRP 161 N -2.38 2.73 -1.45 4.92 0.52 -1.26 -0.46 118.94 121.57 1ngp s TRP 161 Ca -0.01 -0.74 -0.02 0.00 0.02 0.00 0.00 56.10 55.35 1ngp s TRP 161 Cb -0.03 -1.79 0.01 0.00 -1.15 0.00 0.00 33.47 30.51 1ngp s TRP 161 CO -0.02 -0.25 0.40 0.09 0.02 0.00 0.00 176.95 177.18 1ngp n ASN 162 N 3.46 -0.40 -1.84 2.95 3.02 -0.22 -0.52 115.26 121.70 1ngp n ASN 162 Ca -0.18 -1.04 -0.12 0.00 -0.03 0.00 0.00 54.58 53.21 1ngp n ASN 162 Cb 0.53 -2.84 -0.03 0.00 -0.61 0.00 0.00 39.78 36.83 1ngp n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ngp n SER 163 N -2.95 -3.35 0.00 6.41 7.64 -1.26 -2.06 113.62 118.06 1ngp n SER 163 Ca -0.28 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1ngp n SER 163 Cb 0.67 -3.03 0.00 0.00 -1.01 0.00 0.00 64.21 60.85 1ngp n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ngp n GLY 164 N -0.47 2.10 0.34 0.23 0.00 0.32 -4.98 105.19 102.73 1ngp n GLY 164 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.86 1ngp n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ngp h SER 165 N 0.00 1.00 -2.86 1.61 0.02 -1.39 -3.23 113.55 108.70 1ngp h SER 165 Ca 0.00 -0.12 -0.75 0.00 -0.84 0.00 0.00 61.79 60.08 1ngp h SER 165 Cb 0.00 -0.26 -0.22 0.00 0.14 0.00 0.00 62.40 62.07 1ngp h SER 165 CO 0.00 0.85 0.77 -0.76 -1.14 0.00 0.00 176.83 176.55 1ngp s LEU 166 N -9.70 5.67 -0.01 5.07 1.43 -1.15 -4.66 118.68 115.34 1ngp s LEU 166 Ca -0.12 -2.82 0.12 0.00 -1.03 0.00 0.00 54.13 50.29 1ngp s LEU 166 Cb 0.16 -2.32 -0.16 0.00 0.03 0.00 0.00 46.19 43.90 1ngp s LEU 166 CO 0.82 -0.69 0.39 -1.54 0.23 0.00 0.00 176.35 175.55 1ngp n SER 167 N 4.91 1.38 -4.79 2.29 3.41 -1.22 -4.02 113.62 115.58 1ngp n SER 167 Ca 0.26 -0.39 -0.36 0.00 -0.26 0.00 0.00 58.87 58.12 1ngp n SER 167 Cb 0.44 1.28 -0.08 0.00 -0.26 0.00 0.00 64.21 65.59 1ngp n SER 167 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1ngp s SER 168 N -2.75 5.95 -0.71 4.04 0.01 -1.26 -4.40 113.70 114.58 1ngp s SER 168 Ca 0.00 0.32 -0.02 0.00 1.31 0.00 0.00 55.95 57.56 1ngp s SER 168 Cb 0.08 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 64.43 1ngp s SER 168 CO 0.50 0.36 0.60 0.61 0.41 0.00 0.00 173.24 175.72 1ngp n GLY 169 N 2.28 0.03 3.32 3.44 0.00 -1.26 -4.70 105.19 108.30 1ngp n GLY 169 Ca -0.19 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1ngp n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ngp s VAL 170 N -3.20 2.67 -0.12 1.61 1.01 -1.26 -2.50 120.40 118.61 1ngp s VAL 170 Ca 0.11 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1ngp s VAL 170 Cb -0.05 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.27 1ngp s VAL 170 CO 0.41 0.54 -0.14 -1.00 0.00 0.00 0.00 175.10 174.91 1ngp s HIS 171 N 0.26 2.01 -0.24 5.22 3.76 -0.29 -5.00 115.29 121.01 1ngp s HIS 171 Ca -0.12 -1.02 -0.01 0.00 -0.15 0.00 0.00 55.06 53.76 1ngp s HIS 171 Cb -0.16 -1.47 0.02 0.00 1.11 0.00 0.00 32.58 32.08 1ngp s HIS 171 CO 0.06 -0.55 -0.07 0.99 -0.85 0.00 0.00 174.74 174.33 1ngp s THR 172 N 1.20 2.83 0.71 1.30 2.01 -1.26 -1.06 115.64 121.37 1ngp s THR 172 Ca -0.02 -1.01 -0.11 0.00 0.31 0.00 0.00 61.69 60.85 1ngp s THR 172 Cb -0.14 -2.42 0.01 0.00 0.01 0.00 0.00 72.50 69.96 1ngp s THR 172 CO -0.05 0.22 1.09 -0.36 -0.69 0.00 0.00 174.62 174.83 1ngp s PHE 173 N 1.32 3.30 0.64 4.92 0.40 0.12 -4.99 117.98 123.70 1ngp s PHE 173 Ca 0.00 1.10 -0.14 0.00 -0.60 0.00 0.00 56.93 57.29 1ngp s PHE 173 Cb -0.16 -3.03 -0.01 0.00 0.51 0.00 0.00 43.02 40.33 1ngp s PHE 173 CO -0.05 -1.19 1.07 -2.14 0.70 0.00 0.00 175.22 173.61 1ngp s PRO 174 N -5.31 3.04 0.15 0.24 0.02 -1.26 -4.50 135.00 127.39 1ngp s PRO 174 Ca 0.58 1.20 -0.06 0.00 0.02 0.00 0.00 61.00 62.73 1ngp s PRO 174 Cb -0.11 -1.99 -0.06 0.00 0.02 0.00 0.00 34.50 32.35 1ngp s PRO 174 CO 0.52 -1.03 0.41 0.00 -0.33 0.00 0.00 177.00 176.57 1ngp s ALA 175 N -2.58 3.74 -0.20 -1.55 0.00 -1.26 -4.77 121.76 115.15 1ngp s ALA 175 Ca 0.63 -0.49 -0.04 0.00 0.00 0.00 0.00 51.96 52.06 1ngp s ALA 175 Cb -0.17 -2.20 -0.02 0.00 0.00 0.00 0.00 23.12 20.74 1ngp s ALA 175 CO 0.43 0.63 -0.02 0.14 0.00 0.00 0.00 175.76 176.94 1ngp s VAL 176 N -1.66 3.70 -0.49 0.00 -7.23 -0.76 -4.93 120.40 109.03 1ngp s VAL 176 Ca 0.41 -0.40 -0.29 0.00 -1.81 0.00 0.00 61.98 59.90 1ngp s VAL 176 Cb -0.12 -2.67 0.03 0.00 0.56 0.00 0.00 36.38 34.18 1ngp s VAL 176 CO 0.23 0.43 1.13 -0.22 -0.31 0.00 0.00 175.10 176.37 1ngp s LEU 177 N 1.11 3.63 -0.30 1.32 1.98 -1.26 -2.25 118.68 122.91 1ngp s LEU 177 Ca 0.02 0.40 0.02 0.00 -2.89 0.00 0.00 54.13 51.68 1ngp s LEU 177 Cb -0.14 -3.49 0.07 0.00 0.66 0.00 0.00 46.19 43.29 1ngp s LEU 177 CO 0.01 -1.27 -0.01 -1.10 -1.89 0.00 0.00 176.35 172.08 1ngp s GLN 178 N 4.48 2.05 -1.12 1.98 -0.21 0.78 -4.82 119.66 122.79 1ngp s GLN 178 Ca 0.47 -1.52 -0.16 0.00 0.02 0.00 0.00 55.36 54.17 1ngp s GLN 178 Cb -0.07 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 30.81 1ngp s GLN 178 CO 0.31 -0.73 0.83 0.43 -2.12 0.00 0.00 175.29 174.01 1ngp n SER 179 N 4.44 -5.58 0.00 5.90 7.64 -1.26 -2.75 113.62 122.01 1ngp n SER 179 Ca -0.08 -0.92 0.00 0.00 1.01 0.00 0.00 58.87 58.88 1ngp n SER 179 Cb 0.42 -3.93 0.00 0.00 -1.01 0.00 0.00 64.21 59.69 1ngp n SER 179 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ngp n ASP 180 N -2.85 0.00 -4.26 6.43 8.00 -1.26 -4.95 116.55 117.67 1ngp n ASP 180 Ca -0.09 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.13 1ngp n ASP 180 Cb 0.60 -1.89 -0.15 0.00 -0.02 0.00 0.00 41.12 39.66 1ngp n ASP 180 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ngp s LEU 181 N 0.00 2.09 0.55 0.64 1.02 -1.11 -4.66 118.68 117.21 1ngp s LEU 181 Ca 0.00 -0.45 -0.01 0.00 0.02 0.00 0.00 54.13 53.69 1ngp s LEU 181 Cb 0.00 -1.11 0.03 0.00 0.02 0.00 0.00 46.19 45.13 1ngp s LEU 181 CO 0.00 0.24 0.80 -0.31 0.02 0.00 0.00 176.35 177.10 1ngp s TYR 182 N -0.62 3.00 -0.07 0.29 1.51 -0.42 -0.16 117.35 120.88 1ngp s TYR 182 Ca 0.09 0.19 -0.06 0.00 -1.01 0.00 0.00 57.07 56.28 1ngp s TYR 182 Cb -0.09 -2.71 0.02 0.00 -0.11 0.00 0.00 41.96 39.07 1ngp s TYR 182 CO 0.00 -0.82 0.18 0.99 -1.11 0.00 0.00 175.55 174.79 1ngp s THR 183 N -2.81 -0.01 0.11 -0.71 2.01 -0.95 -0.63 115.64 112.65 1ngp s THR 183 Ca 0.55 0.03 -0.04 0.00 0.31 0.00 0.00 61.69 62.54 1ngp s THR 183 Cb -0.10 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 1ngp s THR 183 CO 0.40 0.01 0.10 -0.22 -0.69 0.00 0.00 174.62 174.22 1ngp s LEU 184 N 0.29 1.72 0.02 4.42 0.20 0.47 -1.83 118.68 123.96 1ngp s LEU 184 Ca -0.02 -1.01 -0.01 0.00 0.69 0.00 0.00 54.13 53.79 1ngp s LEU 184 Cb -0.03 0.57 -0.02 0.00 -0.43 0.00 0.00 46.19 46.28 1ngp s LEU 184 CO -0.01 -0.73 -0.02 -0.44 -0.29 0.00 0.00 176.35 174.86 1ngp s SER 185 N -2.97 0.23 -0.05 3.68 0.01 -1.26 0.80 113.70 114.13 1ngp s SER 185 Ca 0.16 -0.48 -0.05 0.00 1.31 0.00 0.00 55.95 56.89 1ngp s SER 185 Cb 0.06 0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.42 1ngp s SER 185 CO -0.03 -0.31 0.14 -0.55 0.41 0.00 0.00 173.24 172.90 1ngp s SER 186 N -1.48 -0.14 0.07 2.44 0.15 -0.82 0.15 113.70 114.06 1ngp s SER 186 Ca -0.16 0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.80 1ngp s SER 186 Cb -0.10 0.27 -0.03 0.00 -1.71 0.00 0.00 66.02 64.46 1ngp s SER 186 CO -0.01 -0.06 -0.09 -0.94 1.20 0.00 0.00 173.24 173.34 1ngp s SER 187 N 0.21 1.09 -0.00 5.45 1.04 -0.22 0.14 113.70 121.41 1ngp s SER 187 Ca -0.01 -0.69 0.02 0.00 0.48 0.00 0.00 55.95 55.74 1ngp s SER 187 Cb -0.02 0.04 -0.01 0.00 0.10 0.00 0.00 66.02 66.13 1ngp s SER 187 CO -0.01 -0.25 -0.05 0.54 0.98 0.00 0.00 173.24 174.45 1ngp s VAL 188 N -1.99 0.40 -0.20 5.02 0.11 0.81 -1.13 120.40 123.42 1ngp s VAL 188 Ca -0.02 -0.28 -0.04 0.00 -2.93 0.00 0.00 61.98 58.70 1ngp s VAL 188 Cb -0.06 -0.35 -0.02 0.00 -1.53 0.00 0.00 36.38 34.42 1ngp s VAL 188 CO -0.01 0.07 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.92 1ngp s THR 189 N -0.22 3.71 0.02 5.04 2.01 -1.04 -0.67 115.64 124.49 1ngp s THR 189 Ca 0.01 -0.40 0.05 0.00 0.31 0.00 0.00 61.69 61.66 1ngp s THR 189 Cb -0.03 -2.67 -0.02 0.00 0.01 0.00 0.00 72.50 69.80 1ngp s THR 189 CO -0.00 0.44 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.52 1ngp s VAL 190 N 1.05 1.21 0.42 3.82 1.01 -0.90 -4.86 120.40 122.15 1ngp s VAL 190 Ca 0.01 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 60.89 1ngp s VAL 190 Cb -0.14 -1.05 -0.12 0.00 0.00 0.00 0.00 36.38 35.07 1ngp s VAL 190 CO 0.01 0.16 0.70 -0.81 0.00 0.00 0.00 175.10 175.16 1ngp n PRO 191 N 2.22 0.80 0.00 2.72 -0.04 -1.26 -0.42 135.00 139.02 1ngp n PRO 191 Ca -0.16 0.29 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 1ngp n PRO 191 Cb 0.55 -1.68 0.49 0.00 -0.04 0.00 0.00 33.50 32.81 1ngp n PRO 191 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1ngp n SER 192 N 0.98 0.00 -0.07 3.54 3.41 -1.08 -2.65 113.62 117.74 1ngp n SER 192 Ca 0.11 -0.20 -0.10 0.00 -0.26 0.00 0.00 58.87 58.43 1ngp n SER 192 Cb 0.39 -0.18 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 1ngp n SER 192 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ngp h SER 193 N 0.00 0.00 -0.79 4.04 0.02 -1.87 -3.36 113.55 111.59 1ngp h SER 193 Ca 0.00 -0.34 0.17 0.00 -0.84 0.00 0.00 61.79 60.77 1ngp h SER 193 Cb 0.10 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 1ngp h SER 193 CO 0.00 0.93 0.53 -0.65 -1.14 0.00 0.00 176.83 176.49 1ngp h PRO 194 N -1.00 0.37 -6.31 3.45 0.11 -1.87 -3.38 132.00 123.38 1ngp h PRO 194 Ca -0.09 -0.02 -0.69 0.00 0.11 0.00 0.00 66.00 65.31 1ngp h PRO 194 Cb 0.68 -0.08 -0.26 0.00 0.11 0.00 0.00 31.00 31.45 1ngp h PRO 194 CO -0.05 0.25 -0.81 -0.46 -0.21 0.00 0.00 178.00 176.72 1ngp s TRP 195 N -5.38 2.60 -1.83 0.65 -0.00 -1.19 0.51 118.94 114.30 1ngp s TRP 195 Ca -0.08 -0.30 0.08 0.00 -0.00 0.00 0.00 56.10 55.80 1ngp s TRP 195 Cb 0.21 -1.61 0.24 0.00 -0.00 0.00 0.00 33.47 32.31 1ngp s TRP 195 CO 0.77 0.08 1.16 -0.35 -0.00 0.00 0.00 176.95 178.60 1ngp n PRO 196 N 2.46 1.70 0.00 5.86 -0.05 -1.26 -4.77 135.00 138.95 1ngp n PRO 196 Ca -0.17 -0.95 0.00 0.00 -0.05 0.00 0.00 63.50 62.33 1ngp n PRO 196 Cb 0.52 -1.28 0.00 0.00 -0.05 0.00 0.00 33.50 32.69 1ngp n PRO 196 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 175.50 175.88 1ngp n SER 197 N 0.25 0.00 -4.76 3.54 7.64 -1.01 -4.49 113.62 114.79 1ngp n SER 197 Ca 0.09 0.91 -0.39 0.00 1.01 0.00 0.00 58.87 60.49 1ngp n SER 197 Cb 0.27 -0.41 -0.06 0.00 -1.01 0.00 0.00 64.21 63.00 1ngp n SER 197 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1ngp s GLU 198 N -2.64 4.37 0.65 1.43 2.02 0.18 -5.06 118.70 119.65 1ngp s GLU 198 Ca 0.00 0.84 -0.12 0.00 0.02 0.00 0.00 54.97 55.72 1ngp s GLU 198 Cb 0.00 -3.34 -0.02 0.00 0.10 0.00 0.00 34.13 30.88 1ngp s GLU 198 CO 0.00 0.38 1.05 0.95 0.02 0.00 0.00 175.26 177.65 1ngp s THR 199 N -0.28 4.23 -0.08 3.63 -4.23 -1.26 -4.40 115.64 113.25 1ngp s THR 199 Ca 0.33 0.77 0.01 0.00 -1.18 0.00 0.00 61.69 61.63 1ngp s THR 199 Cb -0.19 -3.55 0.02 0.00 1.34 0.00 0.00 72.50 70.12 1ngp s THR 199 CO 0.19 -0.89 -0.10 -0.69 -0.54 0.00 0.00 174.62 172.59 1ngp s VAL 200 N -3.00 1.04 -0.03 2.29 1.01 -1.26 -5.01 120.40 115.44 1ngp s VAL 200 Ca 0.58 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.23 1ngp s VAL 200 Cb -0.13 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 1ngp s VAL 200 CO 0.51 0.35 -0.21 -0.89 0.00 0.00 0.00 175.10 174.86 1ngp s THR 201 N 1.00 1.70 -0.14 3.92 2.01 -1.26 0.14 115.64 123.01 1ngp s THR 201 Ca -0.08 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 60.96 1ngp s THR 201 Cb -0.15 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 1ngp s THR 201 CO -0.00 0.48 0.06 0.00 -0.69 0.00 0.00 174.62 174.47 1ngp s ASN 203 N -0.34 5.10 -0.11 0.00 -0.87 0.40 -1.42 114.94 117.70 1ngp s ASN 203 Ca 0.09 -1.64 -0.15 0.00 -1.57 0.00 0.00 52.86 49.58 1ngp s ASN 203 Cb -0.12 -1.78 -0.05 0.00 -0.02 0.00 0.00 41.25 39.29 1ngp s ASN 203 CO 0.02 -0.40 0.38 -0.69 -2.57 0.00 0.00 177.10 173.84 1ngp s VAL 204 N 1.20 5.20 -0.06 1.60 1.01 0.64 -1.83 120.40 128.15 1ngp s VAL 204 Ca 0.02 0.76 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1ngp s VAL 204 Cb -0.21 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.47 1ngp s VAL 204 CO -0.02 0.41 -0.11 0.00 0.00 0.00 0.00 175.10 175.38 1ngp s ALA 205 N 0.14 1.18 -0.46 5.51 0.00 0.24 -1.57 121.76 126.81 1ngp s ALA 205 Ca 0.22 -0.37 0.03 0.00 0.00 0.00 0.00 51.96 51.84 1ngp s ALA 205 Cb -0.15 -0.56 0.13 0.00 0.00 0.00 0.00 23.12 22.54 1ngp s ALA 205 CO 0.08 0.07 0.21 -1.58 0.00 0.00 0.00 175.76 174.55 1ngp s HIS 206 N 0.74 2.82 0.12 0.00 2.46 -1.05 0.84 115.29 121.21 1ngp s HIS 206 Ca -0.13 -2.85 -0.34 0.00 0.47 0.00 0.00 55.06 52.21 1ngp s HIS 206 Cb -0.15 -2.50 -0.13 0.00 -0.13 0.00 0.00 32.58 29.67 1ngp s HIS 206 CO 0.03 -0.79 1.55 -1.00 -2.47 0.00 0.00 174.74 172.06 1ngp h PRO 207 N 6.82 -0.57 -1.29 2.88 0.13 -1.82 -2.61 132.00 135.53 1ngp h PRO 207 Ca -0.06 0.04 0.46 0.00 -0.87 0.00 0.00 66.00 65.57 1ngp h PRO 207 Cb 0.93 0.13 -0.14 0.00 0.13 0.00 0.00 31.00 32.04 1ngp h PRO 207 CO 0.59 -0.38 0.81 0.00 -0.23 0.00 0.00 178.00 178.79 1ngp n ALA 208 N -3.00 1.29 -1.04 -0.56 0.00 -1.26 -0.22 120.51 115.71 1ngp n ALA 208 Ca -0.06 0.88 0.07 0.00 0.00 0.00 0.00 53.44 54.33 1ngp n ALA 208 Cb 0.38 -1.04 0.26 0.00 0.00 0.00 0.00 19.45 19.05 1ngp n ALA 208 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ngp n SER 209 N -4.78 3.79 -4.00 0.00 3.41 -1.01 -4.99 113.62 106.05 1ngp n SER 209 Ca 0.39 -3.10 -0.28 0.00 -0.26 0.00 0.00 58.87 55.63 1ngp n SER 209 Cb 1.50 -0.56 -0.08 0.00 -0.26 0.00 0.00 64.21 64.81 1ngp n SER 209 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ngp n SER 210 N -0.56 0.24 -4.90 4.04 7.64 0.69 -4.93 113.62 115.84 1ngp n SER 210 Ca 0.23 -1.04 -0.33 0.00 1.01 0.00 0.00 58.87 58.74 1ngp n SER 210 Cb 0.93 -1.31 -0.05 0.00 -1.01 0.00 0.00 64.21 62.77 1ngp n SER 210 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ngp s THR 211 N -3.83 5.39 -0.25 0.44 2.01 -1.11 -5.03 115.64 113.25 1ngp s THR 211 Ca 0.16 -0.11 -0.02 0.00 0.31 0.00 0.00 61.69 62.03 1ngp s THR 211 Cb -0.10 -3.56 0.14 0.00 0.01 0.00 0.00 72.50 68.99 1ngp s THR 211 CO 0.83 0.29 0.39 -0.54 -0.69 0.00 0.00 174.62 174.90 1ngp s LYS 212 N -2.01 0.36 -0.05 4.92 -0.14 -1.26 -2.54 119.74 119.02 1ngp s LYS 212 Ca 0.29 0.47 0.05 0.00 -1.36 0.00 0.00 55.97 55.43 1ngp s LYS 212 Cb -0.13 -0.42 -0.01 0.00 -1.68 0.00 0.00 37.83 35.59 1ngp s LYS 212 CO 0.20 -0.71 -0.21 0.08 -0.76 0.00 0.00 175.35 173.94 1ngp s VAL 213 N 2.55 1.77 -0.11 3.17 1.01 -0.61 -5.02 120.40 123.16 1ngp s VAL 213 Ca 0.12 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1ngp s VAL 213 Cb -0.15 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.74 1ngp s VAL 213 CO -0.19 0.50 -0.15 -1.81 0.00 0.00 0.00 175.10 173.46 1ngp s ASP 214 N -0.09 2.43 -0.14 3.32 1.01 -1.26 -0.26 116.67 121.69 1ngp s ASP 214 Ca -0.03 -0.42 0.00 0.00 0.71 0.00 0.00 52.55 52.80 1ngp s ASP 214 Cb -0.13 -1.08 0.02 0.00 1.01 0.00 0.00 42.92 42.75 1ngp s ASP 214 CO 0.03 0.00 -0.11 -0.54 0.21 0.00 0.00 175.17 174.76 1ngp s LYS 215 N 1.06 1.95 0.09 8.23 1.02 -0.51 -4.94 119.74 126.64 1ngp s LYS 215 Ca -0.05 -0.44 -0.31 0.00 0.02 0.00 0.00 55.97 55.19 1ngp s LYS 215 Cb -0.15 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.20 1ngp s LYS 215 CO -0.03 -0.26 1.26 0.21 -0.92 0.00 0.00 175.35 175.62 1ngp s LYS 216 N 1.58 4.40 -0.53 1.68 2.20 -1.26 -1.21 119.74 126.59 1ngp s LYS 216 Ca 0.05 1.88 -0.23 0.00 -0.36 0.00 0.00 55.97 57.31 1ngp s LYS 216 Cb -0.13 -3.31 0.04 0.00 -1.51 0.00 0.00 37.83 32.93 1ngp s LYS 216 CO -0.10 -0.31 0.85 0.42 -0.36 0.00 0.00 175.35 175.86 1ngp s ILE 217 N 1.01 4.53 -0.06 5.43 1.09 0.37 -4.93 121.20 128.63 1ngp s ILE 217 Ca 0.60 0.09 -0.14 0.00 -1.10 0.00 0.00 60.65 60.10 1ngp s ILE 217 Cb -0.32 -4.47 -0.05 0.00 -1.06 0.00 0.00 42.46 36.56 1ngp s ILE 217 CO 0.30 -1.01 0.36 0.54 -0.10 0.00 0.00 174.94 175.03 1ngp s VAL 218 N 3.57 5.15 0.40 2.92 0.11 -1.26 -4.62 120.40 126.68 1ngp s VAL 218 Ca 0.26 0.72 -0.27 0.00 -2.93 0.00 0.00 61.98 59.76 1ngp s VAL 218 Cb -0.14 -3.67 -0.10 0.00 -1.53 0.00 0.00 36.38 30.94 1ngp s VAL 218 CO 0.17 0.52 1.45 -2.16 -3.33 0.00 0.00 175.10 171.75 1ngp s PRO 219 N -0.61 3.99 0.00 1.54 0.04 -1.26 -4.81 135.00 133.89 1ngp s PRO 219 Ca 0.22 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.73 1ngp s PRO 219 Cb -0.15 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1ngp s PRO 219 CO 0.10 -0.59 0.00 -2.13 0.04 0.00 0.00 177.00 174.42