#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ngw s VAL 2 N 0.00 3.38 0.00 -0.39 1.01 -1.26 -4.24 120.40 118.90 1ngw s VAL 2 Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.45 1ngw s VAL 2 Cb 0.00 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1ngw s VAL 2 CO 0.00 -0.06 -0.06 -1.10 0.00 0.00 0.00 175.10 173.88 1ngw s GLN 3 N 4.32 0.49 -0.59 2.72 -0.21 -1.12 -5.01 119.66 120.24 1ngw s GLN 3 Ca 0.79 -0.27 0.04 0.00 0.02 0.00 0.00 55.36 55.95 1ngw s GLN 3 Cb -0.36 -0.46 0.17 0.00 1.00 0.00 0.00 33.01 33.36 1ngw s GLN 3 CO 0.34 0.12 0.43 -0.51 -2.12 0.00 0.00 175.29 173.55 1ngw s LEU 4 N -0.28 3.62 0.13 2.90 1.43 -1.26 -2.96 118.68 122.26 1ngw s LEU 4 Ca 0.01 -3.53 -0.30 0.00 -1.03 0.00 0.00 54.13 49.28 1ngw s LEU 4 Cb -0.03 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.90 1ngw s LEU 4 CO -0.00 -0.12 0.98 -0.22 0.23 0.00 0.00 176.35 177.22 1ngw s LEU 5 N -0.86 4.51 0.28 1.79 2.96 -1.06 -4.22 118.68 122.08 1ngw s LEU 5 Ca 0.27 1.86 0.02 0.00 -0.22 0.00 0.00 54.13 56.06 1ngw s LEU 5 Cb -0.03 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 1ngw s LEU 5 CO -0.17 -0.07 0.10 -1.83 -1.32 0.00 0.00 176.35 173.06 1ngw s GLU 6 N -0.17 1.48 0.69 1.98 -1.05 -1.26 -0.94 118.70 119.43 1ngw s GLU 6 Ca 0.47 -1.81 -0.17 0.00 -0.15 0.00 0.00 54.97 53.30 1ngw s GLU 6 Cb -0.25 -0.35 -0.14 0.00 -0.44 0.00 0.00 34.13 32.96 1ngw s GLU 6 CO 0.31 -0.30 -0.27 0.43 0.95 0.00 0.00 175.26 176.38 1ngw n SER 7 N -0.56 -4.17 -4.93 0.83 7.64 -1.23 -4.96 113.62 106.25 1ngw n SER 7 Ca -0.00 0.49 -0.25 0.00 1.01 0.00 0.00 58.87 60.12 1ngw n SER 7 Cb 0.66 -0.86 -0.00 0.00 -1.01 0.00 0.00 64.21 63.00 1ngw n SER 7 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ngw s GLY 8 N -1.05 1.45 0.03 0.23 0.00 -1.26 -4.52 107.32 102.19 1ngw s GLY 8 Ca 0.52 -0.76 -0.37 0.00 0.00 0.00 0.00 44.72 44.11 1ngw s GLY 8 CO 0.71 -0.63 1.39 0.00 0.00 0.00 0.00 173.10 174.57 1ngw n ALA 9 N -2.06 -0.96 -2.53 3.20 0.00 -1.26 -4.75 120.51 112.15 1ngw n ALA 9 Ca -0.01 0.50 -0.24 0.00 0.00 0.00 0.00 53.44 53.69 1ngw n ALA 9 Cb 0.56 -2.09 -0.15 0.00 0.00 0.00 0.00 19.45 17.78 1ngw n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ngw s GLU 10 N 0.93 1.30 -0.11 0.00 2.02 -0.93 -3.52 118.70 118.38 1ngw s GLU 10 Ca 0.87 -0.67 -0.11 0.00 0.02 0.00 0.00 54.97 55.09 1ngw s GLU 10 Cb -0.99 -1.28 -0.05 0.00 0.10 0.00 0.00 34.13 31.92 1ngw s GLU 10 CO 0.50 0.34 0.23 -1.17 0.02 0.00 0.00 175.26 175.19 1ngw s LEU 11 N -0.61 4.36 -0.02 1.80 2.96 -1.26 -3.08 118.68 122.84 1ngw s LEU 11 Ca 0.06 0.57 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 1ngw s LEU 11 Cb -0.07 -2.26 0.01 0.00 0.50 0.00 0.00 46.19 44.37 1ngw s LEU 11 CO -0.00 0.30 -0.04 0.54 -1.32 0.00 0.00 176.35 175.84 1ngw s VAL 12 N -0.58 0.35 0.22 1.68 0.11 -1.00 -4.99 120.40 116.17 1ngw s VAL 12 Ca 0.17 -0.12 -0.30 0.00 -2.93 0.00 0.00 61.98 58.80 1ngw s VAL 12 Cb -0.13 -0.34 -0.09 0.00 -1.53 0.00 0.00 36.38 34.29 1ngw s VAL 12 CO 0.06 0.13 1.22 -0.54 -3.33 0.00 0.00 175.10 172.63 1ngw s LYS 13 N 0.30 4.48 -0.14 1.54 1.02 -1.26 -3.25 119.74 122.43 1ngw s LYS 13 Ca -0.03 1.94 -0.41 0.00 0.02 0.00 0.00 55.97 57.49 1ngw s LYS 13 Cb -0.06 -3.21 -0.18 0.00 -0.52 0.00 0.00 37.83 33.86 1ngw s LYS 13 CO -0.00 -0.09 1.38 -2.30 -0.92 0.00 0.00 175.35 173.42 1ngw n PRO 14 N 2.18 0.52 0.00 -1.68 -0.02 -1.26 -0.52 135.00 134.22 1ngw n PRO 14 Ca 0.03 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1ngw n PRO 14 Cb 0.44 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1ngw n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngw n GLY 15 N 2.82 3.08 0.00 -1.23 0.00 0.07 -4.94 105.19 104.98 1ngw n GLY 15 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1ngw n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngw n ALA 16 N -0.51 0.00 -3.12 4.61 0.00 0.32 -3.73 120.51 118.07 1ngw n ALA 16 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ngw n ALA 16 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1ngw n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ngw s SER 17 N -1.49 -0.13 0.18 0.00 0.01 -1.26 -2.83 113.70 108.17 1ngw s SER 17 Ca 0.00 0.16 0.10 0.00 1.31 0.00 0.00 55.95 57.53 1ngw s SER 17 Cb 0.00 0.34 -0.04 0.00 0.21 0.00 0.00 66.02 66.53 1ngw s SER 17 CO 0.00 -0.23 -0.22 0.68 0.41 0.00 0.00 173.24 173.88 1ngw s VAL 18 N -0.61 2.16 -0.20 3.43 -7.23 -0.66 -4.95 120.40 112.34 1ngw s VAL 18 Ca -0.07 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1ngw s VAL 18 Cb -0.04 -2.02 0.05 0.00 0.56 0.00 0.00 36.38 34.92 1ngw s VAL 18 CO 0.01 -0.19 -0.07 -0.75 -0.31 0.00 0.00 175.10 173.79 1ngw s LYS 19 N -2.71 1.71 0.17 4.82 2.20 -1.26 -0.53 119.74 124.14 1ngw s LYS 19 Ca 0.19 -0.77 -0.09 0.00 -0.36 0.00 0.00 55.97 54.93 1ngw s LYS 19 Cb -0.07 -2.33 -0.07 0.00 -1.51 0.00 0.00 37.83 33.85 1ngw s LYS 19 CO 0.09 -0.48 0.48 -0.51 -0.36 0.00 0.00 175.35 174.57 1ngw s LEU 20 N 1.48 4.25 0.37 5.43 1.43 0.44 -4.92 118.68 127.15 1ngw s LEU 20 Ca -0.02 0.85 0.08 0.00 -1.03 0.00 0.00 54.13 54.01 1ngw s LEU 20 Cb -0.17 -3.40 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 1ngw s LEU 20 CO -0.08 0.03 0.29 -0.44 0.23 0.00 0.00 176.35 176.39 1ngw s SER 21 N -2.15 5.08 -0.43 2.29 0.01 -1.26 -2.29 113.70 114.96 1ngw s SER 21 Ca 0.42 -0.64 0.04 0.00 1.31 0.00 0.00 55.95 57.07 1ngw s SER 21 Cb -0.13 -0.79 0.19 0.00 0.21 0.00 0.00 66.02 65.51 1ngw s SER 21 CO 0.21 -0.45 0.77 0.00 0.41 0.00 0.00 173.24 174.18 1ngw s LYS 23 N 1.45 4.30 0.28 0.00 2.20 -0.11 -2.01 119.74 125.85 1ngw s LYS 23 Ca 0.21 1.28 0.05 0.00 -0.36 0.00 0.00 55.97 57.16 1ngw s LYS 23 Cb -0.00 -3.60 -0.02 0.00 -1.51 0.00 0.00 37.83 32.69 1ngw s LYS 23 CO -0.08 -0.49 0.42 0.00 -0.36 0.00 0.00 175.35 174.84 1ngw s ALA 24 N 2.68 4.03 -0.03 3.13 0.00 0.21 -2.55 121.76 129.24 1ngw s ALA 24 Ca 0.44 -1.30 -0.30 0.00 0.00 0.00 0.00 51.96 50.80 1ngw s ALA 24 Cb -0.16 -1.74 0.12 0.00 0.00 0.00 0.00 23.12 21.34 1ngw s ALA 24 CO 0.10 0.11 1.31 -1.54 0.00 0.00 0.00 175.76 175.75 1ngw s SER 25 N -4.06 -0.03 0.00 0.00 1.04 -1.16 -4.85 113.70 104.65 1ngw s SER 25 Ca 0.39 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.68 1ngw s SER 25 Cb -0.09 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1ngw s SER 25 CO 0.30 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1ngw n GLY 26 N -0.61 2.13 3.40 7.32 0.00 -1.26 -2.81 105.19 113.36 1ngw n GLY 26 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 1ngw n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ngw s TYR 27 N -3.20 -0.46 -0.75 1.61 1.13 -1.26 -4.40 117.35 110.03 1ngw s TYR 27 Ca 0.00 0.28 -0.26 0.00 -1.41 0.00 0.00 57.07 55.68 1ngw s TYR 27 Cb 0.00 0.46 -0.05 0.00 -1.10 0.00 0.00 41.96 41.27 1ngw s TYR 27 CO 0.00 -0.79 2.02 -0.08 -2.51 0.00 0.00 175.55 174.19 1ngw s THR 28 N -3.53 3.32 0.24 -3.49 -1.32 -1.26 -4.86 115.64 104.74 1ngw s THR 28 Ca 0.00 -0.09 -0.11 0.00 -1.21 0.00 0.00 61.69 60.28 1ngw s THR 28 Cb -0.00 -3.77 0.34 0.00 -1.51 0.00 0.00 72.50 67.56 1ngw s THR 28 CO -0.11 -0.73 1.59 0.15 -2.21 0.00 0.00 174.62 173.31 1ngw h PHE 29 N 13.56 -0.45 0.00 9.09 3.57 -1.95 -1.95 116.94 138.81 1ngw h PHE 29 Ca -0.07 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1ngw h PHE 29 Cb 1.09 0.33 0.00 0.00 2.79 0.00 0.00 35.95 40.15 1ngw h PHE 29 CO 1.12 -0.35 0.00 0.25 -2.23 0.00 0.00 178.31 177.10 1ngw n THR 30 N -5.53 0.68 -0.04 4.41 -2.24 -1.26 -3.69 114.28 106.61 1ngw n THR 30 Ca 0.12 0.17 -0.02 0.00 -2.27 0.00 0.00 64.05 62.04 1ngw n THR 30 Cb 0.41 -1.08 -0.01 0.00 -2.10 0.00 0.00 70.33 67.55 1ngw n THR 30 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1ngw h SER 31 N 0.00 0.00 -3.93 3.42 0.02 -1.76 -3.32 113.55 107.99 1ngw h SER 31 Ca 0.00 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.49 1ngw h SER 31 Cb 0.04 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 1ngw h SER 31 CO 0.00 0.47 0.34 -0.31 -1.14 0.00 0.00 176.83 176.19 1ngw s TYR 32 N -1.72 3.59 0.85 3.45 2.02 -1.24 -4.95 117.35 119.35 1ngw s TYR 32 Ca -0.07 1.74 -0.12 0.00 -0.37 0.00 0.00 57.07 58.25 1ngw s TYR 32 Cb 0.01 -2.90 0.10 0.00 -0.40 0.00 0.00 41.96 38.77 1ngw s TYR 32 CO 0.11 0.13 1.12 -1.58 -1.57 0.00 0.00 175.55 173.75 1ngw s TRP 33 N -1.77 2.69 -0.00 2.71 0.52 -1.26 -4.55 118.94 117.28 1ngw s TRP 33 Ca 0.53 1.01 0.07 0.00 0.02 0.00 0.00 56.10 57.74 1ngw s TRP 33 Cb -0.16 -3.25 -0.02 0.00 -1.15 0.00 0.00 33.47 28.89 1ngw s TRP 33 CO 0.21 -2.04 -0.23 -1.64 0.02 0.00 0.00 176.95 173.27 1ngw s MET 34 N -5.22 1.75 0.45 4.98 -1.94 -0.46 -0.85 119.30 118.02 1ngw s MET 34 Ca 0.62 -0.86 0.06 0.00 -1.71 0.00 0.00 55.69 53.81 1ngw s MET 34 Cb -0.15 -1.74 -0.03 0.00 2.01 0.00 0.00 34.83 34.92 1ngw s MET 34 CO 0.54 0.47 0.20 -1.01 -0.01 0.00 0.00 175.02 175.21 1ngw s HIS 35 N -0.60 2.32 -0.09 -0.03 3.76 -0.21 -1.52 115.29 118.92 1ngw s HIS 35 Ca 0.09 -0.69 -0.04 0.00 -0.15 0.00 0.00 55.06 54.27 1ngw s HIS 35 Cb -0.09 -1.91 0.04 0.00 1.11 0.00 0.00 32.58 31.74 1ngw s HIS 35 CO -0.00 0.06 0.20 -1.58 -0.85 0.00 0.00 174.74 172.56 1ngw s TRP 36 N -2.67 -0.25 -0.01 1.40 0.52 -1.10 -2.69 118.94 114.14 1ngw s TRP 36 Ca 0.35 0.65 0.05 0.00 0.02 0.00 0.00 56.10 57.17 1ngw s TRP 36 Cb 0.02 -0.02 -0.01 0.00 -1.15 0.00 0.00 33.47 32.31 1ngw s TRP 36 CO 0.20 -0.21 -0.17 0.08 0.02 0.00 0.00 176.95 176.87 1ngw s VAL 37 N 1.29 1.35 -0.14 4.03 1.01 0.12 -0.69 120.40 127.37 1ngw s VAL 37 Ca -0.09 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1ngw s VAL 37 Cb -0.11 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 1ngw s VAL 37 CO -0.07 0.38 0.00 -0.75 0.00 0.00 0.00 175.10 174.66 1ngw s LYS 38 N -0.39 3.55 -0.09 2.72 2.20 0.12 -0.43 119.74 127.41 1ngw s LYS 38 Ca 0.06 -0.44 -0.12 0.00 -0.36 0.00 0.00 55.97 55.12 1ngw s LYS 38 Cb -0.07 -2.96 -0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1ngw s LYS 38 CO -0.01 0.39 -0.23 0.94 -0.36 0.00 0.00 175.35 176.09 1ngw n GLN 39 N 3.10 0.35 -0.92 4.03 7.27 -0.29 -1.25 117.38 129.68 1ngw n GLN 39 Ca -0.18 0.14 0.00 0.00 0.07 0.00 0.00 57.00 57.03 1ngw n GLN 39 Cb 0.53 -1.11 0.00 0.00 2.41 0.00 0.00 30.24 32.07 1ngw n GLN 39 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1ngw n ARG 40 N -4.12 -2.18 -0.57 3.69 0.63 -1.26 -4.47 116.66 108.38 1ngw n ARG 40 Ca -0.10 1.69 -0.22 0.00 -0.92 0.00 0.00 57.85 58.30 1ngw n ARG 40 Cb 0.35 -1.70 -0.03 0.00 0.45 0.00 0.00 32.46 31.53 1ngw n ARG 40 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1ngw n PRO 41 N 0.28 0.00 -0.23 -0.14 -0.02 -1.26 -1.88 135.00 131.75 1ngw n PRO 41 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1ngw n PRO 41 Cb 0.00 -0.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.98 1ngw n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngw n GLY 42 N 1.24 0.00 0.00 -1.23 0.00 -1.26 -4.92 105.19 99.02 1ngw n GLY 42 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1ngw n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ngw n ARG 43 N -1.11 0.76 0.00 1.61 1.74 -0.79 -5.12 116.66 113.76 1ngw n ARG 43 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1ngw n ARG 43 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1ngw n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ngw n GLY 44 N 5.00 -2.12 3.03 -0.13 0.00 -1.26 -4.91 105.19 104.80 1ngw n GLY 44 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 1ngw n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ngw s LEU 45 N 0.00 0.69 -0.10 0.99 1.43 -1.26 -4.72 118.68 115.71 1ngw s LEU 45 Ca 0.00 0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 1ngw s LEU 45 Cb 0.00 0.63 0.01 0.00 0.03 0.00 0.00 46.19 46.87 1ngw s LEU 45 CO 0.00 -0.14 -0.16 -1.61 0.23 0.00 0.00 176.35 174.67 1ngw s GLU 46 N 0.95 2.25 0.22 1.70 2.02 -0.38 -5.00 118.70 120.46 1ngw s GLU 46 Ca -0.07 -0.58 -0.30 0.00 0.02 0.00 0.00 54.97 54.04 1ngw s GLU 46 Cb -0.08 -1.87 -0.08 0.00 0.10 0.00 0.00 34.13 32.19 1ngw s GLU 46 CO -0.06 -0.01 1.02 -0.46 0.02 0.00 0.00 175.26 175.77 1ngw s TRP 47 N 0.84 3.76 -0.16 1.61 -0.00 -1.26 -0.71 118.94 123.03 1ngw s TRP 47 Ca -0.10 1.77 -0.15 0.00 -0.00 0.00 0.00 56.10 57.62 1ngw s TRP 47 Cb -0.15 -3.14 -0.05 0.00 -0.00 0.00 0.00 33.47 30.12 1ngw s TRP 47 CO 0.01 -0.10 -0.30 -0.89 -0.00 0.00 0.00 176.95 175.67 1ngw n ILE 48 N 1.75 1.32 -3.79 5.86 5.41 0.13 -4.77 119.36 125.27 1ngw n ILE 48 Ca -0.00 0.19 -0.04 0.00 1.00 0.00 0.00 62.75 63.90 1ngw n ILE 48 Cb 0.46 -2.25 -0.00 0.00 -0.71 0.00 0.00 39.64 37.14 1ngw n ILE 48 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1ngw s GLY 49 N -4.65 -0.10 0.08 7.39 0.00 -1.24 -0.55 107.32 108.25 1ngw s GLY 49 Ca -0.25 -0.07 0.07 0.00 0.00 0.00 0.00 44.72 44.47 1ngw s GLY 49 CO 0.37 0.58 -0.19 -0.29 0.00 0.00 0.00 173.10 173.57 1ngw s MET 50 N -2.96 1.08 -0.05 2.90 1.75 0.20 -2.71 119.30 119.52 1ngw s MET 50 Ca 0.15 -1.07 -0.03 0.00 -1.25 0.00 0.00 55.69 53.50 1ngw s MET 50 Cb -0.02 -1.26 0.02 0.00 2.84 0.00 0.00 34.83 36.41 1ngw s MET 50 CO 0.04 0.30 0.11 -1.50 -0.65 0.00 0.00 175.02 173.31 1ngw s ILE 51 N -1.12 -0.02 -0.39 10.11 2.07 -0.58 -1.29 121.20 129.98 1ngw s ILE 51 Ca 0.04 0.09 -0.20 0.00 -1.41 0.00 0.00 60.65 59.18 1ngw s ILE 51 Cb -0.10 -0.17 0.01 0.00 0.13 0.00 0.00 42.46 42.33 1ngw s ILE 51 CO 0.03 0.04 0.61 -0.62 -1.91 0.00 0.00 174.94 173.09 1ngw s ASP 52 N 0.58 6.35 0.17 4.50 3.68 -0.47 -1.36 116.67 130.13 1ngw s ASP 52 Ca -0.04 -0.12 -0.15 0.00 2.13 0.00 0.00 52.55 54.36 1ngw s ASP 52 Cb -0.06 -2.31 0.14 0.00 -1.45 0.00 0.00 42.92 39.23 1ngw s ASP 52 CO -0.02 -0.65 1.69 -0.65 0.13 0.00 0.00 175.17 175.66 1ngw h PRO 53 N 8.65 0.09 0.00 4.34 0.11 -1.85 -2.15 132.00 141.19 1ngw h PRO 53 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1ngw h PRO 53 Cb 1.11 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ngw h PRO 53 CO 0.85 0.06 0.00 -1.71 -0.21 0.00 0.00 178.00 176.99 1ngw n ASN 54 N -5.22 0.00 0.03 -2.05 2.85 -1.25 -4.34 115.26 105.28 1ngw n ASN 54 Ca 0.04 0.14 -0.14 0.00 -0.11 0.00 0.00 54.58 54.50 1ngw n ASN 54 Cb 0.23 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.17 1ngw n ASN 54 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1ngw h SER 55 N 0.00 -1.50 0.00 1.20 4.64 -1.91 -3.47 113.55 112.51 1ngw h SER 55 Ca 0.00 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1ngw h SER 55 Cb 0.00 0.58 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1ngw h SER 55 CO 0.00 -0.48 0.00 0.61 -0.87 0.00 0.00 176.83 176.09 1ngw n GLY 56 N -1.45 1.08 3.75 -0.77 0.00 -0.81 -5.09 105.19 101.89 1ngw n GLY 56 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1ngw n GLY 56 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ngw s GLY 57 N -0.98 2.28 0.12 -0.02 0.00 -1.26 -4.73 107.32 102.73 1ngw s GLY 57 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 44.72 45.38 1ngw s GLY 57 CO 0.00 1.11 0.20 -0.51 0.00 0.00 0.00 173.10 173.90 1ngw s THR 58 N -2.13 0.11 -0.04 0.90 -4.23 -1.26 -1.36 115.64 107.63 1ngw s THR 58 Ca 0.71 -1.37 -0.02 0.00 -1.18 0.00 0.00 61.69 59.83 1ngw s THR 58 Cb -0.25 -1.62 0.03 0.00 1.34 0.00 0.00 72.50 72.00 1ngw s THR 58 CO 0.43 -0.51 0.06 -0.75 -0.54 0.00 0.00 174.62 173.30 1ngw s LYS 59 N -3.93 -0.06 0.30 3.99 2.47 -0.41 -5.00 119.74 117.10 1ngw s LYS 59 Ca 0.12 0.35 0.08 0.00 -1.56 0.00 0.00 55.97 54.95 1ngw s LYS 59 Cb 0.05 -0.43 -0.03 0.00 -1.46 0.00 0.00 37.83 35.95 1ngw s LYS 59 CO -0.05 -0.29 0.21 0.71 0.16 0.00 0.00 175.35 176.08 1ngw s TYR 60 N 1.92 2.92 -0.27 4.03 1.51 -1.26 0.62 117.35 126.81 1ngw s TYR 60 Ca 0.02 -0.24 -0.28 0.00 -1.01 0.00 0.00 57.07 55.55 1ngw s TYR 60 Cb -0.12 -1.58 0.01 0.00 -0.11 0.00 0.00 41.96 40.16 1ngw s TYR 60 CO -0.03 0.36 1.03 1.21 -1.11 0.00 0.00 175.55 177.01 1ngw s ASN 61 N -3.89 6.99 -0.15 2.29 3.84 0.28 -4.86 114.94 119.44 1ngw s ASN 61 Ca 0.37 1.18 -0.01 0.00 0.21 0.00 0.00 52.86 54.61 1ngw s ASN 61 Cb -0.06 -2.53 -0.02 0.00 -0.55 0.00 0.00 41.25 38.10 1ngw s ASN 61 CO 0.25 -0.74 1.15 1.21 -2.79 0.00 0.00 177.10 176.18 1ngw n GLU 62 N 6.52 0.40 0.02 0.43 4.07 -1.26 -1.88 120.64 128.94 1ngw n GLU 62 Ca 0.11 -0.57 0.00 0.00 -0.06 0.00 0.00 57.16 56.64 1ngw n GLU 62 Cb 0.47 -1.97 0.00 0.00 -0.06 0.00 0.00 31.44 29.87 1ngw n GLU 62 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1ngw n LYS 63 N 4.40 0.00 0.00 5.31 4.81 -1.26 -4.81 118.16 126.61 1ngw n LYS 63 Ca 0.08 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.66 1ngw n LYS 63 Cb 0.05 0.00 0.38 0.00 0.02 0.00 0.00 35.03 35.48 1ngw n LYS 63 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1ngw n PHE 64 N -2.62 0.00 -0.32 5.64 3.01 -0.79 -4.37 117.46 118.01 1ngw n PHE 64 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.61 1ngw n PHE 64 Cb 0.00 -0.07 0.29 0.00 -0.01 0.00 0.00 39.48 39.69 1ngw n PHE 64 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1ngw n LYS 65 N -0.25 -0.07 0.08 -1.08 3.00 -1.00 -0.30 118.16 118.55 1ngw n LYS 65 Ca 0.14 1.40 -0.17 0.00 -0.00 0.00 0.00 58.31 59.68 1ngw n LYS 65 Cb 0.37 -2.25 -0.14 0.00 0.00 0.00 0.00 35.03 33.01 1ngw n LYS 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1ngw h SER 66 N 0.00 0.45 1.25 3.14 4.64 -1.90 -3.38 113.55 117.75 1ngw h SER 66 Ca 0.58 -0.56 -0.15 0.00 -0.47 0.00 0.00 61.79 61.20 1ngw h SER 66 Cb 1.23 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 1ngw h SER 66 CO -0.88 1.46 -0.76 0.50 -0.87 0.00 0.00 176.83 176.28 1ngw h LYS 67 N 0.08 0.00 -6.29 4.77 3.64 -1.34 -3.47 116.57 113.97 1ngw h LYS 67 Ca -0.22 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 58.55 1ngw h LYS 67 Cb 2.02 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 33.69 1ngw h LYS 67 CO 0.19 0.63 -0.77 0.00 -2.27 0.00 0.00 179.45 177.23 1ngw s ALA 68 N -2.87 2.72 -0.14 5.00 0.00 0.59 -0.68 121.76 126.38 1ngw s ALA 68 Ca 0.02 -1.83 -0.07 0.00 0.00 0.00 0.00 51.96 50.08 1ngw s ALA 68 Cb 0.08 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.97 1ngw s ALA 68 CO 0.78 0.31 0.34 0.95 0.00 0.00 0.00 175.76 178.13 1ngw s THR 69 N -2.35 -0.06 -0.13 0.00 -4.23 -0.34 -4.72 115.64 103.82 1ngw s THR 69 Ca 0.28 0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 60.87 1ngw s THR 69 Cb -0.06 -0.51 -0.04 0.00 1.34 0.00 0.00 72.50 73.24 1ngw s THR 69 CO 0.14 0.05 0.06 -0.76 -0.54 0.00 0.00 174.62 173.58 1ngw s LEU 70 N 1.41 3.91 0.19 4.79 1.43 -1.26 -0.50 118.68 128.65 1ngw s LEU 70 Ca -0.09 0.23 -0.07 0.00 -1.03 0.00 0.00 54.13 53.17 1ngw s LEU 70 Cb -0.09 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 1ngw s LEU 70 CO -0.11 0.33 0.27 0.28 0.23 0.00 0.00 176.35 177.35 1ngw s THR 71 N -0.56 0.04 0.12 5.49 -1.32 0.53 -4.99 115.64 114.95 1ngw s THR 71 Ca 0.11 -1.59 0.03 0.00 -1.21 0.00 0.00 61.69 59.02 1ngw s THR 71 Cb -0.12 -2.10 -0.01 0.00 -1.51 0.00 0.00 72.50 68.76 1ngw s THR 71 CO 0.02 -0.18 0.09 1.33 -2.21 0.00 0.00 174.62 173.68 1ngw n VAL 72 N -0.25 0.00 -3.25 5.08 0.24 -1.26 0.03 118.33 118.92 1ngw n VAL 72 Ca -0.04 -0.84 -0.13 0.00 -2.04 0.00 0.00 64.34 61.29 1ngw n VAL 72 Cb 0.63 0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 1ngw n VAL 72 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1ngw s ASP 73 N -1.81 0.37 0.20 -1.34 2.15 -1.01 -4.92 116.67 110.30 1ngw s ASP 73 Ca 0.13 -1.68 0.06 0.00 0.43 0.00 0.00 52.55 51.49 1ngw s ASP 73 Cb 0.01 0.86 0.60 0.00 -0.30 0.00 0.00 42.92 44.08 1ngw s ASP 73 CO 0.09 -0.20 0.94 0.29 -0.17 0.00 0.00 175.17 176.12 1ngw n LYS 74 N 3.88 -0.04 0.00 4.34 4.76 -1.26 -2.31 118.16 127.53 1ngw n LYS 74 Ca 0.15 0.87 0.00 0.00 -2.87 0.00 0.00 58.31 56.45 1ngw n LYS 74 Cb 0.49 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 1ngw n LYS 74 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1ngw n PRO 75 N -4.59 0.00 0.00 1.97 -0.02 -1.26 -4.05 135.00 127.05 1ngw n PRO 75 Ca 0.18 0.22 0.04 0.00 -2.02 0.00 0.00 63.50 61.92 1ngw n PRO 75 Cb 0.59 -1.06 0.21 0.00 -0.02 0.00 0.00 33.50 33.21 1ngw n PRO 75 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ngw n SER 76 N -1.17 0.00 -3.32 2.55 3.41 -1.12 -4.89 113.62 109.09 1ngw n SER 76 Ca 0.00 0.08 -0.17 0.00 -0.26 0.00 0.00 58.87 58.52 1ngw n SER 76 Cb 0.00 -0.22 0.07 0.00 -0.26 0.00 0.00 64.21 63.80 1ngw n SER 76 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ngw n ASN 77 N -1.22 -6.02 -3.95 4.04 3.02 -0.98 -4.71 115.26 105.45 1ngw n ASN 77 Ca 0.04 -0.73 -0.19 0.00 -0.03 0.00 0.00 54.58 53.67 1ngw n ASN 77 Cb 0.06 -5.02 -0.16 0.00 -0.61 0.00 0.00 39.78 34.05 1ngw n ASN 77 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ngw s THR 78 N -3.40 0.61 -0.05 3.41 -4.23 -1.26 -0.62 115.64 110.11 1ngw s THR 78 Ca 0.41 -0.24 -0.03 0.00 -1.18 0.00 0.00 61.69 60.65 1ngw s THR 78 Cb -0.06 -0.57 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 1ngw s THR 78 CO 0.75 0.21 0.11 0.00 -0.54 0.00 0.00 174.62 175.15 1ngw s ALA 79 N 0.39 3.70 -0.05 3.99 0.00 -0.85 -2.41 121.76 126.54 1ngw s ALA 79 Ca -0.05 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1ngw s ALA 79 Cb -0.09 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.29 1ngw s ALA 79 CO 0.00 0.67 -0.14 0.71 0.00 0.00 0.00 175.76 177.01 1ngw s TYR 80 N -1.14 1.45 -0.06 0.00 2.02 0.11 -2.16 117.35 117.57 1ngw s TYR 80 Ca 0.20 -0.45 0.04 0.00 -0.37 0.00 0.00 57.07 56.50 1ngw s TYR 80 Cb -0.12 -1.02 -0.00 0.00 -0.40 0.00 0.00 41.96 40.42 1ngw s TYR 80 CO 0.11 -0.19 -0.20 1.41 -1.57 0.00 0.00 175.55 175.11 1ngw s MET 81 N 0.29 2.23 -0.10 -0.62 -2.45 -0.97 -0.34 119.30 117.35 1ngw s MET 81 Ca -0.08 -0.72 0.04 0.00 -1.25 0.00 0.00 55.69 53.69 1ngw s MET 81 Cb -0.12 -1.85 -0.00 0.00 1.25 0.00 0.00 34.83 34.11 1ngw s MET 81 CO 0.02 0.24 -0.23 -1.14 1.05 0.00 0.00 175.02 174.96 1ngw s GLN 82 N 0.13 2.94 -0.10 4.11 0.74 0.34 -0.42 119.66 127.40 1ngw s GLN 82 Ca -0.08 -0.86 -0.01 0.00 0.05 0.00 0.00 55.36 54.46 1ngw s GLN 82 Cb -0.14 -2.24 -0.03 0.00 1.10 0.00 0.00 33.01 31.70 1ngw s GLN 82 CO 0.04 0.19 -0.04 -0.51 -0.55 0.00 0.00 175.29 174.42 1ngw s LEU 83 N 0.32 3.31 0.17 3.68 1.43 0.31 -1.20 118.68 126.70 1ngw s LEU 83 Ca -0.18 -0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.01 1ngw s LEU 83 Cb -0.18 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 1ngw s LEU 83 CO 0.08 0.31 -0.19 -0.94 0.23 0.00 0.00 176.35 175.84 1ngw s SER 84 N -0.49 2.82 -1.29 2.29 1.04 0.14 -1.65 113.70 116.56 1ngw s SER 84 Ca 0.08 -0.88 -0.01 0.00 0.48 0.00 0.00 55.95 55.62 1ngw s SER 84 Cb -0.12 -0.18 -0.00 0.00 0.10 0.00 0.00 66.02 65.82 1ngw s SER 84 CO 0.02 -0.02 0.71 -1.20 0.98 0.00 0.00 173.24 173.73 1ngw n SER 85 N 0.22 -1.50 -4.77 7.02 7.64 -1.13 -4.82 113.62 116.29 1ngw n SER 85 Ca -0.13 -0.83 -0.41 0.00 1.01 0.00 0.00 58.87 58.52 1ngw n SER 85 Cb 0.57 -4.06 -0.02 0.00 -1.01 0.00 0.00 64.21 59.70 1ngw n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ngw s LEU 86 N -6.62 4.40 0.39 -3.43 2.01 -1.15 -4.72 118.68 109.56 1ngw s LEU 86 Ca 0.04 2.77 0.04 0.00 0.01 0.00 0.00 54.13 56.99 1ngw s LEU 86 Cb -0.01 -3.65 -0.02 0.00 0.01 0.00 0.00 46.19 42.51 1ngw s LEU 86 CO 0.81 -0.63 0.16 0.42 1.01 0.00 0.00 176.35 178.13 1ngw s THR 87 N -1.03 0.44 0.45 5.49 -4.23 -1.26 -0.75 115.64 114.74 1ngw s THR 87 Ca 0.51 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.18 1ngw s THR 87 Cb -0.42 -2.38 0.35 0.00 1.34 0.00 0.00 72.50 71.40 1ngw s THR 87 CO 0.54 0.00 1.96 0.77 -0.54 0.00 0.00 174.62 177.36 1ngw h SER 88 N 1.88 0.32 0.46 3.99 4.64 -1.97 0.88 113.55 123.76 1ngw h SER 88 Ca -0.33 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 60.95 1ngw h SER 88 Cb 1.26 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1ngw h SER 88 CO 0.52 0.18 -0.26 1.05 -0.87 0.00 0.00 176.83 177.45 1ngw h GLU 89 N 0.35 0.00 0.00 4.77 -0.00 -1.96 -2.44 114.58 115.30 1ngw h GLU 89 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.66 1ngw h GLU 89 Cb 0.71 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.46 1ngw h GLU 89 CO -0.08 0.26 0.00 -0.44 -0.00 0.00 0.00 179.01 178.75 1ngw h ASP 90 N 0.00 0.00 -2.62 3.06 3.45 -1.21 -3.43 116.42 115.67 1ngw h ASP 90 Ca -0.00 0.00 -0.54 0.00 0.43 0.00 0.00 57.03 56.92 1ngw h ASP 90 Cb 0.56 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.34 1ngw h ASP 90 CO 0.03 0.00 1.06 -0.44 -1.57 0.00 0.00 179.24 178.33 1ngw s SER 91 N -5.26 6.62 0.03 6.45 0.01 -0.92 -4.90 113.70 115.72 1ngw s SER 91 Ca 0.03 2.40 -0.21 0.00 1.31 0.00 0.00 55.95 59.48 1ngw s SER 91 Cb 0.09 -2.55 0.07 0.00 0.21 0.00 0.00 66.02 63.84 1ngw s SER 91 CO 0.51 -0.92 0.95 0.00 0.41 0.00 0.00 173.24 174.19 1ngw n ALA 92 N 6.49 -2.64 -2.81 1.44 0.00 -0.78 -4.72 120.51 117.50 1ngw n ALA 92 Ca 0.17 -0.69 -0.35 0.00 0.00 0.00 0.00 53.44 52.57 1ngw n ALA 92 Cb 0.42 0.22 -0.09 0.00 0.00 0.00 0.00 19.45 20.00 1ngw n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ngw s VAL 93 N -2.08 4.84 -0.13 0.00 1.01 -1.26 -1.28 120.40 121.49 1ngw s VAL 93 Ca 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.17 1ngw s VAL 93 Cb -0.01 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 1ngw s VAL 93 CO 0.01 0.50 -0.09 -0.31 0.00 0.00 0.00 175.10 175.20 1ngw s TYR 94 N 0.05 2.89 -0.01 5.22 1.51 -0.17 -1.14 117.35 125.71 1ngw s TYR 94 Ca 0.06 -0.47 0.07 0.00 -1.01 0.00 0.00 57.07 55.71 1ngw s TYR 94 Cb -0.12 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1ngw s TYR 94 CO 0.01 -0.11 -0.20 0.71 -1.11 0.00 0.00 175.55 174.84 1ngw s TYR 95 N 0.27 2.50 -0.11 2.71 2.02 0.42 -1.13 117.35 124.04 1ngw s TYR 95 Ca -0.07 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 1ngw s TYR 95 Cb -0.15 -1.52 -0.01 0.00 -0.40 0.00 0.00 41.96 39.88 1ngw s TYR 95 CO 0.04 0.12 -0.16 0.00 -1.57 0.00 0.00 175.55 173.98 1ngw s THR 97 N 0.22 1.23 0.79 0.00 -4.23 -1.09 -1.87 115.64 110.69 1ngw s THR 97 Ca -0.10 -2.07 -0.12 0.00 -1.18 0.00 0.00 61.69 58.21 1ngw s THR 97 Cb -0.16 -2.17 0.07 0.00 1.34 0.00 0.00 72.50 71.58 1ngw s THR 97 CO 0.06 -0.48 1.14 -0.60 -0.54 0.00 0.00 174.62 174.20 1ngw s ARG 98 N -3.78 2.14 0.16 3.99 3.52 -0.58 -1.04 118.95 123.35 1ngw s ARG 98 Ca 0.24 0.27 -0.20 0.00 -0.13 0.00 0.00 55.73 55.92 1ngw s ARG 98 Cb 0.04 -1.96 0.06 0.00 -1.56 0.00 0.00 34.95 31.53 1ngw s ARG 98 CO 0.06 -1.50 1.25 -2.13 -0.81 0.00 0.00 175.30 172.17 1ngw n ARG 99 N -3.29 -0.28 -0.68 5.12 0.63 -0.03 -0.40 116.66 117.74 1ngw n ARG 99 Ca 0.07 1.24 -0.01 0.00 -0.92 0.00 0.00 57.85 58.24 1ngw n ARG 99 Cb 0.59 -1.83 0.24 0.00 0.45 0.00 0.00 32.46 31.92 1ngw n ARG 99 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1ngw n ASP 100 N -5.10 4.10 -4.36 6.15 8.00 -1.26 -4.91 116.55 119.17 1ngw n ASP 100 Ca 0.05 -2.76 -0.37 0.00 0.71 0.00 0.00 54.79 52.41 1ngw n ASP 100 Cb 0.26 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.65 1ngw n ASP 100 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1ngw n MET 101 N 0.17 -1.75 0.04 -1.24 2.81 0.47 -4.80 117.12 112.82 1ngw n MET 101 Ca 0.25 0.23 0.05 0.00 -1.81 0.00 0.00 57.70 56.42 1ngw n MET 101 Cb 1.01 -4.64 -0.07 0.00 -0.71 0.00 0.00 33.22 28.81 1ngw n MET 101 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1ngw n ASP 102 N -2.64 0.68 -4.00 7.83 3.85 -1.26 -4.82 116.55 116.19 1ngw n ASP 102 Ca -0.00 0.28 -0.27 0.00 -0.71 0.00 0.00 54.79 54.09 1ngw n ASP 102 Cb 0.52 0.58 -0.17 0.00 -1.35 0.00 0.00 41.12 40.71 1ngw n ASP 102 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1ngw s TYR 103 N -3.15 1.70 0.39 2.11 2.02 -1.26 -5.05 117.35 114.11 1ngw s TYR 103 Ca -0.03 -0.78 0.08 0.00 -0.37 0.00 0.00 57.07 55.97 1ngw s TYR 103 Cb 0.10 -1.28 -0.07 0.00 -0.40 0.00 0.00 41.96 40.31 1ngw s TYR 103 CO 0.82 -0.44 -0.02 -1.58 -1.57 0.00 0.00 175.55 172.76 1ngw s TRP 104 N 1.11 2.49 0.65 2.71 0.52 -1.26 -1.53 118.94 123.62 1ngw s TRP 104 Ca -0.05 -0.61 0.04 0.00 0.02 0.00 0.00 56.10 55.49 1ngw s TRP 104 Cb -0.14 -1.66 0.10 0.00 -1.15 0.00 0.00 33.47 30.62 1ngw s TRP 104 CO -0.02 0.49 0.89 0.20 0.02 0.00 0.00 176.95 178.53 1ngw s GLY 105 N -3.68 1.76 0.17 0.98 0.00 -0.78 -4.63 107.32 101.14 1ngw s GLY 105 Ca 0.34 -1.88 0.26 0.00 0.00 0.00 0.00 44.72 43.45 1ngw s GLY 105 CO 0.18 -1.37 1.79 0.00 0.00 0.00 0.00 173.10 173.70 1ngw n ALA 106 N -2.56 2.23 0.00 3.20 0.00 -1.26 -4.84 120.51 117.28 1ngw n ALA 106 Ca 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1ngw n ALA 106 Cb 0.61 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1ngw n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ngw n GLY 107 N 1.22 -1.39 3.42 0.00 0.00 -1.26 -5.01 105.19 102.17 1ngw n GLY 107 Ca 0.06 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 1ngw n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ngw s THR 108 N -3.18 3.30 -0.37 2.61 2.01 -0.28 -4.88 115.64 114.85 1ngw s THR 108 Ca 0.00 -0.58 -0.20 0.00 0.31 0.00 0.00 61.69 61.23 1ngw s THR 108 Cb 0.00 -2.40 0.00 0.00 0.01 0.00 0.00 72.50 70.12 1ngw s THR 108 CO 0.00 0.52 0.59 -0.89 -0.69 0.00 0.00 174.62 174.15 1ngw s THR 109 N 0.26 4.93 -0.47 -0.82 2.01 -1.26 -1.00 115.64 119.28 1ngw s THR 109 Ca -0.07 0.41 -0.11 0.00 0.31 0.00 0.00 61.69 62.23 1ngw s THR 109 Cb -0.15 -4.05 0.11 0.00 0.01 0.00 0.00 72.50 68.42 1ngw s THR 109 CO 0.05 -0.32 0.36 -0.69 -0.69 0.00 0.00 174.62 173.33 1ngw s VAL 110 N 2.59 4.49 -0.18 3.82 1.01 -0.41 -2.20 120.40 129.53 1ngw s VAL 110 Ca 0.22 -1.59 -0.08 0.00 0.00 0.00 0.00 61.98 60.52 1ngw s VAL 110 Cb -0.15 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1ngw s VAL 110 CO 0.15 -0.72 0.10 0.28 0.00 0.00 0.00 175.10 174.91 1ngw s THR 111 N 1.44 5.19 -0.56 3.92 -1.32 -1.18 -1.86 115.64 121.27 1ngw s THR 111 Ca 0.04 0.11 -0.08 0.00 -1.21 0.00 0.00 61.69 60.55 1ngw s THR 111 Cb -0.26 -3.34 0.14 0.00 -1.51 0.00 0.00 72.50 67.54 1ngw s THR 111 CO 0.01 0.48 0.43 -0.69 -2.21 0.00 0.00 174.62 172.64 1ngw s VAL 112 N 0.11 4.31 0.07 5.08 1.01 -1.26 -2.37 120.40 127.35 1ngw s VAL 112 Ca 0.08 -2.16 0.03 0.00 0.00 0.00 0.00 61.98 59.92 1ngw s VAL 112 Cb -0.12 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1ngw s VAL 112 CO -0.00 -0.84 -0.09 -0.55 0.00 0.00 0.00 175.10 173.62 1ngw s SER 113 N 2.14 1.11 0.26 3.32 0.15 -1.20 -4.54 113.70 114.95 1ngw s SER 113 Ca 0.10 -0.69 0.13 0.00 0.70 0.00 0.00 55.95 56.19 1ngw s SER 113 Cb -0.22 0.03 0.24 0.00 -1.71 0.00 0.00 66.02 64.36 1ngw s SER 113 CO -0.03 -0.25 1.53 0.77 1.20 0.00 0.00 173.24 176.46 1ngw h SER 114 N 4.00 0.00 -2.17 5.45 4.64 -1.96 -3.38 113.55 120.14 1ngw h SER 114 Ca -0.37 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.57 1ngw h SER 114 Cb 1.19 0.00 0.21 0.00 -0.31 0.00 0.00 62.40 63.49 1ngw h SER 114 CO 0.47 0.63 -0.89 0.00 -0.87 0.00 0.00 176.83 176.17 1ngw n ALA 115 N -2.33 -3.34 -2.67 5.18 0.00 -1.26 -4.97 120.51 111.12 1ngw n ALA 115 Ca 0.00 -1.27 -0.34 0.00 0.00 0.00 0.00 53.44 51.83 1ngw n ALA 115 Cb 0.69 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 1ngw n ALA 115 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ngw s SER 116 N -1.90 5.13 0.15 0.00 0.01 -1.26 -4.99 113.70 110.84 1ngw s SER 116 Ca 0.50 0.10 -0.31 0.00 1.31 0.00 0.00 55.95 57.55 1ngw s SER 116 Cb -0.09 -1.41 -0.10 0.00 0.21 0.00 0.00 66.02 64.63 1ngw s SER 116 CO 0.56 0.36 1.62 0.28 0.41 0.00 0.00 173.24 176.48 1ngw s THR 117 N -0.90 2.58 -0.04 1.44 -1.32 -1.26 -4.85 115.64 111.29 1ngw s THR 117 Ca 0.14 0.36 0.02 0.00 -1.21 0.00 0.00 61.69 61.00 1ngw s THR 117 Cb -0.11 -3.23 0.01 0.00 -1.51 0.00 0.00 72.50 67.66 1ngw s THR 117 CO 0.03 0.02 -0.08 -0.75 -2.21 0.00 0.00 174.62 171.63 1ngw s LYS 118 N 1.47 1.08 0.38 7.08 2.20 -0.32 -4.99 119.74 126.65 1ngw s LYS 118 Ca 0.72 -0.26 -0.24 0.00 -0.36 0.00 0.00 55.97 55.83 1ngw s LYS 118 Cb -0.44 -0.98 -0.09 0.00 -1.51 0.00 0.00 37.83 34.80 1ngw s LYS 118 CO 0.32 0.03 1.04 0.20 -0.36 0.00 0.00 175.35 176.58 1ngw s GLY 119 N 0.54 2.75 0.45 5.54 0.00 -1.26 -1.88 107.32 113.46 1ngw s GLY 119 Ca -0.09 0.69 -0.21 0.00 0.00 0.00 0.00 44.72 45.11 1ngw s GLY 119 CO 0.01 1.13 0.98 2.56 0.00 0.00 0.00 173.10 177.78 1ngw s PRO 120 N -2.40 4.08 0.28 2.90 0.04 -1.26 -4.61 135.00 134.03 1ngw s PRO 120 Ca 0.56 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 1ngw s PRO 120 Cb -0.22 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 1ngw s PRO 120 CO 0.28 -0.17 0.49 -1.12 0.04 0.00 0.00 177.00 176.52 1ngw s SER 121 N -2.16 6.36 -0.14 6.66 0.01 -0.38 -4.92 113.70 119.13 1ngw s SER 121 Ca 0.64 0.47 -0.01 0.00 1.31 0.00 0.00 55.95 58.35 1ngw s SER 121 Cb -0.11 -2.04 0.04 0.00 0.21 0.00 0.00 66.02 64.12 1ngw s SER 121 CO 0.16 -0.18 -0.01 -0.69 0.41 0.00 0.00 173.24 172.92 1ngw s VAL 122 N -2.11 0.73 -0.06 3.43 1.01 -1.26 -1.58 120.40 120.55 1ngw s VAL 122 Ca 0.40 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.05 1ngw s VAL 122 Cb -0.10 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 1ngw s VAL 122 CO 0.32 0.09 -0.16 -0.36 0.00 0.00 0.00 175.10 174.99 1ngw s PHE 123 N 1.80 2.66 0.11 5.22 0.08 -0.07 -4.94 117.98 122.85 1ngw s PHE 123 Ca 0.02 -0.34 -0.30 0.00 0.12 0.00 0.00 56.93 56.43 1ngw s PHE 123 Cb -0.15 -1.65 -0.06 0.00 -0.57 0.00 0.00 43.02 40.59 1ngw s PHE 123 CO -0.07 0.05 0.99 -1.25 -0.10 0.00 0.00 175.22 174.83 1ngw s PRO 124 N -0.45 4.67 -0.70 0.24 0.04 -1.26 0.14 135.00 137.68 1ngw s PRO 124 Ca 0.05 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.40 1ngw s PRO 124 Cb -0.12 -3.37 0.12 0.00 0.04 0.00 0.00 34.50 31.18 1ngw s PRO 124 CO 0.02 0.18 0.82 -0.51 0.04 0.00 0.00 177.00 177.54 1ngw s LEU 125 N 0.01 5.45 0.32 -3.56 1.43 0.24 -4.87 118.68 117.70 1ngw s LEU 125 Ca 0.48 -1.71 -0.29 0.00 -1.03 0.00 0.00 54.13 51.58 1ngw s LEU 125 Cb -0.24 -2.32 -0.11 0.00 0.03 0.00 0.00 46.19 43.55 1ngw s LEU 125 CO 0.30 -1.05 1.50 0.00 0.23 0.00 0.00 176.35 177.33 1ngw s ALA 126 N 2.42 3.63 -0.03 4.21 0.00 -1.26 -1.92 121.76 128.82 1ngw s ALA 126 Ca 0.17 1.50 -0.30 0.00 0.00 0.00 0.00 51.96 53.34 1ngw s ALA 126 Cb -0.18 -3.60 -0.06 0.00 0.00 0.00 0.00 23.12 19.28 1ngw s ALA 126 CO 0.01 -0.94 1.65 -2.14 0.00 0.00 0.00 175.76 174.34 1ngw s PRO 127 N -1.24 4.19 -0.73 0.00 0.02 -1.26 -4.87 135.00 131.11 1ngw s PRO 127 Ca 0.57 2.21 -0.22 0.00 0.02 0.00 0.00 61.00 63.58 1ngw s PRO 127 Cb -0.45 -3.90 0.08 0.00 0.02 0.00 0.00 34.50 30.25 1ngw s PRO 127 CO 0.54 -0.81 1.02 -1.12 -0.33 0.00 0.00 177.00 176.30 1ngw s SER 128 N 3.12 6.28 0.00 2.53 0.01 -1.26 -3.90 113.70 120.48 1ngw s SER 128 Ca 0.73 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.78 1ngw s SER 128 Cb -0.34 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.46 1ngw s SER 128 CO 0.30 -1.38 0.59 -1.20 0.41 0.00 0.00 173.24 171.97 1ngw n SER 129 N 7.55 0.00 0.00 2.44 7.64 -1.26 -0.25 113.62 129.75 1ngw n SER 129 Ca 0.03 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1ngw n SER 129 Cb 0.46 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1ngw n SER 129 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ngw n LYS 130 N -1.09 2.75 -0.83 1.43 5.02 -1.26 -4.78 118.16 119.40 1ngw n LYS 130 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.24 1ngw n LYS 130 Cb 0.07 -0.86 0.20 0.00 -0.02 0.00 0.00 35.03 34.43 1ngw n LYS 130 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1ngw n SER 131 N -1.53 2.56 -2.87 4.39 7.64 -0.18 -4.65 113.62 118.99 1ngw n SER 131 Ca 0.00 -3.76 -0.12 0.00 1.01 0.00 0.00 58.87 56.00 1ngw n SER 131 Cb 0.33 -0.65 0.03 0.00 -1.01 0.00 0.00 64.21 62.91 1ngw n SER 131 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1ngw n THR 132 N -1.11 -0.16 -4.06 0.44 -1.04 0.66 -4.75 114.28 104.26 1ngw n THR 132 Ca 0.34 -2.24 -0.13 0.00 -2.04 0.00 0.00 64.05 59.98 1ngw n THR 132 Cb 1.07 0.66 -0.02 0.00 -1.82 0.00 0.00 70.33 70.22 1ngw n THR 132 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1ngw n SER 133 N 1.26 2.26 0.00 8.00 7.64 -1.26 -4.39 113.62 127.13 1ngw n SER 133 Ca 0.12 -1.91 0.00 0.00 1.01 0.00 0.00 58.87 58.09 1ngw n SER 133 Cb 0.62 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.91 1ngw n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ngw n GLY 134 N 2.26 1.71 1.44 0.23 0.00 -1.26 -4.54 105.19 105.03 1ngw n GLY 134 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1ngw n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ngw n GLY 135 N -0.69 2.89 3.34 -0.02 0.00 -1.26 -5.00 105.19 104.46 1ngw n GLY 135 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1ngw n GLY 135 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ngw s THR 136 N -1.97 1.99 0.04 2.61 -4.23 -1.26 -2.75 115.64 110.07 1ngw s THR 136 Ca 0.00 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 58.86 1ngw s THR 136 Cb 0.00 -1.81 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 1ngw s THR 136 CO 0.00 -0.04 -0.20 0.00 -0.54 0.00 0.00 174.62 173.84 1ngw s ALA 137 N -1.29 2.52 -0.07 3.99 0.00 0.18 -4.21 121.76 122.89 1ngw s ALA 137 Ca 0.12 -1.20 -0.00 0.00 0.00 0.00 0.00 51.96 50.87 1ngw s ALA 137 Cb -0.09 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 1ngw s ALA 137 CO 0.06 0.56 -0.03 0.00 0.00 0.00 0.00 175.76 176.35 1ngw s ALA 138 N -0.89 3.14 0.16 0.00 0.00 -1.26 -0.12 121.76 122.79 1ngw s ALA 138 Ca 0.14 -0.86 -0.15 0.00 0.00 0.00 0.00 51.96 51.09 1ngw s ALA 138 Cb -0.10 -1.35 0.02 0.00 0.00 0.00 0.00 23.12 21.69 1ngw s ALA 138 CO 0.04 0.59 0.41 -0.48 0.00 0.00 0.00 175.76 176.32 1ngw s LEU 139 N -0.92 0.44 0.00 0.00 0.05 -0.91 -4.37 118.68 112.96 1ngw s LEU 139 Ca 0.14 -0.49 0.00 0.00 0.05 0.00 0.00 54.13 53.82 1ngw s LEU 139 Cb -0.11 1.79 0.00 0.00 -2.05 0.00 0.00 46.19 45.82 1ngw s LEU 139 CO 0.03 -0.93 0.00 0.61 -0.55 0.00 0.00 176.35 175.51 1ngw n GLY 140 N -0.26 0.68 3.11 -3.48 0.00 -0.81 -0.27 105.19 104.17 1ngw n GLY 140 Ca -0.12 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.84 1ngw n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngw s LEU 142 N -0.12 3.99 -0.40 0.00 2.96 0.38 -1.07 118.68 124.42 1ngw s LEU 142 Ca 0.01 0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 53.93 1ngw s LEU 142 Cb -0.08 -2.06 0.09 0.00 0.50 0.00 0.00 46.19 44.63 1ngw s LEU 142 CO 0.01 0.07 0.20 -0.69 -1.32 0.00 0.00 176.35 174.61 1ngw s VAL 143 N 1.04 3.62 0.03 1.68 1.01 0.49 -0.89 120.40 127.38 1ngw s VAL 143 Ca 0.07 -1.70 0.09 0.00 0.00 0.00 0.00 61.98 60.43 1ngw s VAL 143 Cb -0.14 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1ngw s VAL 143 CO 0.04 -0.54 -0.26 -0.75 0.00 0.00 0.00 175.10 173.60 1ngw s LYS 144 N 1.27 1.85 -0.62 2.72 2.20 -0.62 0.31 119.74 126.86 1ngw s LYS 144 Ca 0.04 -1.05 -0.01 0.00 -0.36 0.00 0.00 55.97 54.59 1ngw s LYS 144 Cb -0.23 -1.96 -0.01 0.00 -1.51 0.00 0.00 37.83 34.12 1ngw s LYS 144 CO -0.01 0.51 0.57 -0.25 -0.36 0.00 0.00 175.35 175.81 1ngw n ASP 145 N 1.97 -6.13 -4.24 1.43 10.43 -1.07 -1.25 116.55 117.68 1ngw n ASP 145 Ca -0.17 -0.18 -0.14 0.00 2.57 0.00 0.00 54.79 56.88 1ngw n ASP 145 Cb 0.52 -4.19 -0.10 0.00 1.84 0.00 0.00 41.12 39.19 1ngw n ASP 145 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 1ngw s TYR 146 N -3.08 1.21 -0.28 1.24 -0.85 -0.82 -4.18 117.35 110.59 1ngw s TYR 146 Ca 0.09 -0.95 -0.23 0.00 -0.52 0.00 0.00 57.07 55.45 1ngw s TYR 146 Cb -0.01 -0.68 0.12 0.00 0.38 0.00 0.00 41.96 41.76 1ngw s TYR 146 CO 0.56 -0.14 0.98 0.12 -1.52 0.00 0.00 175.55 175.55 1ngw s PHE 147 N -3.58 -0.55 0.00 -3.49 5.36 -0.79 -0.24 117.98 114.70 1ngw s PHE 147 Ca 0.22 1.28 0.00 0.00 -0.96 0.00 0.00 56.93 57.47 1ngw s PHE 147 Cb 0.05 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 1ngw s PHE 147 CO 0.03 -0.27 0.00 -0.35 -1.46 0.00 0.00 175.22 173.17 1ngw n PRO 148 N 2.57 0.96 -1.41 10.12 -0.04 -1.26 -1.18 135.00 144.77 1ngw n PRO 148 Ca -0.14 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.00 1ngw n PRO 148 Cb 0.56 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.10 1ngw n PRO 148 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ngw s GLU 149 N -1.87 2.34 0.42 0.54 0.41 -1.26 -4.75 118.70 114.53 1ngw s GLU 149 Ca 0.00 1.33 0.07 0.00 -0.41 0.00 0.00 54.97 55.95 1ngw s GLU 149 Cb 0.00 -1.90 -0.06 0.00 -1.78 0.00 0.00 34.13 30.40 1ngw s GLU 149 CO 0.00 -1.60 0.13 -1.25 -0.49 0.00 0.00 175.26 172.05 1ngw s PRO 150 N -4.51 2.15 -0.03 0.39 0.04 -1.26 -4.84 135.00 126.94 1ngw s PRO 150 Ca 0.65 -1.95 0.02 0.00 0.04 0.00 0.00 61.00 59.76 1ngw s PRO 150 Cb -0.20 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.48 1ngw s PRO 150 CO 0.50 -0.12 -0.08 0.54 0.04 0.00 0.00 177.00 177.87 1ngw s VAL 151 N -2.65 0.76 -0.03 -0.36 0.11 -1.26 -4.48 120.40 112.50 1ngw s VAL 151 Ca 0.38 -0.33 0.02 0.00 -2.93 0.00 0.00 61.98 59.12 1ngw s VAL 151 Cb 0.05 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.17 1ngw s VAL 151 CO 0.20 0.25 -0.08 0.42 -3.33 0.00 0.00 175.10 172.56 1ngw s THR 152 N 0.35 3.57 -0.05 5.04 -4.23 -0.51 -4.95 115.64 114.87 1ngw s THR 152 Ca -0.06 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 59.77 1ngw s THR 152 Cb -0.10 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.27 1ngw s THR 152 CO 0.01 0.49 0.04 0.54 -0.54 0.00 0.00 174.62 175.16 1ngw s VAL 153 N -0.89 0.05 0.32 2.29 0.11 -1.26 -0.66 120.40 120.36 1ngw s VAL 153 Ca 0.15 0.33 0.10 0.00 -2.93 0.00 0.00 61.98 59.62 1ngw s VAL 153 Cb -0.11 -0.27 -0.06 0.00 -1.53 0.00 0.00 36.38 34.41 1ngw s VAL 153 CO 0.04 0.20 -0.12 -0.94 -3.33 0.00 0.00 175.10 170.96 1ngw s SER 154 N 2.08 3.63 -0.03 3.54 1.04 -0.56 -4.94 113.70 118.46 1ngw s SER 154 Ca 0.05 -1.15 0.02 0.00 0.48 0.00 0.00 55.95 55.34 1ngw s SER 154 Cb -0.12 -0.32 -0.03 0.00 0.10 0.00 0.00 66.02 65.64 1ngw s SER 154 CO -0.04 -0.15 -0.06 0.26 0.98 0.00 0.00 173.24 174.23 1ngw s TRP 155 N -2.61 2.94 -1.24 5.02 0.52 -1.26 0.06 118.94 122.37 1ngw s TRP 155 Ca 0.32 0.01 -0.29 0.00 0.02 0.00 0.00 56.10 56.15 1ngw s TRP 155 Cb 0.01 -1.66 0.03 0.00 -1.15 0.00 0.00 33.47 30.70 1ngw s TRP 155 CO 0.16 0.37 0.64 0.09 0.02 0.00 0.00 176.95 178.23 1ngw n ASN 156 N 1.81 -3.79 -3.01 2.95 5.03 0.99 0.06 115.26 119.29 1ngw n ASN 156 Ca -0.16 -1.26 -0.17 0.00 0.87 0.00 0.00 54.58 53.86 1ngw n ASN 156 Cb 0.53 -1.93 -0.01 0.00 -1.02 0.00 0.00 39.78 37.35 1ngw n ASN 156 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1ngw n SER 157 N -2.30 -3.09 0.00 6.41 7.64 -1.26 -0.09 113.62 120.93 1ngw n SER 157 Ca -0.13 -0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.65 1ngw n SER 157 Cb 0.58 -2.62 0.00 0.00 -1.01 0.00 0.00 64.21 61.16 1ngw n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ngw n GLY 158 N -0.93 1.04 0.15 0.23 0.00 0.11 -4.89 105.19 100.90 1ngw n GLY 158 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ngw n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngw h ALA 159 N 0.00 1.05 -3.05 4.61 0.00 -0.31 -3.42 119.26 118.14 1ngw h ALA 159 Ca 0.00 -0.49 -0.64 0.00 0.00 0.00 0.00 54.91 53.78 1ngw h ALA 159 Cb 0.00 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 17.48 1ngw h ALA 159 CO 0.00 0.67 -0.64 -1.17 0.00 0.00 0.00 179.25 178.11 1ngw s LEU 160 N -7.64 3.36 0.00 0.00 2.96 -1.13 -4.94 118.68 111.31 1ngw s LEU 160 Ca -0.01 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 1ngw s LEU 160 Cb 0.13 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.94 1ngw s LEU 160 CO 0.74 0.03 0.00 0.35 -1.32 0.00 0.00 176.35 176.15 1ngw n THR 161 N 4.51 0.00 -3.71 3.68 -2.24 -1.26 -4.04 114.28 111.23 1ngw n THR 161 Ca -0.17 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.26 1ngw n THR 161 Cb 0.52 1.57 -0.07 0.00 -2.10 0.00 0.00 70.33 70.24 1ngw n THR 161 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ngw s SER 162 N 0.00 6.31 0.00 3.42 0.01 -1.26 -4.01 113.70 118.17 1ngw s SER 162 Ca 0.00 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.62 1ngw s SER 162 Cb 0.00 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.12 1ngw s SER 162 CO 0.00 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.47 1ngw n GLY 163 N 3.17 0.76 3.73 3.44 0.00 -1.26 -4.73 105.19 110.29 1ngw n GLY 163 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1ngw n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ngw s VAL 164 N -2.74 4.96 -0.19 1.61 1.01 -1.26 -2.21 120.40 121.59 1ngw s VAL 164 Ca 0.00 1.51 -0.02 0.00 0.00 0.00 0.00 61.98 63.47 1ngw s VAL 164 Cb 0.00 -4.07 0.05 0.00 0.00 0.00 0.00 36.38 32.37 1ngw s VAL 164 CO 0.00 0.28 0.00 -1.00 0.00 0.00 0.00 175.10 174.38 1ngw s HIS 165 N 0.56 1.37 -0.36 5.22 3.76 -0.49 -5.00 115.29 120.35 1ngw s HIS 165 Ca 0.38 -1.01 -0.09 0.00 -0.15 0.00 0.00 55.06 54.19 1ngw s HIS 165 Cb -0.19 -1.16 0.03 0.00 1.11 0.00 0.00 32.58 32.37 1ngw s HIS 165 CO 0.20 -0.62 0.16 0.99 -0.85 0.00 0.00 174.74 174.62 1ngw s THR 166 N 1.74 4.24 0.53 1.30 2.01 -1.26 -1.10 115.64 123.10 1ngw s THR 166 Ca -0.01 -0.97 -0.20 0.00 0.31 0.00 0.00 61.69 60.82 1ngw s THR 166 Cb -0.17 -3.38 -0.06 0.00 0.01 0.00 0.00 72.50 68.90 1ngw s THR 166 CO -0.07 -0.21 1.11 -0.36 -0.69 0.00 0.00 174.62 174.40 1ngw s PHE 167 N 1.49 2.73 0.68 4.92 0.08 -0.84 -5.00 117.98 122.04 1ngw s PHE 167 Ca 0.00 1.55 -0.17 0.00 0.12 0.00 0.00 56.93 58.44 1ngw s PHE 167 Cb -0.19 -3.25 0.01 0.00 -0.57 0.00 0.00 43.02 39.02 1ngw s PHE 167 CO 0.05 -1.43 1.25 -2.14 -0.10 0.00 0.00 175.22 172.84 1ngw s PRO 168 N -3.27 2.42 0.52 0.24 0.02 -1.26 -4.52 135.00 129.16 1ngw s PRO 168 Ca 0.72 1.91 -0.21 0.00 0.02 0.00 0.00 61.00 63.44 1ngw s PRO 168 Cb -0.22 -1.85 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 1ngw s PRO 168 CO 0.26 -1.65 1.16 0.00 -0.33 0.00 0.00 177.00 176.43 1ngw s ALA 169 N -1.67 2.77 -0.08 -1.55 0.00 -1.26 -4.80 121.76 115.17 1ngw s ALA 169 Ca 0.78 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.69 1ngw s ALA 169 Cb -0.33 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.40 1ngw s ALA 169 CO 0.41 -0.80 -0.24 0.08 0.00 0.00 0.00 175.76 175.21 1ngw s VAL 170 N -1.66 2.13 -0.38 0.00 1.01 0.68 -4.94 120.40 117.23 1ngw s VAL 170 Ca 0.70 -1.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.45 1ngw s VAL 170 Cb -0.27 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.33 1ngw s VAL 170 CO 0.31 0.56 0.71 -0.22 0.00 0.00 0.00 175.10 176.46 1ngw s LEU 171 N 0.07 4.23 1.02 3.92 2.96 -1.26 -0.08 118.68 129.54 1ngw s LEU 171 Ca -0.10 0.13 -0.16 0.00 -0.22 0.00 0.00 54.13 53.78 1ngw s LEU 171 Cb -0.16 -2.89 0.20 0.00 0.50 0.00 0.00 46.19 43.85 1ngw s LEU 171 CO 0.06 -0.71 1.19 -1.10 -1.32 0.00 0.00 176.35 174.47 1ngw s GLN 172 N 2.95 0.24 0.26 1.98 -0.21 0.12 -4.93 119.66 120.07 1ngw s GLN 172 Ca 0.27 -0.05 0.00 0.00 0.02 0.00 0.00 55.36 55.61 1ngw s GLN 172 Cb -0.14 -1.77 0.36 0.00 1.00 0.00 0.00 33.01 32.46 1ngw s GLN 172 CO 0.17 -2.74 1.71 0.66 -2.12 0.00 0.00 175.29 172.97 1ngw h SER 173 N -1.88 0.59 0.00 5.90 4.64 -1.96 -2.42 113.55 118.42 1ngw h SER 173 Ca -0.47 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 60.66 1ngw h SER 173 Cb 1.29 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1ngw h SER 173 CO 0.45 0.80 0.14 0.77 -0.87 0.00 0.00 176.83 178.12 1ngw h SER 174 N 0.53 0.00 0.00 4.97 4.64 -2.02 -3.44 113.55 118.23 1ngw h SER 174 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1ngw h SER 174 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1ngw h SER 174 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1ngw n GLY 175 N -1.24 0.70 3.90 -0.77 0.00 -0.91 -5.06 105.19 101.82 1ngw n GLY 175 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1ngw n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ngw s LEU 176 N 0.00 4.30 0.12 0.99 1.43 -1.26 -4.87 118.68 119.39 1ngw s LEU 176 Ca 0.00 0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 53.19 1ngw s LEU 176 Cb 0.00 -2.88 -0.07 0.00 0.03 0.00 0.00 46.19 43.27 1ngw s LEU 176 CO 0.00 0.18 0.54 -0.31 0.23 0.00 0.00 176.35 176.99 1ngw s TYR 177 N -1.48 3.65 0.23 0.29 2.02 0.67 -0.70 117.35 122.03 1ngw s TYR 177 Ca 0.34 1.09 0.09 0.00 -0.37 0.00 0.00 57.07 58.22 1ngw s TYR 177 Cb -0.13 -2.38 -0.05 0.00 -0.40 0.00 0.00 41.96 39.00 1ngw s TYR 177 CO 0.27 0.48 -0.15 0.45 -1.57 0.00 0.00 175.55 175.02 1ngw s SER 178 N -1.56 2.89 -0.10 2.29 0.15 0.88 -1.95 113.70 116.31 1ngw s SER 178 Ca 0.35 -1.04 -0.32 0.00 0.70 0.00 0.00 55.95 55.65 1ngw s SER 178 Cb -0.16 -0.19 0.12 0.00 -1.71 0.00 0.00 66.02 64.08 1ngw s SER 178 CO 0.19 -0.12 1.04 -0.22 1.20 0.00 0.00 173.24 175.33 1ngw s LEU 179 N -3.38 -0.26 0.05 3.45 0.20 0.15 -0.23 118.68 118.66 1ngw s LEU 179 Ca 0.25 0.01 -0.01 0.00 0.69 0.00 0.00 54.13 55.07 1ngw s LEU 179 Cb -0.02 1.71 -0.04 0.00 -0.43 0.00 0.00 46.19 47.42 1ngw s LEU 179 CO 0.10 -0.43 -0.02 -0.94 -0.29 0.00 0.00 176.35 174.76 1ngw s SER 180 N -2.30 0.47 -0.06 3.68 1.04 -1.26 0.19 113.70 115.46 1ngw s SER 180 Ca 0.07 -0.98 -0.02 0.00 0.48 0.00 0.00 55.95 55.50 1ngw s SER 180 Cb -0.01 0.20 0.03 0.00 0.10 0.00 0.00 66.02 66.34 1ngw s SER 180 CO -0.07 -0.59 0.06 -0.55 0.98 0.00 0.00 173.24 173.07 1ngw s SER 181 N -2.87 1.34 0.45 7.02 0.15 -0.23 -1.98 113.70 117.57 1ngw s SER 181 Ca 0.06 -0.03 0.06 0.00 0.70 0.00 0.00 55.95 56.75 1ngw s SER 181 Cb 0.07 -0.18 -0.03 0.00 -1.71 0.00 0.00 66.02 64.18 1ngw s SER 181 CO -0.10 -0.26 0.22 0.68 1.20 0.00 0.00 173.24 174.98 1ngw s VAL 182 N 2.15 2.10 -0.27 4.45 -7.23 -0.26 -0.87 120.40 120.47 1ngw s VAL 182 Ca 0.05 -1.66 -0.18 0.00 -1.81 0.00 0.00 61.98 58.38 1ngw s VAL 182 Cb -0.13 -2.76 0.08 0.00 0.56 0.00 0.00 36.38 34.13 1ngw s VAL 182 CO -0.04 0.00 0.68 0.54 -0.31 0.00 0.00 175.10 175.97 1ngw s VAL 183 N -2.65 -0.00 -0.10 1.32 0.11 0.63 -1.40 120.40 118.30 1ngw s VAL 183 Ca 0.37 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.30 1ngw s VAL 183 Cb 0.02 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.84 1ngw s VAL 183 CO 0.21 0.00 0.29 0.42 -3.33 0.00 0.00 175.10 172.70 1ngw s THR 184 N 1.26 5.27 0.17 5.04 -4.23 -0.94 -2.15 115.64 120.06 1ngw s THR 184 Ca -0.07 0.56 -0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1ngw s THR 184 Cb -0.05 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 1ngw s THR 184 CO -0.14 0.50 0.19 0.68 -0.54 0.00 0.00 174.62 175.31 1ngw s VAL 185 N -0.32 0.06 0.23 2.29 -7.23 0.83 -4.70 120.40 111.57 1ngw s VAL 185 Ca 0.18 -1.69 -0.31 0.00 -1.81 0.00 0.00 61.98 58.35 1ngw s VAL 185 Cb -0.14 -2.08 -0.11 0.00 0.56 0.00 0.00 36.38 34.62 1ngw s VAL 185 CO 0.07 -0.27 1.58 -2.84 -0.31 0.00 0.00 175.10 173.32 1ngw s PRO 186 N -4.04 4.18 0.18 4.82 0.02 -1.26 0.50 135.00 139.39 1ngw s PRO 186 Ca 0.24 2.47 -0.13 0.00 0.02 0.00 0.00 61.00 63.60 1ngw s PRO 186 Cb 0.05 -3.08 0.14 0.00 0.02 0.00 0.00 34.50 31.63 1ngw s PRO 186 CO 0.04 -0.60 1.76 0.77 -0.33 0.00 0.00 177.00 178.63 1ngw h SER 187 N 5.74 0.22 0.00 2.53 0.02 -1.81 -2.50 113.55 117.75 1ngw h SER 187 Ca -0.45 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1ngw h SER 187 Cb 1.21 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.77 1ngw h SER 187 CO 0.85 0.16 0.41 0.77 -1.14 0.00 0.00 176.83 177.88 1ngw h SER 188 N 0.37 0.00 0.44 3.07 4.64 -1.90 -1.38 113.55 118.80 1ngw h SER 188 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1ngw h SER 188 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1ngw h SER 188 CO -0.21 0.00 -0.67 -1.54 -0.87 0.00 0.00 176.83 173.54 1ngw n SER 189 N -2.52 0.61 0.09 4.97 3.41 -0.94 -4.16 113.62 115.08 1ngw n SER 189 Ca -0.01 -0.34 0.19 0.00 -0.26 0.00 0.00 58.87 58.45 1ngw n SER 189 Cb 0.44 0.44 0.75 0.00 -0.26 0.00 0.00 64.21 65.58 1ngw n SER 189 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ngw h LEU 190 N 0.00 0.00 -0.92 1.04 -0.00 -1.39 0.14 115.31 114.18 1ngw h LEU 190 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1ngw h LEU 190 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 1ngw h LEU 190 CO 0.00 0.00 -0.16 0.61 -0.00 0.00 0.00 178.44 178.89 1ngw n GLY 191 N -1.52 -0.09 0.57 0.83 0.00 -1.26 -4.60 105.19 99.12 1ngw n GLY 191 Ca 0.07 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1ngw n GLY 191 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ngw n THR 192 N -0.01 0.00 -3.05 2.61 -2.24 -0.25 -5.07 114.28 106.28 1ngw n THR 192 Ca 0.14 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.53 1ngw n THR 192 Cb 0.40 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 67.95 1ngw n THR 192 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ngw s GLN 193 N -1.76 4.47 -0.20 -0.78 2.00 0.32 -5.06 119.66 118.66 1ngw s GLN 193 Ca 0.00 1.04 -0.09 0.00 -2.00 0.00 0.00 55.36 54.30 1ngw s GLN 193 Cb 0.00 -3.28 -0.05 0.00 0.80 0.00 0.00 33.01 30.48 1ngw s GLN 193 CO 0.00 0.51 0.12 0.95 -0.50 0.00 0.00 175.29 176.37 1ngw s THR 194 N -0.84 5.30 -0.21 -0.34 -4.23 -1.26 -4.71 115.64 109.35 1ngw s THR 194 Ca 0.35 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1ngw s THR 194 Cb -0.22 -3.41 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 1ngw s THR 194 CO 0.24 0.45 0.01 -0.31 -0.54 0.00 0.00 174.62 174.47 1ngw s TYR 195 N 0.34 3.06 -0.05 3.99 2.02 -1.26 -4.96 117.35 120.49 1ngw s TYR 195 Ca 0.07 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.38 1ngw s TYR 195 Cb -0.11 -2.10 0.00 0.00 -0.40 0.00 0.00 41.96 39.34 1ngw s TYR 195 CO -0.02 -0.24 -0.16 0.42 -1.57 0.00 0.00 175.55 173.99 1ngw s ILE 196 N 1.05 1.35 -0.14 2.71 1.01 -1.26 -0.86 121.20 125.06 1ngw s ILE 196 Ca 0.02 -0.65 -0.03 0.00 0.00 0.00 0.00 60.65 59.99 1ngw s ILE 196 Cb -0.14 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1ngw s ILE 196 CO 0.02 0.39 -0.02 0.00 0.00 0.00 0.00 174.94 175.34 1ngw s ASN 198 N -0.03 5.59 -0.12 0.00 0.01 0.11 -1.74 114.94 118.77 1ngw s ASN 198 Ca 0.02 -0.08 -0.00 0.00 -0.71 0.00 0.00 52.86 52.09 1ngw s ASN 198 Cb -0.13 -2.01 -0.02 0.00 0.41 0.00 0.00 41.25 39.50 1ngw s ASN 198 CO 0.02 -0.01 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.81 1ngw s VAL 199 N 1.48 3.31 -0.07 1.60 1.01 0.30 -1.50 120.40 126.53 1ngw s VAL 199 Ca 0.06 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.50 1ngw s VAL 199 Cb -0.15 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.85 1ngw s VAL 199 CO 0.06 0.54 -0.19 0.20 0.00 0.00 0.00 175.10 175.71 1ngw s ASN 200 N 0.05 2.48 -0.46 3.32 0.01 0.17 -1.31 114.94 119.20 1ngw s ASN 200 Ca -0.03 -0.43 0.03 0.00 -0.71 0.00 0.00 52.86 51.72 1ngw s ASN 200 Cb -0.14 -0.94 0.16 0.00 0.41 0.00 0.00 41.25 40.74 1ngw s ASN 200 CO 0.04 0.14 0.33 -2.28 -1.51 0.00 0.00 177.10 173.81 1ngw s HIS 201 N 0.26 1.62 0.22 2.20 5.65 -0.51 -1.42 115.29 123.31 1ngw s HIS 201 Ca -0.11 -2.40 -0.08 0.00 0.25 0.00 0.00 55.06 52.71 1ngw s HIS 201 Cb -0.15 -1.40 0.33 0.00 -1.18 0.00 0.00 32.58 30.18 1ngw s HIS 201 CO 0.05 -0.77 1.72 -0.22 -0.65 0.00 0.00 174.74 174.87 1ngw h LYS 202 N 6.03 0.32 -1.45 2.88 1.63 -1.80 -2.28 116.57 121.90 1ngw h LYS 202 Ca 0.16 -0.02 0.42 0.00 -0.85 0.00 0.00 60.65 60.36 1ngw h LYS 202 Cb 0.90 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.40 1ngw h LYS 202 CO 0.43 0.21 1.09 -1.35 -3.45 0.00 0.00 179.45 176.39 1ngw h PRO 203 N 0.33 0.00 -0.01 1.90 0.11 -1.86 0.40 132.00 132.88 1ngw h PRO 203 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1ngw h PRO 203 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.60 1ngw h PRO 203 CO -0.38 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.28 1ngw n SER 204 N -3.99 2.16 -3.78 -2.05 3.41 -0.97 -4.79 113.62 103.61 1ngw n SER 204 Ca 0.32 -2.44 -0.25 0.00 -0.26 0.00 0.00 58.87 56.24 1ngw n SER 204 Cb 1.55 -0.18 0.01 0.00 -0.26 0.00 0.00 64.21 65.33 1ngw n SER 204 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ngw n ASN 205 N -0.86 -1.82 -4.42 4.04 5.03 0.14 -4.93 115.26 112.43 1ngw n ASN 205 Ca 0.07 -0.93 -0.32 0.00 0.87 0.00 0.00 54.58 54.26 1ngw n ASN 205 Cb 0.41 -3.55 -0.14 0.00 -1.02 0.00 0.00 39.78 35.48 1ngw n ASN 205 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1ngw s THR 206 N -3.74 2.71 -0.08 3.41 2.01 -0.90 -5.02 115.64 114.05 1ngw s THR 206 Ca 0.11 -0.89 -0.03 0.00 0.31 0.00 0.00 61.69 61.20 1ngw s THR 206 Cb -0.04 -2.03 0.04 0.00 0.01 0.00 0.00 72.50 70.48 1ngw s THR 206 CO 0.85 0.57 0.12 -0.75 -0.69 0.00 0.00 174.62 174.72 1ngw s LYS 207 N -0.75 0.00 -0.02 4.92 2.20 -1.26 -1.42 119.74 123.41 1ngw s LYS 207 Ca 0.11 0.45 0.06 0.00 -0.36 0.00 0.00 55.97 56.23 1ngw s LYS 207 Cb -0.10 -0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 35.72 1ngw s LYS 207 CO 0.00 -0.35 -0.19 0.08 -0.36 0.00 0.00 175.35 174.54 1ngw s VAL 208 N 2.24 1.49 -0.13 4.02 1.01 -0.43 -5.00 120.40 123.61 1ngw s VAL 208 Ca 0.04 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1ngw s VAL 208 Cb -0.12 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.03 1ngw s VAL 208 CO -0.05 0.42 -0.20 -1.81 0.00 0.00 0.00 175.10 173.46 1ngw s ASP 209 N -0.37 2.90 -0.07 3.32 1.11 -1.26 -0.54 116.67 121.76 1ngw s ASP 209 Ca 0.06 -0.55 0.02 0.00 0.18 0.00 0.00 52.55 52.26 1ngw s ASP 209 Cb -0.08 -1.33 0.01 0.00 1.07 0.00 0.00 42.92 42.59 1ngw s ASP 209 CO -0.00 0.06 -0.12 -0.75 1.18 0.00 0.00 175.17 175.54 1ngw s LYS 210 N 0.84 1.72 -0.02 8.23 2.47 -0.71 -4.97 119.74 127.31 1ngw s LYS 210 Ca -0.08 -0.42 -0.20 0.00 -1.56 0.00 0.00 55.97 53.72 1ngw s LYS 210 Cb -0.15 -1.43 -0.05 0.00 -1.46 0.00 0.00 37.83 34.73 1ngw s LYS 210 CO -0.01 0.02 0.56 0.21 0.16 0.00 0.00 175.35 176.29 1ngw s LYS 211 N 0.69 4.28 -0.34 4.03 2.20 -1.26 -1.40 119.74 127.93 1ngw s LYS 211 Ca -0.14 0.65 -0.07 0.00 -0.36 0.00 0.00 55.97 56.06 1ngw s LYS 211 Cb -0.16 -3.34 0.04 0.00 -1.51 0.00 0.00 37.83 32.86 1ngw s LYS 211 CO 0.03 0.37 0.11 0.42 -0.36 0.00 0.00 175.35 175.93 1ngw s ILE 212 N -0.15 3.83 0.13 5.43 -1.09 -0.04 -4.94 121.20 124.37 1ngw s ILE 212 Ca 0.29 -1.13 0.06 0.00 -2.23 0.00 0.00 60.65 57.65 1ngw s ILE 212 Cb -0.18 -3.17 -0.04 0.00 -1.58 0.00 0.00 42.46 37.49 1ngw s ILE 212 CO 0.16 -0.19 0.01 0.68 -1.23 0.00 0.00 174.94 174.37 1ngw s VAL 213 N 1.41 3.94 0.18 2.92 -7.23 -1.26 -4.33 120.40 116.03 1ngw s VAL 213 Ca -0.01 -1.18 -0.33 0.00 -1.81 0.00 0.00 61.98 58.65 1ngw s VAL 213 Cb -0.20 -2.93 -0.12 0.00 0.56 0.00 0.00 36.38 33.69 1ngw s VAL 213 CO 0.03 0.00 1.70 -2.65 -0.31 0.00 0.00 175.10 173.87 1ngw n PRO 214 N 0.19 2.58 -2.41 4.82 -0.02 -1.26 -4.48 135.00 134.42 1ngw n PRO 214 Ca -0.10 0.93 -0.39 0.00 -2.02 0.00 0.00 63.50 61.92 1ngw n PRO 214 Cb 0.54 -2.76 -0.03 0.00 -0.02 0.00 0.00 33.50 31.22 1ngw n PRO 214 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ngw s LYS 215 N 1.32 4.33 0.00 -0.52 2.20 -1.25 -4.99 119.74 120.83 1ngw s LYS 215 Ca 0.77 1.78 0.00 0.00 -0.36 0.00 0.00 55.97 58.16 1ngw s LYS 215 Cb -0.56 -2.88 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 1ngw s LYS 215 CO 0.35 -0.06 0.33 0.43 -0.36 0.00 0.00 175.35 176.04