#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jwd s VAL 2 N 0.00 4.89 -0.03 3.84 0.11 -1.26 -4.36 120.40 123.59 3jwd s VAL 2 Ca 0.00 1.36 -0.20 0.00 -2.93 0.00 0.00 61.98 60.21 3jwd s VAL 2 Cb 0.00 -3.99 0.04 0.00 -1.53 0.00 0.00 36.38 30.90 3jwd s VAL 2 CO 0.00 0.38 0.43 -1.58 -3.33 0.00 0.00 175.10 171.00 3jwd s GLN 3 N -0.01 0.78 -0.35 1.54 0.74 -0.49 -5.01 119.66 116.85 3jwd s GLN 3 Ca 0.34 -0.03 0.01 0.00 0.05 0.00 0.00 55.36 55.73 3jwd s GLN 3 Cb -0.19 0.36 0.11 0.00 1.10 0.00 0.00 33.01 34.39 3jwd s GLN 3 CO 0.19 -0.22 0.12 -0.51 -0.55 0.00 0.00 175.29 174.31 3jwd s LEU 4 N -1.23 3.07 -0.42 3.68 1.43 -1.25 -2.27 118.68 121.70 3jwd s LEU 4 Ca -0.12 -2.03 -0.22 0.00 -1.03 0.00 0.00 54.13 50.73 3jwd s LEU 4 Cb -0.04 -1.13 0.02 0.00 0.03 0.00 0.00 46.19 45.07 3jwd s LEU 4 CO 0.06 -0.37 0.71 -0.69 0.23 0.00 0.00 176.35 176.29 3jwd s VAL 5 N 1.10 4.76 0.00 -1.59 1.01 -0.82 -4.06 120.40 120.80 3jwd s VAL 5 Ca 0.12 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3jwd s VAL 5 Cb -0.19 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 31.95 3jwd s VAL 5 CO -0.15 -0.59 0.00 0.00 0.00 0.00 0.00 175.10 174.36 3jwd n GLN 6 N 6.43 1.37 -3.52 2.72 6.02 -1.26 -0.26 117.38 128.88 3jwd n GLN 6 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.79 3jwd n GLN 6 Cb 0.48 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.72 3jwd n GLN 6 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3jwd s SER 7 N -1.00 5.26 0.91 1.08 1.04 -1.06 -4.82 113.70 115.11 3jwd s SER 7 Ca 0.00 -0.60 -0.12 0.00 0.48 0.00 0.00 55.95 55.71 3jwd s SER 7 Cb 0.00 -0.71 0.14 0.00 0.10 0.00 0.00 66.02 65.55 3jwd s SER 7 CO 0.00 -0.59 1.10 -0.83 0.98 0.00 0.00 173.24 173.89 3jwd s GLY 8 N -4.14 1.60 0.94 7.32 0.00 -1.26 -4.73 107.32 107.05 3jwd s GLY 8 Ca 0.48 -0.21 -0.11 0.00 0.00 0.00 0.00 44.72 44.88 3jwd s GLY 8 CO 0.29 0.31 1.10 0.00 0.00 0.00 0.00 173.10 174.80 3jwd s ALA 9 N -3.01 1.23 0.15 3.20 0.00 -1.26 -4.83 121.76 117.24 3jwd s ALA 9 Ca 0.64 0.26 -0.07 0.00 0.00 0.00 0.00 51.96 52.79 3jwd s ALA 9 Cb -0.17 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3jwd s ALA 9 CO 0.56 -2.73 0.22 -1.21 0.00 0.00 0.00 175.76 172.61 3jwd s GLU 10 N -4.71 1.07 -0.05 0.00 2.02 -0.73 -4.99 118.70 111.31 3jwd s GLU 10 Ca 0.65 -1.21 -0.02 0.00 0.02 0.00 0.00 54.97 54.41 3jwd s GLU 10 Cb -0.21 0.34 0.03 0.00 0.10 0.00 0.00 34.13 34.39 3jwd s GLU 10 CO 0.59 -0.37 0.04 0.08 0.02 0.00 0.00 175.26 175.62 3jwd s VAL 11 N -3.98 0.05 0.06 2.63 1.01 -1.26 -2.48 120.40 116.43 3jwd s VAL 11 Ca 0.17 0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.52 3jwd s VAL 11 Cb 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.13 3jwd s VAL 11 CO -0.01 0.20 -0.14 -0.54 0.00 0.00 0.00 175.10 174.61 3jwd s LYS 12 N 2.01 0.85 0.51 2.72 -0.14 -0.95 -4.99 119.74 119.74 3jwd s LYS 12 Ca 0.04 -0.89 -0.18 0.00 -1.36 0.00 0.00 55.97 53.57 3jwd s LYS 12 Cb -0.12 -0.86 -0.08 0.00 -1.68 0.00 0.00 37.83 35.09 3jwd s LYS 12 CO -0.04 0.20 1.02 0.15 -0.76 0.00 0.00 175.35 175.92 3jwd s LYS 13 N -1.56 3.78 0.26 1.68 1.02 -1.26 -3.18 119.74 120.48 3jwd s LYS 13 Ca -0.01 1.20 -0.31 0.00 0.02 0.00 0.00 55.97 56.87 3jwd s LYS 13 Cb -0.09 -2.10 -0.13 0.00 -0.52 0.00 0.00 37.83 34.99 3jwd s LYS 13 CO 0.02 -0.43 1.49 -2.30 -0.92 0.00 0.00 175.35 173.21 3jwd n PRO 14 N -1.30 2.30 0.00 -1.68 -0.02 -1.26 -1.96 135.00 131.07 3jwd n PRO 14 Ca 0.08 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 3jwd n PRO 14 Cb 0.53 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3jwd n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jwd n GLY 15 N 2.22 3.11 0.00 -1.23 0.00 -0.10 -4.89 105.19 104.30 3jwd n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3jwd n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jwd n ALA 16 N -0.65 0.00 -3.67 4.61 0.00 -0.83 -3.47 120.51 116.51 3jwd n ALA 16 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3jwd n ALA 16 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 3jwd n ALA 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3jwd s THR 17 N -0.27 -0.05 0.26 0.00 2.01 -1.26 -2.55 115.64 113.78 3jwd s THR 17 Ca 0.00 0.18 0.10 0.00 0.31 0.00 0.00 61.69 62.28 3jwd s THR 17 Cb 0.00 -0.15 -0.05 0.00 0.01 0.00 0.00 72.50 72.32 3jwd s THR 17 CO 0.00 0.07 -0.10 0.54 -0.69 0.00 0.00 174.62 174.44 3jwd s VAL 18 N 1.00 3.01 -0.28 3.82 0.11 -1.02 -4.97 120.40 122.07 3jwd s VAL 18 Ca -0.08 -2.07 -0.01 0.00 -2.93 0.00 0.00 61.98 56.89 3jwd s VAL 18 Cb -0.11 -2.58 0.13 0.00 -1.53 0.00 0.00 36.38 32.29 3jwd s VAL 18 CO -0.04 -0.34 0.27 -0.75 -3.33 0.00 0.00 175.10 170.91 3jwd s LYS 19 N -3.46 0.30 0.18 1.54 2.20 -1.26 -1.26 119.74 117.98 3jwd s LYS 19 Ca 0.30 -0.15 -0.04 0.00 -0.36 0.00 0.00 55.97 55.72 3jwd s LYS 19 Cb -0.06 -0.75 -0.05 0.00 -1.51 0.00 0.00 37.83 35.46 3jwd s LYS 19 CO 0.17 -0.99 0.41 0.96 -0.36 0.00 0.00 175.35 175.54 3jwd s ILE 20 N 2.33 5.14 0.38 5.43 -4.36 -1.13 -4.88 121.20 124.11 3jwd s ILE 20 Ca 0.09 -0.03 0.08 0.00 -0.26 0.00 0.00 60.65 60.53 3jwd s ILE 20 Cb -0.14 -3.66 -0.05 0.00 1.25 0.00 0.00 42.46 39.85 3jwd s ILE 20 CO -0.32 -0.07 0.11 -0.94 0.24 0.00 0.00 174.94 173.97 3jwd s SER 21 N -2.71 4.35 -0.31 4.36 1.04 -1.26 -1.44 113.70 117.73 3jwd s SER 21 Ca 0.41 -1.03 0.05 0.00 0.48 0.00 0.00 55.95 55.86 3jwd s SER 21 Cb -0.12 -0.53 0.18 0.00 0.10 0.00 0.00 66.02 65.66 3jwd s SER 21 CO 0.26 -0.41 0.51 0.00 0.98 0.00 0.00 173.24 174.59 3jwd s LYS 23 N 2.50 3.94 -0.01 0.00 2.47 0.65 -1.97 119.74 127.31 3jwd s LYS 23 Ca 0.11 1.82 0.08 0.00 -1.56 0.00 0.00 55.97 56.43 3jwd s LYS 23 Cb -0.10 -2.57 -0.02 0.00 -1.46 0.00 0.00 37.83 33.67 3jwd s LYS 23 CO -0.24 -0.41 -0.25 0.00 0.16 0.00 0.00 175.35 174.61 3jwd s ALA 24 N -1.46 2.12 -0.18 3.13 0.00 -0.54 -1.95 121.76 122.88 3jwd s ALA 24 Ca 0.60 -1.12 -0.16 0.00 0.00 0.00 0.00 51.96 51.28 3jwd s ALA 24 Cb -0.30 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.35 3jwd s ALA 24 CO 0.37 0.52 0.47 -1.54 0.00 0.00 0.00 175.76 175.58 3jwd s SER 25 N -0.72 -0.51 0.00 0.00 1.04 -0.96 -4.93 113.70 107.62 3jwd s SER 25 Ca 0.10 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.49 3jwd s SER 25 Cb -0.10 0.96 0.00 0.00 0.10 0.00 0.00 66.02 66.98 3jwd s SER 25 CO -0.00 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.66 3jwd n GLY 26 N 3.02 2.31 3.23 7.32 0.00 -1.26 -1.40 105.19 118.41 3jwd n GLY 26 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 3jwd n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3jwd s TYR 27 N -2.23 0.72 -0.37 1.61 -0.85 -1.26 -4.83 117.35 110.14 3jwd s TYR 27 Ca 0.00 -1.08 -0.29 0.00 -0.52 0.00 0.00 57.07 55.19 3jwd s TYR 27 Cb 0.00 -0.33 -0.00 0.00 0.38 0.00 0.00 41.96 42.01 3jwd s TYR 27 CO 0.00 -0.61 1.61 0.99 -1.52 0.00 0.00 175.55 176.02 3jwd s THR 28 N -4.03 3.68 0.16 -3.49 2.01 -1.26 -4.90 115.64 107.82 3jwd s THR 28 Ca 0.23 0.69 -0.14 0.00 0.31 0.00 0.00 61.69 62.78 3jwd s THR 28 Cb 0.06 -3.92 0.05 0.00 0.01 0.00 0.00 72.50 68.70 3jwd s THR 28 CO 0.02 -0.58 1.79 0.15 -0.69 0.00 0.00 174.62 175.31 3jwd h PHE 29 N 11.81 0.67 0.00 4.92 3.57 -1.96 -2.91 116.94 133.04 3jwd h PHE 29 Ca -0.31 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.19 3jwd h PHE 29 Cb 1.14 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.66 3jwd h PHE 29 CO 0.96 0.47 0.00 -1.13 -2.23 0.00 0.00 178.31 176.39 3jwd n SER 30 N -4.68 0.00 -0.51 0.41 3.41 -1.26 -3.25 113.62 107.73 3jwd n SER 30 Ca 0.02 -1.48 0.05 0.00 -0.26 0.00 0.00 58.87 57.21 3jwd n SER 30 Cb 0.06 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.10 3jwd n SER 30 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3jwd n ASP 31 N -0.73 2.31 -4.16 4.04 8.00 -1.10 -4.15 116.55 120.75 3jwd n ASP 31 Ca 0.11 -1.67 -0.10 0.00 0.71 0.00 0.00 54.79 53.83 3jwd n ASP 31 Cb 0.05 -0.09 -0.10 0.00 -0.02 0.00 0.00 41.12 40.96 3jwd n ASP 31 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3jwd s PHE 32 N -0.95 0.86 -0.00 1.24 0.40 -1.20 -5.10 117.98 113.23 3jwd s PHE 32 Ca 0.17 -0.93 -0.29 0.00 -0.60 0.00 0.00 56.93 55.28 3jwd s PHE 32 Cb 0.10 -0.50 -0.03 0.00 0.51 0.00 0.00 43.02 43.09 3jwd s PHE 32 CO 0.14 -0.17 0.92 0.71 0.70 0.00 0.00 175.22 177.52 3jwd s TYR 33 N -3.65 3.66 -0.23 0.36 1.51 -1.26 -4.35 117.35 113.38 3jwd s TYR 33 Ca 0.11 1.62 -0.08 0.00 -1.01 0.00 0.00 57.07 57.71 3jwd s TYR 33 Cb 0.06 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.82 3jwd s TYR 33 CO -0.05 0.04 0.08 1.41 -1.11 0.00 0.00 175.55 175.92 3jwd s MET 34 N 0.85 3.80 0.42 -0.62 -2.45 -0.90 -4.06 119.30 116.35 3jwd s MET 34 Ca 0.49 -0.41 0.08 0.00 -1.25 0.00 0.00 55.69 54.59 3jwd s MET 34 Cb -0.21 -3.33 -0.00 0.00 1.25 0.00 0.00 34.83 32.54 3jwd s MET 34 CO 0.26 -0.03 0.50 0.71 1.05 0.00 0.00 175.02 177.50 3jwd s TYR 35 N 1.22 2.72 -0.06 4.11 1.51 -0.87 -2.32 117.35 123.67 3jwd s TYR 35 Ca 0.05 -0.45 -0.02 0.00 -1.01 0.00 0.00 57.07 55.64 3jwd s TYR 35 Cb -0.14 -2.29 0.04 0.00 -0.11 0.00 0.00 41.96 39.46 3jwd s TYR 35 CO 0.04 -0.32 0.11 -1.58 -1.11 0.00 0.00 175.55 172.69 3jwd s TRP 36 N -2.41 -0.09 0.25 2.71 0.52 -1.08 -2.83 118.94 116.01 3jwd s TRP 36 Ca 0.52 0.40 0.09 0.00 0.02 0.00 0.00 56.10 57.13 3jwd s TRP 36 Cb -0.07 -0.21 -0.05 0.00 -1.15 0.00 0.00 33.47 31.99 3jwd s TRP 36 CO 0.31 -0.18 -0.14 0.08 0.02 0.00 0.00 176.95 177.05 3jwd s VAL 37 N 1.53 1.93 0.24 4.03 1.01 -1.18 -1.12 120.40 126.84 3jwd s VAL 37 Ca -0.05 -2.24 0.01 0.00 0.00 0.00 0.00 61.98 59.70 3jwd s VAL 37 Cb -0.12 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 3jwd s VAL 37 CO -0.05 -0.47 0.14 0.00 0.00 0.00 0.00 175.10 174.72 3jwd s ARG 38 N -3.63 1.37 -0.25 2.72 1.70 -0.04 -0.34 118.95 120.48 3jwd s ARG 38 Ca 0.26 -1.75 -0.04 0.00 -0.47 0.00 0.00 55.73 53.74 3jwd s ARG 38 Cb -0.01 0.06 0.14 0.00 -0.57 0.00 0.00 34.95 34.57 3jwd s ARG 38 CO 0.10 -0.39 0.48 -1.14 -1.08 0.00 0.00 175.30 173.27 3jwd s GLN 39 N -4.01 0.43 1.14 3.89 0.74 0.81 -2.04 119.66 120.62 3jwd s GLN 39 Ca 0.38 0.89 -0.13 0.00 0.05 0.00 0.00 55.36 56.56 3jwd s GLN 39 Cb 0.07 0.15 0.26 0.00 1.10 0.00 0.00 33.01 34.59 3jwd s GLN 39 CO 0.15 -0.49 0.99 0.00 -0.55 0.00 0.00 175.29 175.39 3jwd n ALA 40 N 5.40 -2.68 -1.55 1.58 0.00 -1.26 -0.93 120.51 121.06 3jwd n ALA 40 Ca -0.05 -1.10 -0.39 0.00 0.00 0.00 0.00 53.44 51.89 3jwd n ALA 40 Cb 0.50 -2.01 -0.04 0.00 0.00 0.00 0.00 19.45 17.90 3jwd n ALA 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3jwd n PRO 41 N -4.74 1.22 -0.85 0.00 -0.02 -1.26 -2.40 135.00 126.94 3jwd n PRO 41 Ca 0.04 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3jwd n PRO 41 Cb 0.54 -3.19 0.00 0.00 -0.02 0.00 0.00 33.50 30.83 3jwd n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jwd n GLY 42 N 6.03 0.37 4.00 -1.23 0.00 -1.26 -4.98 105.19 108.11 3jwd n GLY 42 Ca 0.37 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.21 3jwd n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jwd s LYS 43 N -0.76 2.71 0.99 1.61 1.02 -1.01 -5.08 119.74 119.23 3jwd s LYS 43 Ca 0.00 -1.13 -0.11 0.00 0.02 0.00 0.00 55.97 54.75 3jwd s LYS 43 Cb 0.00 -2.67 0.19 0.00 -0.52 0.00 0.00 37.83 34.83 3jwd s LYS 43 CO 0.00 -0.44 1.10 0.20 -0.92 0.00 0.00 175.35 175.29 3jwd s GLY 44 N -4.39 1.63 0.47 -3.33 0.00 -1.26 -4.37 107.32 96.07 3jwd s GLY 44 Ca 0.56 0.30 -0.23 0.00 0.00 0.00 0.00 44.72 45.36 3jwd s GLY 44 CO 0.35 0.82 1.16 1.08 0.00 0.00 0.00 173.10 176.51 3jwd s LEU 45 N -6.78 3.99 -0.09 0.66 1.43 -1.26 -4.34 118.68 112.29 3jwd s LEU 45 Ca 0.67 2.29 -0.03 0.00 -1.03 0.00 0.00 54.13 56.03 3jwd s LEU 45 Cb -0.23 -4.28 0.05 0.00 0.03 0.00 0.00 46.19 41.76 3jwd s LEU 45 CO 0.60 -0.95 0.13 -0.70 0.23 0.00 0.00 176.35 175.67 3jwd s GLU 46 N -2.76 0.02 0.19 1.70 2.12 -0.86 -5.03 118.70 114.07 3jwd s GLU 46 Ca 0.64 0.41 -0.29 0.00 0.36 0.00 0.00 54.97 56.09 3jwd s GLU 46 Cb -0.28 -0.59 -0.08 0.00 0.26 0.00 0.00 34.13 33.44 3jwd s GLU 46 CO 0.34 -0.38 0.92 -0.46 -0.54 0.00 0.00 175.26 175.14 3jwd s TRP 47 N 2.25 3.92 -0.12 5.30 -0.00 -1.26 -0.86 118.94 128.17 3jwd s TRP 47 Ca 0.04 1.84 -0.10 0.00 -0.00 0.00 0.00 56.10 57.88 3jwd s TRP 47 Cb -0.13 -2.97 -0.05 0.00 -0.00 0.00 0.00 33.47 30.32 3jwd s TRP 47 CO -0.06 0.39 -0.21 -1.33 -0.00 0.00 0.00 176.95 175.73 3jwd n MET 48 N 1.93 0.34 -0.60 5.86 2.81 -0.27 -4.69 117.12 122.50 3jwd n MET 48 Ca -0.01 0.14 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 3jwd n MET 48 Cb 0.48 -1.08 0.00 0.00 -0.71 0.00 0.00 33.22 31.91 3jwd n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3jwd n GLY 49 N 2.12 2.44 3.82 3.03 0.00 -1.18 0.17 105.19 115.59 3jwd n GLY 49 Ca -0.20 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 44.85 3jwd n GLY 49 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3jwd s LEU 50 N 0.00 -0.20 -0.28 0.99 0.05 -0.62 -2.62 118.68 116.00 3jwd s LEU 50 Ca 0.00 -0.57 -0.24 0.00 0.05 0.00 0.00 54.13 53.37 3jwd s LEU 50 Cb 0.00 2.49 0.10 0.00 -2.05 0.00 0.00 46.19 46.73 3jwd s LEU 50 CO 0.00 -1.19 0.88 -0.51 -0.55 0.00 0.00 176.35 174.99 3jwd s ILE 51 N -3.49 0.00 -0.46 1.48 2.07 -0.98 -2.51 121.20 117.31 3jwd s ILE 51 Ca 0.12 0.00 -0.15 0.00 -1.41 0.00 0.00 60.65 59.21 3jwd s ILE 51 Cb -0.04 -1.00 0.07 0.00 0.13 0.00 0.00 42.46 41.62 3jwd s ILE 51 CO 0.05 0.00 0.38 -0.62 -1.91 0.00 0.00 174.94 172.84 3jwd s ASP 52 N 0.49 6.10 0.48 4.50 2.15 -0.88 -2.12 116.67 127.39 3jwd s ASP 52 Ca -0.00 -1.30 0.20 0.00 0.43 0.00 0.00 52.55 51.87 3jwd s ASP 52 Cb -0.05 -2.17 1.22 0.00 -0.30 0.00 0.00 42.92 41.62 3jwd s ASP 52 CO -0.05 -0.62 1.99 -0.65 -0.17 0.00 0.00 175.17 175.66 3jwd h PRO 52 N 8.72 0.19 0.46 4.34 0.11 -1.84 0.44 132.00 144.42 3jwd h PRO 52 Ca -0.28 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 3jwd h PRO 52 Cb 1.11 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3jwd h PRO 52 CO 0.86 0.13 -0.33 1.49 -0.21 0.00 0.00 178.00 179.93 3jwd h GLU 53 N 0.20 -0.74 -0.27 1.05 4.57 -1.93 -3.25 114.58 114.20 3jwd h GLU 53 Ca 0.26 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.50 3jwd h GLU 53 Cb 0.78 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.54 3jwd h GLU 53 CO -0.05 -0.50 0.00 -0.25 -1.18 0.00 0.00 179.01 177.04 3jwd n ASP 54 N -5.46 2.78 -1.46 1.04 8.00 -1.17 -4.99 116.55 115.30 3jwd n ASP 54 Ca -0.11 -2.06 -0.16 0.00 0.71 0.00 0.00 54.79 53.17 3jwd n ASP 54 Cb 0.35 -0.20 -0.04 0.00 -0.02 0.00 0.00 41.12 41.21 3jwd n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3jwd n ALA 55 N 0.24 -0.34 -1.96 2.24 0.00 0.13 -4.92 120.51 115.90 3jwd n ALA 55 Ca 0.10 0.19 -0.41 0.00 0.00 0.00 0.00 53.44 53.32 3jwd n ALA 55 Cb 0.42 -1.71 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 3jwd n ALA 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3jwd s ASP 56 N -2.59 5.58 0.12 0.00 -0.00 -1.14 -4.82 116.67 113.83 3jwd s ASP 56 Ca 0.00 1.05 0.03 0.00 -0.00 0.00 0.00 52.55 53.63 3jwd s ASP 56 Cb 0.00 -2.52 -0.04 0.00 -0.00 0.00 0.00 42.92 40.36 3jwd s ASP 56 CO 0.00 -2.00 0.16 0.42 -0.00 0.00 0.00 175.17 173.75 3jwd s THR 57 N 7.98 4.81 -0.20 -1.27 -4.23 -1.26 -2.07 115.64 119.40 3jwd s THR 57 Ca 0.79 -0.80 -0.04 0.00 -1.18 0.00 0.00 61.69 60.46 3jwd s THR 57 Cb -0.20 -3.40 0.10 0.00 1.34 0.00 0.00 72.50 70.34 3jwd s THR 57 CO 0.30 0.00 0.27 -0.04 -0.54 0.00 0.00 174.62 174.61 3jwd s MET 58 N -2.83 0.23 0.10 3.99 -1.94 -1.04 -4.99 119.30 112.81 3jwd s MET 58 Ca 0.32 0.40 0.04 0.00 -1.71 0.00 0.00 55.69 54.74 3jwd s MET 58 Cb -0.11 -0.78 -0.04 0.00 2.01 0.00 0.00 34.83 35.91 3jwd s MET 58 CO 0.25 -0.58 0.05 0.71 -0.01 0.00 0.00 175.02 175.44 3jwd s TYR 59 N 2.41 3.08 0.85 -0.03 1.51 -1.26 -1.59 117.35 122.31 3jwd s TYR 59 Ca 0.07 0.00 -0.11 0.00 -1.01 0.00 0.00 57.07 56.03 3jwd s TYR 59 Cb -0.15 -1.55 0.10 0.00 -0.11 0.00 0.00 41.96 40.25 3jwd s TYR 59 CO -0.12 0.50 1.09 0.00 -1.11 0.00 0.00 175.55 175.91 3jwd s ALA 60 N -1.44 1.80 0.23 3.71 0.00 0.13 -4.86 121.76 121.33 3jwd s ALA 60 Ca 0.28 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.27 3jwd s ALA 60 Cb -0.11 -3.24 0.25 0.00 0.00 0.00 0.00 23.12 20.02 3jwd s ALA 60 CO 0.20 -2.16 1.88 1.49 0.00 0.00 0.00 175.76 177.18 3jwd h GLU 61 N -1.41 1.06 0.00 0.00 4.81 -1.93 -2.75 114.58 114.37 3jwd h GLU 61 Ca -0.47 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 3jwd h GLU 61 Cb 1.26 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 3jwd h GLU 61 CO 0.52 0.70 -0.14 -0.22 -0.73 0.00 0.00 179.01 179.14 3jwd h LYS 62 N 1.09 0.00 -0.17 1.92 3.64 -1.95 -3.10 116.57 118.00 3jwd h LYS 62 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 3jwd h LYS 62 Cb -0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3jwd h LYS 62 CO -0.11 0.14 0.00 1.19 -2.27 0.00 0.00 179.45 178.41 3jwd n PHE 63 N -4.09 0.22 -1.82 1.91 3.01 -1.05 -5.00 117.46 110.63 3jwd n PHE 63 Ca -0.02 -0.21 -0.41 0.00 1.01 0.00 0.00 57.45 57.82 3jwd n PHE 63 Cb 0.22 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.69 3jwd n PHE 63 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3jwd s ARG 64 N -1.02 4.01 -1.52 -1.08 0.52 -1.13 -1.74 118.95 116.99 3jwd s ARG 64 Ca 0.19 2.51 -0.06 0.00 -0.52 0.00 0.00 55.73 57.86 3jwd s ARG 64 Cb 0.12 -2.89 0.01 0.00 0.52 0.00 0.00 34.95 32.71 3jwd s ARG 64 CO 0.16 -0.59 0.73 0.41 0.02 0.00 0.00 175.30 176.03 3jwd n GLY 65 N 0.50 -0.53 0.00 -3.53 0.00 -1.26 -4.72 105.19 95.66 3jwd n GLY 65 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3jwd n GLY 65 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3jwd n ARG 66 N -4.24 0.00 -4.41 1.61 0.63 -0.95 -5.08 116.66 104.22 3jwd n ARG 66 Ca -0.09 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.55 3jwd n ARG 66 Cb 0.61 -0.16 -0.12 0.00 0.45 0.00 0.00 32.46 33.24 3jwd n ARG 66 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3jwd s VAL 67 N -1.00 2.84 -0.19 5.15 0.11 -0.71 -4.50 120.40 122.11 3jwd s VAL 67 Ca 0.00 -1.40 -0.04 0.00 -2.93 0.00 0.00 61.98 57.61 3jwd s VAL 67 Cb 0.00 -2.27 0.06 0.00 -1.53 0.00 0.00 36.38 32.64 3jwd s VAL 67 CO 0.00 0.17 0.08 -0.89 -3.33 0.00 0.00 175.10 171.13 3jwd s THR 68 N -1.08 0.12 -0.35 5.04 2.01 0.17 -4.95 115.64 116.60 3jwd s THR 68 Ca 0.17 -0.34 -0.17 0.00 0.31 0.00 0.00 61.69 61.66 3jwd s THR 68 Cb -0.11 -0.76 -0.00 0.00 0.01 0.00 0.00 72.50 71.64 3jwd s THR 68 CO 0.09 -0.29 0.46 -0.63 -0.69 0.00 0.00 174.62 173.55 3jwd s ILE 69 N 2.04 5.07 0.52 1.82 1.01 -1.26 -1.44 121.20 128.95 3jwd s ILE 69 Ca 0.02 0.18 0.06 0.00 0.00 0.00 0.00 60.65 60.91 3jwd s ILE 69 Cb -0.16 -3.92 0.03 0.00 0.01 0.00 0.00 42.46 38.41 3jwd s ILE 69 CO -0.11 -0.20 0.41 0.42 0.00 0.00 0.00 174.94 175.47 3jwd s THR 70 N 2.25 1.90 -0.30 2.92 -4.23 -1.12 -4.94 115.64 112.12 3jwd s THR 70 Ca 0.16 -1.44 -0.08 0.00 -1.18 0.00 0.00 61.69 59.15 3jwd s THR 70 Cb -0.16 -2.34 0.16 0.00 1.34 0.00 0.00 72.50 71.50 3jwd s THR 70 CO 0.13 0.00 0.70 0.00 -0.54 0.00 0.00 174.62 174.91 3jwd s ALA 71 N -2.70 -2.29 -0.50 3.99 0.00 -1.26 -1.47 121.76 117.53 3jwd s ALA 71 Ca 0.39 2.09 -0.24 0.00 0.00 0.00 0.00 51.96 54.20 3jwd s ALA 71 Cb -0.02 -1.99 0.03 0.00 0.00 0.00 0.00 23.12 21.14 3jwd s ALA 71 CO 0.24 -1.10 0.87 0.34 0.00 0.00 0.00 175.76 176.11 3jwd s ASP 72 N 2.83 6.40 0.00 0.00 2.15 0.42 -4.90 116.67 123.57 3jwd s ASP 72 Ca 0.04 -0.19 0.24 0.00 0.43 0.00 0.00 52.55 53.07 3jwd s ASP 72 Cb -0.12 -2.42 1.14 0.00 -0.30 0.00 0.00 42.92 41.22 3jwd s ASP 72 CO -0.19 -1.07 1.77 0.35 -0.17 0.00 0.00 175.17 175.86 3jwd n THR 73 N 6.21 0.29 -0.01 1.71 -2.24 -1.26 -1.20 114.28 117.78 3jwd n THR 73 Ca 0.03 0.07 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 3jwd n THR 73 Cb 0.48 -0.68 -0.14 0.00 -2.10 0.00 0.00 70.33 67.89 3jwd n THR 73 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3jwd n SER 74 N -1.34 1.58 -0.59 3.42 3.41 -1.26 -4.30 113.62 114.54 3jwd n SER 74 Ca 0.10 0.29 0.06 0.00 -0.26 0.00 0.00 58.87 59.06 3jwd n SER 74 Cb 0.21 -0.51 0.10 0.00 -0.26 0.00 0.00 64.21 63.75 3jwd n SER 74 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3jwd n THR 75 N -3.29 0.42 -3.59 6.66 -2.24 -1.18 -5.00 114.28 106.06 3jwd n THR 75 Ca -0.26 -0.71 -0.21 0.00 -2.27 0.00 0.00 64.05 60.61 3jwd n THR 75 Cb 1.05 0.94 0.05 0.00 -2.10 0.00 0.00 70.33 70.27 3jwd n THR 75 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3jwd n ASP 76 N 0.67 -2.42 -3.76 3.42 8.00 -0.34 -4.82 116.55 117.31 3jwd n ASP 76 Ca 0.10 -0.79 -0.22 0.00 0.71 0.00 0.00 54.79 54.59 3jwd n ASP 76 Cb 0.37 -4.35 -0.18 0.00 -0.02 0.00 0.00 41.12 36.94 3jwd n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3jwd s THR 77 N -3.55 0.31 0.01 -3.53 2.01 -0.95 -1.47 115.64 108.47 3jwd s THR 77 Ca 0.10 0.16 -0.11 0.00 0.31 0.00 0.00 61.69 62.15 3jwd s THR 77 Cb -0.02 -0.48 -0.05 0.00 0.01 0.00 0.00 72.50 71.95 3jwd s THR 77 CO 0.79 0.25 0.35 -0.83 -0.69 0.00 0.00 174.62 174.49 3jwd s GLY 78 N 1.95 2.36 0.42 4.40 0.00 -0.83 -0.43 107.32 115.19 3jwd s GLY 78 Ca 0.04 -0.37 0.06 0.00 0.00 0.00 0.00 44.72 44.46 3jwd s GLY 78 CO -0.05 -0.09 0.01 -0.19 0.00 0.00 0.00 173.10 172.78 3jwd s TYR 79 N -1.19 2.46 -0.29 1.90 1.51 -0.54 -0.77 117.35 120.42 3jwd s TYR 79 Ca 0.26 -0.69 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 3jwd s TYR 79 Cb -0.15 -1.77 0.14 0.00 -0.11 0.00 0.00 41.96 40.08 3jwd s TYR 79 CO 0.14 0.43 0.34 -1.17 -1.11 0.00 0.00 175.55 174.17 3jwd s LEU 80 N -3.72 -0.41 -0.22 -1.29 2.96 -0.52 -2.80 118.68 112.67 3jwd s LEU 80 Ca 0.33 -0.68 -0.19 0.00 -0.22 0.00 0.00 54.13 53.37 3jwd s LEU 80 Cb 0.09 0.71 -0.03 0.00 0.50 0.00 0.00 46.19 47.46 3jwd s LEU 80 CO 0.17 -0.37 0.54 -0.70 -1.32 0.00 0.00 176.35 174.66 3jwd s GLU 81 N 2.38 4.16 0.29 1.98 2.12 -0.52 -2.84 118.70 126.26 3jwd s GLU 81 Ca 0.10 0.42 0.10 0.00 0.36 0.00 0.00 54.97 55.96 3jwd s GLU 81 Cb -0.13 -3.59 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 3jwd s GLU 81 CO -0.31 -0.22 -0.09 -1.17 -0.54 0.00 0.00 175.26 172.93 3jwd s LEU 82 N 1.86 2.86 0.00 2.70 2.96 -0.39 -0.66 118.68 128.02 3jwd s LEU 82 Ca 0.24 -0.92 0.00 0.00 -0.22 0.00 0.00 54.13 53.23 3jwd s LEU 82 Cb -0.15 -1.33 0.00 0.00 0.50 0.00 0.00 46.19 45.21 3jwd s LEU 82 CO 0.09 -0.04 0.00 -0.24 -1.32 0.00 0.00 176.35 174.84 3jwd n SER 82 N -0.78 0.00 -4.76 3.68 2.88 -1.06 -2.43 113.62 111.15 3jwd n SER 82 Ca -0.05 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.17 3jwd n SER 82 Cb 0.60 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.14 3jwd n SER 82 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3jwd s LEU 82 N -4.08 3.17 0.14 2.46 1.43 -1.08 -4.73 118.68 115.99 3jwd s LEU 82 Ca 0.00 1.92 -0.05 0.00 -1.03 0.00 0.00 54.13 54.96 3jwd s LEU 82 Cb 0.00 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 3jwd s LEU 82 CO 0.00 -1.92 0.17 -0.13 0.23 0.00 0.00 176.35 174.70 3jwd s ARG 83 N -4.55 1.00 0.45 1.70 0.52 -1.26 -0.92 118.95 115.89 3jwd s ARG 83 Ca 0.64 -1.25 0.11 0.00 -0.52 0.00 0.00 55.73 54.71 3jwd s ARG 83 Cb -0.19 0.31 1.02 0.00 0.52 0.00 0.00 34.95 36.61 3jwd s ARG 83 CO 0.50 -0.32 2.09 1.03 0.02 0.00 0.00 175.30 178.62 3jwd h SER 84 N 2.73 0.28 0.46 0.23 0.87 -1.98 -0.19 113.55 115.95 3jwd h SER 84 Ca -0.33 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 3jwd h SER 84 Cb 1.21 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 3jwd h SER 84 CO 0.54 0.21 0.00 -0.62 -0.53 0.00 0.00 176.83 176.43 3jwd n GLU 85 N -4.50 0.43 -0.24 2.24 4.71 -1.26 -2.89 120.64 119.14 3jwd n GLU 85 Ca 0.01 0.03 0.08 0.00 -0.01 0.00 0.00 57.16 57.26 3jwd n GLU 85 Cb 0.08 -1.50 0.21 0.00 -1.01 0.00 0.00 31.44 29.21 3jwd n GLU 85 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3jwd n ASP 86 N -1.26 2.52 -4.59 1.62 8.00 -0.08 -4.82 116.55 117.93 3jwd n ASP 86 Ca 0.14 -2.00 -0.43 0.00 0.71 0.00 0.00 54.79 53.21 3jwd n ASP 86 Cb 0.20 -0.31 -0.02 0.00 -0.02 0.00 0.00 41.12 40.97 3jwd n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3jwd s THR 87 N -1.37 4.01 0.34 -3.53 2.01 -1.14 -4.77 115.64 111.19 3jwd s THR 87 Ca 0.31 0.96 -0.17 0.00 0.31 0.00 0.00 61.69 63.11 3jwd s THR 87 Cb 0.16 -4.52 0.06 0.00 0.01 0.00 0.00 72.50 68.21 3jwd s THR 87 CO 0.21 -1.08 0.85 0.00 -0.69 0.00 0.00 174.62 173.91 3jwd s ALA 88 N 5.12 -0.94 -0.16 7.40 0.00 -0.97 -4.21 121.76 128.01 3jwd s ALA 88 Ca 0.50 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.69 3jwd s ALA 88 Cb -0.09 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.67 3jwd s ALA 88 CO 0.29 -1.00 0.20 0.08 0.00 0.00 0.00 175.76 175.32 3jwd s VAL 89 N -2.24 5.37 -0.24 0.00 1.01 -0.11 -1.72 120.40 122.48 3jwd s VAL 89 Ca 0.17 0.34 -0.03 0.00 0.00 0.00 0.00 61.98 62.46 3jwd s VAL 89 Cb -0.05 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.82 3jwd s VAL 89 CO 0.10 0.47 -0.04 -0.31 0.00 0.00 0.00 175.10 175.32 3jwd s TYR 90 N 0.02 3.02 0.56 5.22 1.51 0.57 -0.13 117.35 128.11 3jwd s TYR 90 Ca 0.13 -1.24 0.08 0.00 -1.01 0.00 0.00 57.07 55.02 3jwd s TYR 90 Cb -0.12 -2.09 0.07 0.00 -0.11 0.00 0.00 41.96 39.71 3jwd s TYR 90 CO 0.02 -0.64 0.77 0.71 -1.11 0.00 0.00 175.55 175.29 3jwd s TYR 91 N 1.41 1.82 -0.37 2.71 1.51 0.54 -0.90 117.35 124.06 3jwd s TYR 91 Ca 0.03 -0.56 0.02 0.00 -1.01 0.00 0.00 57.07 55.55 3jwd s TYR 91 Cb -0.16 -2.38 0.15 0.00 -0.11 0.00 0.00 41.96 39.47 3jwd s TYR 91 CO -0.04 -1.05 0.33 0.00 -1.11 0.00 0.00 175.55 173.68 3jwd s ALA 93 N 1.11 1.73 0.31 0.00 0.00 -1.13 -3.95 121.76 119.83 3jwd s ALA 93 Ca 0.20 -0.65 -0.12 0.00 0.00 0.00 0.00 51.96 51.39 3jwd s ALA 93 Cb -0.15 -2.99 0.02 0.00 0.00 0.00 0.00 23.12 20.00 3jwd s ALA 93 CO -0.03 -2.42 0.58 0.00 0.00 0.00 0.00 175.76 173.89 3jwd s ALA 94 N -3.33 -0.20 -0.38 0.00 0.00 -1.03 -2.05 121.76 114.77 3jwd s ALA 94 Ca 0.66 -0.96 0.10 0.00 0.00 0.00 0.00 51.96 51.76 3jwd s ALA 94 Cb -0.13 0.97 0.31 0.00 0.00 0.00 0.00 23.12 24.27 3jwd s ALA 94 CO 0.53 -0.89 0.65 -3.47 0.00 0.00 0.00 175.76 172.58 3jwd n ASP 95 N -0.94 0.63 0.31 0.00 -0.08 -1.26 -1.07 116.55 114.14 3jwd n ASP 95 Ca -0.03 -2.89 0.20 0.00 -1.51 0.00 0.00 54.79 50.56 3jwd n ASP 95 Cb 0.61 -0.63 0.97 0.00 2.34 0.00 0.00 41.12 44.41 3jwd n ASP 95 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3jwd h PRO 96 N 3.42 0.00 -0.05 -0.67 0.11 -1.92 -2.52 132.00 130.37 3jwd h PRO 96 Ca 0.09 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 3jwd h PRO 96 Cb 0.93 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 3jwd h PRO 96 CO 0.49 0.01 -0.00 0.91 -0.21 0.00 0.00 178.00 179.20 3jwd n TRP 97 N -3.13 0.18 -3.72 0.65 8.01 -1.26 -5.01 117.44 113.16 3jwd n TRP 97 Ca -0.01 -0.98 -0.23 0.00 -1.31 0.00 0.00 57.50 54.97 3jwd n TRP 97 Cb 0.18 -0.18 0.03 0.00 -2.01 0.00 0.00 31.31 29.32 3jwd n TRP 97 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 3jwd n GLU 98 N -1.27 -4.18 0.00 -0.99 1.02 -0.95 -4.88 120.64 109.40 3jwd n GLU 98 Ca 0.17 0.58 0.13 0.00 -0.02 0.00 0.00 57.16 58.02 3jwd n GLU 98 Cb 0.69 -4.99 0.34 0.00 -0.02 0.00 0.00 31.44 27.46 3jwd n GLU 98 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3jwd n LEU 99 N -4.24 1.96 -3.67 -4.62 4.77 -1.26 -4.95 117.00 104.99 3jwd n LEU 99 Ca -0.28 -0.65 -0.24 0.00 -0.03 0.00 0.00 56.01 54.81 3jwd n LEU 99 Cb 0.67 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.81 3jwd n LEU 99 CO 0.69 0.33 0.16 0.59 -1.33 0.00 0.00 177.39 177.83 3jwd n ASN 100 N 0.45 -4.73 -3.47 -1.43 3.02 -1.26 -5.00 115.26 102.83 3jwd n ASN 100 Ca 0.16 -0.65 -0.14 0.00 -0.03 0.00 0.00 54.58 53.92 3jwd n ASN 100 Cb 0.44 -4.64 -0.04 0.00 -0.61 0.00 0.00 39.78 34.93 3jwd n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3jwd s ALA 100 N -3.36 -1.62 -0.93 5.41 0.00 -1.26 -5.09 121.76 114.91 3jwd s ALA 100 Ca 0.46 0.78 -0.24 0.00 0.00 0.00 0.00 51.96 52.96 3jwd s ALA 100 Cb -0.21 0.52 0.01 0.00 0.00 0.00 0.00 23.12 23.44 3jwd s ALA 100 CO 0.77 -0.60 1.61 -0.06 0.00 0.00 0.00 175.76 177.48 3jwd s PHE 100 N -2.72 2.23 -0.06 0.00 0.08 -1.26 -4.44 117.98 111.81 3jwd s PHE 100 Ca -0.04 -0.21 -0.07 0.00 0.12 0.00 0.00 56.93 56.74 3jwd s PHE 100 Cb -0.01 -4.45 -0.04 0.00 -0.57 0.00 0.00 43.02 37.96 3jwd s PHE 100 CO -0.04 -1.91 0.30 -0.97 -0.10 0.00 0.00 175.22 172.50 3jwd h ASN 101 N 10.58 -0.20 -2.44 1.36 -1.24 -1.51 -3.46 115.58 118.67 3jwd h ASN 101 Ca 0.10 0.01 -0.45 0.00 0.71 0.00 0.00 56.30 56.67 3jwd h ASN 101 Cb 1.02 0.05 0.03 0.00 0.73 0.00 0.00 38.32 40.15 3jwd h ASN 101 CO 1.33 0.21 -0.14 0.68 -1.29 0.00 0.00 177.43 178.22 3jwd s VAL 102 N -2.30 3.71 0.08 2.57 -7.23 -1.23 -4.97 120.40 111.03 3jwd s VAL 102 Ca -0.03 -0.66 0.01 0.00 -1.81 0.00 0.00 61.98 59.48 3jwd s VAL 102 Cb 0.00 -3.35 -0.00 0.00 0.56 0.00 0.00 36.38 33.59 3jwd s VAL 102 CO 0.10 -0.22 0.09 0.79 -0.31 0.00 0.00 175.10 175.56 3jwd n TRP 103 N -2.03 -0.44 -4.52 2.82 7.02 -1.26 -2.46 117.44 116.57 3jwd n TRP 103 Ca 0.03 -0.60 -0.25 0.00 -1.02 0.00 0.00 57.50 55.66 3jwd n TRP 103 Cb 0.58 0.10 -0.11 0.00 -2.42 0.00 0.00 31.31 29.47 3jwd n TRP 103 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 3jwd s GLY 104 N -1.52 2.18 0.12 6.99 0.00 -1.25 -3.85 107.32 109.98 3jwd s GLY 104 Ca 0.08 -2.10 0.16 0.00 0.00 0.00 0.00 44.72 42.86 3jwd s GLY 104 CO 0.06 -1.97 1.51 0.61 0.00 0.00 0.00 173.10 173.30 3jwd n GLN 105 N -0.78 0.08 0.00 2.90 0.00 -1.26 -4.79 117.38 113.54 3jwd n GLN 105 Ca -0.05 0.38 0.00 0.00 0.00 0.00 0.00 57.00 57.33 3jwd n GLN 105 Cb 0.65 -1.67 0.00 0.00 0.00 0.00 0.00 30.24 29.22 3jwd n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3jwd n GLY 106 N -0.32 -1.40 2.97 2.61 0.00 -1.26 -5.02 105.19 102.77 3jwd n GLY 106 Ca 0.02 -1.43 -0.28 0.00 0.00 0.00 0.00 46.02 44.33 3jwd n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jwd s THR 107 N -3.42 1.30 -0.27 2.61 2.01 -0.08 -4.86 115.64 112.93 3jwd s THR 107 Ca 0.00 -0.47 -0.23 0.00 0.31 0.00 0.00 61.69 61.30 3jwd s THR 107 Cb 0.00 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 3jwd s THR 107 CO 0.00 0.41 0.77 -0.22 -0.69 0.00 0.00 174.62 174.89 3jwd s LEU 108 N 1.52 4.08 -0.10 4.42 2.96 -1.26 -0.31 118.68 129.98 3jwd s LEU 108 Ca 0.03 0.84 0.02 0.00 -0.22 0.00 0.00 54.13 54.80 3jwd s LEU 108 Cb -0.13 -3.08 -0.01 0.00 0.50 0.00 0.00 46.19 43.47 3jwd s LEU 108 CO -0.08 -0.52 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.58 3jwd s VAL 109 N 2.81 2.83 -0.16 1.68 1.01 -0.70 -1.77 120.40 126.09 3jwd s VAL 109 Ca 0.32 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.54 3jwd s VAL 109 Cb -0.15 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.09 3jwd s VAL 109 CO 0.09 0.55 -0.16 -0.44 0.00 0.00 0.00 175.10 175.14 3jwd s SER 110 N 0.10 3.56 -0.39 3.32 0.01 -1.04 -2.29 113.70 116.98 3jwd s SER 110 Ca -0.07 -0.51 -0.09 0.00 1.31 0.00 0.00 55.95 56.60 3jwd s SER 110 Cb -0.15 -1.55 0.06 0.00 0.21 0.00 0.00 66.02 64.59 3jwd s SER 110 CO 0.05 0.07 0.21 -0.69 0.41 0.00 0.00 173.24 173.28 3jwd s VAL 111 N 0.93 4.14 -0.23 3.43 1.01 -1.26 -2.24 120.40 126.18 3jwd s VAL 111 Ca -0.03 -1.27 -0.23 0.00 0.00 0.00 0.00 61.98 60.46 3jwd s VAL 111 Cb -0.15 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.83 3jwd s VAL 111 CO -0.02 -0.38 0.64 -0.55 0.00 0.00 0.00 175.10 174.78 3jwd s SER 112 N 1.83 -0.66 0.39 3.32 0.15 -1.19 -4.40 113.70 113.14 3jwd s SER 112 Ca 0.02 1.25 0.28 0.00 0.70 0.00 0.00 55.95 58.20 3jwd s SER 112 Cb -0.21 1.26 1.09 0.00 -1.71 0.00 0.00 66.02 66.45 3jwd s SER 112 CO 0.03 -0.24 1.83 -1.28 1.20 0.00 0.00 173.24 174.77 3jwd h SER 113 N 5.01 0.00 -4.29 5.45 0.87 -1.94 -3.41 113.55 115.25 3jwd h SER 113 Ca -0.28 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 59.77 3jwd h SER 113 Cb 1.16 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 63.23 3jwd h SER 113 CO 0.12 0.00 0.35 0.00 -0.53 0.00 0.00 176.83 176.77 3jwd s ALA 114 N -3.44 2.48 0.37 6.23 0.00 -1.26 -5.03 121.76 121.10 3jwd s ALA 114 Ca 0.04 0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.33 3jwd s ALA 114 Cb 0.09 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 3jwd s ALA 114 CO 0.49 -1.42 0.44 0.45 0.00 0.00 0.00 175.76 175.72 3jwd s SER 115 N -3.34 5.62 0.23 0.00 0.15 -1.26 -5.02 113.70 110.08 3jwd s SER 115 Ca 0.61 -0.39 -0.31 0.00 0.70 0.00 0.00 55.95 56.57 3jwd s SER 115 Cb -0.16 -0.95 -0.10 0.00 -1.71 0.00 0.00 66.02 63.09 3jwd s SER 115 CO 0.52 -0.52 1.52 -0.89 1.20 0.00 0.00 173.24 175.06 3jwd s THR 116 N -2.29 2.52 -0.08 6.45 2.01 -1.26 -4.71 115.64 118.28 3jwd s THR 116 Ca 0.47 0.41 -0.19 0.00 0.31 0.00 0.00 61.69 62.69 3jwd s THR 116 Cb -0.08 -3.26 0.04 0.00 0.01 0.00 0.00 72.50 69.21 3jwd s THR 116 CO 0.30 0.05 0.44 -0.75 -0.69 0.00 0.00 174.62 173.98 3jwd s LYS 117 N 0.13 0.71 0.38 4.92 2.36 -0.35 -4.94 119.74 122.95 3jwd s LYS 117 Ca 0.64 0.19 -0.19 0.00 -2.55 0.00 0.00 55.97 54.06 3jwd s LYS 117 Cb -0.44 0.33 -0.10 0.00 -1.05 0.00 0.00 37.83 36.57 3jwd s LYS 117 CO 0.40 -0.17 0.86 0.20 1.55 0.00 0.00 175.35 178.19 3jwd s GLY 118 N -0.76 2.39 0.66 5.54 0.00 -1.26 -1.11 107.32 112.78 3jwd s GLY 118 Ca -0.08 0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.79 3jwd s GLY 118 CO 0.04 0.52 1.05 2.56 0.00 0.00 0.00 173.10 177.27 3jwd s PRO 119 N -3.03 3.25 -0.06 2.90 0.04 -1.26 -4.62 135.00 132.23 3jwd s PRO 119 Ca 0.58 0.82 0.06 0.00 0.04 0.00 0.00 61.00 62.50 3jwd s PRO 119 Cb -0.10 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 3jwd s PRO 119 CO 0.15 -0.84 -0.23 -1.12 0.04 0.00 0.00 177.00 175.00 3jwd s SER 120 N -4.02 3.22 -0.04 6.66 0.01 -1.07 -5.00 113.70 113.47 3jwd s SER 120 Ca 0.57 -0.47 0.02 0.00 1.31 0.00 0.00 55.95 57.37 3jwd s SER 120 Cb -0.12 -0.88 -0.03 0.00 0.21 0.00 0.00 66.02 65.20 3jwd s SER 120 CO 0.54 0.25 -0.06 -0.69 0.41 0.00 0.00 173.24 173.69 3jwd s VAL 121 N -0.20 3.71 -0.02 3.43 1.01 -1.26 -2.13 120.40 124.94 3jwd s VAL 121 Ca -0.02 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.38 3jwd s VAL 121 Cb -0.13 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.71 3jwd s VAL 121 CO 0.03 0.52 -0.01 -0.36 0.00 0.00 0.00 175.10 175.28 3jwd s PHE 122 N -0.89 0.31 0.60 5.22 0.08 -1.15 -4.99 117.98 117.17 3jwd s PHE 122 Ca 0.14 -0.02 -0.16 0.00 0.12 0.00 0.00 56.93 57.01 3jwd s PHE 122 Cb -0.11 -0.35 -0.03 0.00 -0.57 0.00 0.00 43.02 41.96 3jwd s PHE 122 CO 0.04 -0.10 1.09 -2.14 -0.10 0.00 0.00 175.22 174.02 3jwd s PRO 123 N 0.72 3.13 -0.53 0.24 0.02 -1.26 -2.18 135.00 135.15 3jwd s PRO 123 Ca -0.07 1.38 0.07 0.00 0.02 0.00 0.00 61.00 62.40 3jwd s PRO 123 Cb -0.10 -2.00 0.27 0.00 0.02 0.00 0.00 34.50 32.69 3jwd s PRO 123 CO -0.01 -0.99 0.69 1.28 -0.33 0.00 0.00 177.00 177.65 3jwd n LEU 124 N -1.98 2.39 -4.80 -5.54 4.77 -0.71 -4.92 117.00 106.21 3jwd n LEU 124 Ca 0.10 -5.18 -0.35 0.00 -0.03 0.00 0.00 56.01 50.55 3jwd n LEU 124 Cb 0.52 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 3jwd n LEU 124 CO 0.46 2.12 0.67 0.00 -1.33 0.00 0.00 177.39 179.31 3jwd s ALA 125 N -2.16 3.07 -0.28 -1.18 0.00 -1.26 -3.38 121.76 116.57 3jwd s ALA 125 Ca 0.39 0.51 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 3jwd s ALA 125 Cb 0.19 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 20.12 3jwd s ALA 125 CO -0.07 0.03 1.22 -2.14 0.00 0.00 0.00 175.76 174.81 3jwd s PRO 126 N -2.77 4.02 -0.68 0.00 0.02 -1.26 -4.95 135.00 129.39 3jwd s PRO 126 Ca 0.59 1.27 -0.04 0.00 0.02 0.00 0.00 61.00 62.83 3jwd s PRO 126 Cb -0.15 -3.81 0.07 0.00 0.02 0.00 0.00 34.50 30.63 3jwd s PRO 126 CO 0.19 -0.97 2.69 0.45 -0.33 0.00 0.00 177.00 179.03 3jwd n SER 127 N 7.19 6.87 -2.21 2.53 2.88 -1.26 -4.69 113.62 124.93 3jwd n SER 127 Ca 0.14 -3.17 -0.16 0.00 -1.33 0.00 0.00 58.87 54.34 3jwd n SER 127 Cb 0.46 -1.27 -0.02 0.00 -0.75 0.00 0.00 64.21 62.63 3jwd n SER 127 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3jwd n SER 128 N 1.15 -4.77 0.00 -3.46 2.88 -1.26 -4.72 113.62 103.45 3jwd n SER 128 Ca 0.52 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 3jwd n SER 128 Cb 0.48 -4.07 0.00 0.00 -0.75 0.00 0.00 64.21 59.87 3jwd n SER 128 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3jwd n LYS 129 N -2.73 0.00 0.28 -1.46 0.00 -1.26 -4.76 118.16 108.23 3jwd n LYS 129 Ca -0.19 0.00 0.15 0.00 0.00 0.00 0.00 58.31 58.27 3jwd n LYS 129 Cb 0.63 -0.56 0.80 0.00 0.00 0.00 0.00 35.03 35.90 3jwd n LYS 129 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3jwd h SER 130 N 0.00 0.00 -3.18 3.14 0.87 -1.90 -3.43 113.55 109.06 3jwd h SER 130 Ca 0.00 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.03 3jwd h SER 130 Cb 0.41 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.39 3jwd h SER 130 CO 0.00 0.08 0.67 0.42 -0.53 0.00 0.00 176.83 177.47 3jwd s THR 131 N -4.12 3.39 -0.58 2.23 -4.23 -1.26 -4.66 115.64 106.41 3jwd s THR 131 Ca -0.03 1.05 0.24 0.00 -1.18 0.00 0.00 61.69 61.78 3jwd s THR 131 Cb 0.12 -3.67 0.25 0.00 1.34 0.00 0.00 72.50 70.54 3jwd s THR 131 CO 0.55 0.11 1.60 0.28 -0.54 0.00 0.00 174.62 176.62 3jwd h SER 132 N 6.25 0.00 0.00 3.99 0.02 -1.83 -3.47 113.55 118.51 3jwd h SER 132 Ca -0.43 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3jwd h SER 132 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 3jwd h SER 132 CO 0.82 0.02 0.00 0.61 -1.14 0.00 0.00 176.83 177.14 3jwd n GLY 133 N 1.23 1.76 0.31 -3.77 0.00 -1.26 -4.90 105.19 98.56 3jwd n GLY 133 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3jwd n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jwd n GLY 134 N -0.04 0.00 2.88 -0.02 0.00 -1.26 -4.87 105.19 101.88 3jwd n GLY 134 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3jwd n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jwd s THR 135 N -1.48 1.12 0.51 2.61 2.01 -1.26 -1.80 115.64 117.35 3jwd s THR 135 Ca 0.00 -0.71 -0.02 0.00 0.31 0.00 0.00 61.69 61.27 3jwd s THR 135 Cb 0.00 -1.34 0.01 0.00 0.01 0.00 0.00 72.50 71.18 3jwd s THR 135 CO 0.00 0.06 0.77 0.00 -0.69 0.00 0.00 174.62 174.76 3jwd s ALA 136 N 1.62 3.60 -0.02 7.40 0.00 0.12 -3.75 121.76 130.73 3jwd s ALA 136 Ca -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.01 3jwd s ALA 136 Cb -0.16 -2.31 0.02 0.00 0.00 0.00 0.00 23.12 20.67 3jwd s ALA 136 CO -0.07 -0.58 -0.00 0.00 0.00 0.00 0.00 175.76 175.10 3jwd s ALA 137 N -2.74 0.25 0.13 0.00 0.00 -1.26 -1.27 121.76 116.86 3jwd s ALA 137 Ca 0.51 0.11 -0.15 0.00 0.00 0.00 0.00 51.96 52.43 3jwd s ALA 137 Cb -0.10 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.82 3jwd s ALA 137 CO 0.41 -0.04 0.38 -0.48 0.00 0.00 0.00 175.76 176.02 3jwd s LEU 138 N 0.70 0.54 0.00 0.00 2.34 -1.03 -4.36 118.68 116.87 3jwd s LEU 138 Ca -0.07 -0.40 0.00 0.00 0.06 0.00 0.00 54.13 53.73 3jwd s LEU 138 Cb -0.10 1.72 0.00 0.00 -0.56 0.00 0.00 46.19 47.26 3jwd s LEU 138 CO -0.01 -0.85 0.00 0.61 -1.06 0.00 0.00 176.35 175.03 3jwd n GLY 139 N -0.21 2.02 3.55 -3.48 0.00 -1.22 -1.39 105.19 104.46 3jwd n GLY 139 Ca -0.15 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 3jwd n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jwd s LEU 141 N -3.65 -0.44 -0.60 0.00 2.96 -0.93 -3.43 118.68 112.60 3jwd s LEU 141 Ca 0.21 -0.60 -0.24 0.00 -0.22 0.00 0.00 54.13 53.28 3jwd s LEU 141 Cb 0.02 0.72 0.05 0.00 0.50 0.00 0.00 46.19 47.48 3jwd s LEU 141 CO 0.14 -0.37 0.96 -0.69 -1.32 0.00 0.00 176.35 175.07 3jwd s VAL 142 N 2.43 4.33 0.01 1.68 1.01 -0.86 -2.92 120.40 126.09 3jwd s VAL 142 Ca 0.09 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.17 3jwd s VAL 142 Cb -0.13 -4.61 -0.03 0.00 0.00 0.00 0.00 36.38 31.60 3jwd s VAL 142 CO -0.31 -1.27 -0.09 -0.75 0.00 0.00 0.00 175.10 172.67 3jwd s LYS 143 N 4.08 2.45 -0.21 2.72 2.20 -0.91 -1.10 119.74 128.97 3jwd s LYS 143 Ca 0.28 -0.78 -0.04 0.00 -0.36 0.00 0.00 55.97 55.07 3jwd s LYS 143 Cb -0.14 -2.43 0.02 0.00 -1.51 0.00 0.00 37.83 33.76 3jwd s LYS 143 CO 0.16 0.59 0.08 -0.25 -0.36 0.00 0.00 175.35 175.57 3jwd n ASP 144 N 1.56 -5.43 -3.82 1.43 8.00 -0.76 -2.58 116.55 114.95 3jwd n ASP 144 Ca -0.16 1.25 -0.08 0.00 0.71 0.00 0.00 54.79 56.52 3jwd n ASP 144 Cb 0.52 -4.59 -0.02 0.00 -0.02 0.00 0.00 41.12 37.01 3jwd n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3jwd s TYR 145 N -1.14 -0.18 -0.28 1.24 -0.85 -1.25 -4.00 117.35 110.89 3jwd s TYR 145 Ca -0.09 -0.24 -0.23 0.00 -0.52 0.00 0.00 57.07 55.98 3jwd s TYR 145 Cb 0.01 0.64 0.13 0.00 0.38 0.00 0.00 41.96 43.11 3jwd s TYR 145 CO 0.64 -1.17 1.03 0.12 -1.52 0.00 0.00 175.55 174.65 3jwd s PHE 146 N -3.91 -0.48 0.00 -3.49 5.36 -0.27 -2.57 117.98 112.62 3jwd s PHE 146 Ca 0.11 1.13 0.00 0.00 -0.96 0.00 0.00 56.93 57.21 3jwd s PHE 146 Cb -0.05 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.00 3jwd s PHE 146 CO 0.05 -0.23 0.00 -0.35 -1.46 0.00 0.00 175.22 173.22 3jwd n PRO 147 N 2.47 3.75 -1.99 10.12 -0.05 -1.26 -1.21 135.00 146.83 3jwd n PRO 147 Ca -0.13 0.00 -0.29 0.00 -0.05 0.00 0.00 63.50 63.03 3jwd n PRO 147 Cb 0.56 0.00 0.07 0.00 -0.05 0.00 0.00 33.50 34.08 3jwd n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 3jwd s GLU 148 N 3.74 2.39 0.00 0.54 0.41 -1.26 -4.82 118.70 119.70 3jwd s GLU 148 Ca 0.00 0.16 0.00 0.00 -0.41 0.00 0.00 54.97 54.72 3jwd s GLU 148 Cb 0.00 -2.04 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 3jwd s GLU 148 CO 0.00 -1.27 0.00 -2.30 -0.49 0.00 0.00 175.26 171.20 3jwd n PRO 149 N -3.09 1.40 -3.64 0.39 -0.02 -1.26 -4.88 135.00 123.91 3jwd n PRO 149 Ca 0.07 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.49 3jwd n PRO 149 Cb 0.59 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 34.00 3jwd n PRO 149 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3jwd s VAL 150 N 1.00 0.00 0.00 -1.45 0.11 -1.26 -4.55 120.40 114.25 3jwd s VAL 150 Ca 0.00 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.02 3jwd s VAL 150 Cb 0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 3jwd s VAL 150 CO 0.00 0.00 0.20 0.42 -3.33 0.00 0.00 175.10 172.39 3jwd s THR 151 N 1.36 5.42 -0.08 5.04 -4.23 -1.24 -4.99 115.64 116.92 3jwd s THR 151 Ca -0.08 -0.15 -0.00 0.00 -1.18 0.00 0.00 61.69 60.28 3jwd s THR 151 Cb -0.05 -3.55 0.02 0.00 1.34 0.00 0.00 72.50 70.27 3jwd s THR 151 CO -0.16 0.31 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.50 3jwd s VAL 152 N -1.35 0.65 0.35 2.29 1.01 -1.26 -3.04 120.40 119.05 3jwd s VAL 152 Ca 0.28 -0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.23 3jwd s VAL 152 Cb -0.13 -0.72 -0.07 0.00 0.00 0.00 0.00 36.38 35.46 3jwd s VAL 152 CO 0.19 0.29 0.04 -0.94 0.00 0.00 0.00 175.10 174.68 3jwd s SER 153 N 1.58 2.94 -0.15 3.32 1.04 -1.20 -4.97 113.70 116.26 3jwd s SER 153 Ca 0.00 -1.37 0.01 0.00 0.48 0.00 0.00 55.95 55.07 3jwd s SER 153 Cb -0.13 -0.20 0.02 0.00 0.10 0.00 0.00 66.02 65.81 3jwd s SER 153 CO -0.04 -0.54 -0.15 0.26 0.98 0.00 0.00 173.24 173.75 3jwd s TRP 154 N -3.07 2.21 -1.32 5.02 0.52 -1.26 -0.83 118.94 120.21 3jwd s TRP 154 Ca 0.36 -1.22 -0.08 0.00 0.02 0.00 0.00 56.10 55.17 3jwd s TRP 154 Cb 0.09 -1.61 0.01 0.00 -1.15 0.00 0.00 33.47 30.81 3jwd s TRP 154 CO 0.16 -0.65 1.08 0.09 0.02 0.00 0.00 176.95 177.65 3jwd n ASN 155 N 4.66 -6.19 -2.14 2.95 3.02 -1.15 -2.50 115.26 113.91 3jwd n ASN 155 Ca -0.18 -0.49 -0.21 0.00 -0.03 0.00 0.00 54.58 53.68 3jwd n ASN 155 Cb 0.50 -4.83 -0.04 0.00 -0.61 0.00 0.00 39.78 34.81 3jwd n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3jwd n SER 156 N -2.77 -5.73 0.00 6.41 7.64 -1.26 -1.60 113.62 116.31 3jwd n SER 156 Ca -0.00 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.04 3jwd n SER 156 Cb 0.56 -4.87 0.00 0.00 -1.01 0.00 0.00 64.21 58.90 3jwd n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3jwd n GLY 157 N -0.80 1.43 0.36 0.23 0.00 -1.05 -4.95 105.19 100.40 3jwd n GLY 157 Ca -0.23 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.84 3jwd n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jwd h ALA 158 N 0.00 1.61 -3.33 4.61 0.00 -1.31 -3.36 119.26 117.49 3jwd h ALA 158 Ca 0.00 -0.02 -0.69 0.00 0.00 0.00 0.00 54.91 54.20 3jwd h ALA 158 Cb 0.00 -0.23 -0.32 0.00 0.00 0.00 0.00 17.79 17.24 3jwd h ALA 158 CO 0.00 0.25 -0.64 -1.17 0.00 0.00 0.00 179.25 177.70 3jwd s LEU 159 N -9.86 4.38 0.00 0.00 2.96 -1.04 -4.88 118.68 110.23 3jwd s LEU 159 Ca -0.11 -1.47 0.00 0.00 -0.22 0.00 0.00 54.13 52.34 3jwd s LEU 159 Cb 0.20 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 45.11 3jwd s LEU 159 CO 0.79 -0.36 0.51 0.35 -1.32 0.00 0.00 176.35 176.32 3jwd n THR 160 N 4.65 0.26 -3.29 3.68 -2.24 -1.26 -4.21 114.28 111.87 3jwd n THR 160 Ca -0.10 -0.40 -0.43 0.00 -2.27 0.00 0.00 64.05 60.85 3jwd n THR 160 Cb 0.43 1.11 -0.08 0.00 -2.10 0.00 0.00 70.33 69.69 3jwd n THR 160 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3jwd s SER 161 N -0.26 6.20 0.00 3.42 0.15 -1.26 -4.28 113.70 117.66 3jwd s SER 161 Ca 0.00 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 55.80 3jwd s SER 161 Cb 0.00 -2.23 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 3jwd s SER 161 CO 0.00 -0.67 0.00 0.61 1.20 0.00 0.00 173.24 174.38 3jwd n GLY 162 N 5.14 0.89 3.11 9.45 0.00 -1.26 -4.88 105.19 117.64 3jwd n GLY 162 Ca -0.08 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 3jwd n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jwd s VAL 163 N -2.97 3.86 -0.38 1.61 1.01 -1.26 -3.59 120.40 118.68 3jwd s VAL 163 Ca 0.00 -3.00 -0.29 0.00 0.00 0.00 0.00 61.98 58.69 3jwd s VAL 163 Cb 0.00 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.89 3jwd s VAL 163 CO 0.00 -0.90 1.26 -1.00 0.00 0.00 0.00 175.10 174.46 3jwd s HIS 164 N -0.15 2.70 -0.65 5.22 3.76 -0.80 -4.91 115.29 120.47 3jwd s HIS 164 Ca 0.18 0.82 -0.08 0.00 -0.15 0.00 0.00 55.06 55.83 3jwd s HIS 164 Cb -0.19 -4.13 0.17 0.00 1.11 0.00 0.00 32.58 29.54 3jwd s HIS 164 CO -0.04 -1.55 0.51 0.99 -0.85 0.00 0.00 174.74 173.80 3jwd s THR 165 N 4.60 4.40 0.58 1.30 2.01 -1.26 -0.83 115.64 126.44 3jwd s THR 165 Ca 0.54 -2.53 -0.20 0.00 0.31 0.00 0.00 61.69 59.82 3jwd s THR 165 Cb -0.13 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 3jwd s THR 165 CO 0.27 -0.90 1.25 -0.36 -0.69 0.00 0.00 174.62 174.19 3jwd s PHE 166 N 0.36 2.36 0.65 4.92 0.40 -1.09 -4.98 117.98 120.60 3jwd s PHE 166 Ca 0.14 1.48 -0.18 0.00 -0.60 0.00 0.00 56.93 57.78 3jwd s PHE 166 Cb -0.19 -3.58 -0.01 0.00 0.51 0.00 0.00 43.02 39.76 3jwd s PHE 166 CO -0.04 -2.42 1.26 -2.14 0.70 0.00 0.00 175.22 172.57 3jwd s PRO 167 N -3.19 2.57 0.99 0.24 0.02 -1.26 -4.34 135.00 130.03 3jwd s PRO 167 Ca 0.76 1.95 -0.13 0.00 0.02 0.00 0.00 61.00 63.60 3jwd s PRO 167 Cb -0.34 -1.86 0.18 0.00 0.02 0.00 0.00 34.50 32.50 3jwd s PRO 167 CO 0.37 -1.55 1.13 0.00 -0.33 0.00 0.00 177.00 176.62 3jwd s ALA 168 N -1.55 1.32 0.01 -1.55 0.00 -1.26 -4.74 121.76 114.00 3jwd s ALA 168 Ca 0.80 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 52.23 3jwd s ALA 168 Cb -0.34 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 3jwd s ALA 168 CO 0.39 -2.68 -0.08 0.14 0.00 0.00 0.00 175.76 173.54 3jwd s VAL 169 N -3.16 0.59 -0.57 0.00 -7.23 -0.78 -4.93 120.40 104.31 3jwd s VAL 169 Ca 0.66 -0.51 -0.27 0.00 -1.81 0.00 0.00 61.98 60.04 3jwd s VAL 169 Cb -0.15 -0.53 0.03 0.00 0.56 0.00 0.00 36.38 36.29 3jwd s VAL 169 CO 0.55 0.03 1.15 -0.22 -0.31 0.00 0.00 175.10 176.30 3jwd s LEU 170 N -0.53 3.57 1.02 1.32 0.20 -1.26 -2.40 118.68 120.60 3jwd s LEU 170 Ca 0.00 0.03 -0.12 0.00 0.69 0.00 0.00 54.13 54.73 3jwd s LEU 170 Cb -0.05 -3.11 0.20 0.00 -0.43 0.00 0.00 46.19 42.80 3jwd s LEU 170 CO 0.00 -1.43 1.08 -1.10 -0.29 0.00 0.00 176.35 174.61 3jwd s GLN 171 N 4.76 0.28 0.55 1.98 -0.21 0.13 -4.91 119.66 122.24 3jwd s GLN 171 Ca 0.41 0.70 0.32 0.00 0.02 0.00 0.00 55.36 56.81 3jwd s GLN 171 Cb -0.08 -1.70 1.56 0.00 1.00 0.00 0.00 33.01 33.78 3jwd s GLN 171 CO 0.24 -2.88 2.08 0.66 -2.12 0.00 0.00 175.29 173.27 3jwd h SER 172 N -2.01 0.00 -0.28 5.90 4.64 -1.95 -2.56 113.55 117.30 3jwd h SER 172 Ca -0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 3jwd h SER 172 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3jwd h SER 172 CO 0.54 0.07 0.00 -1.54 -0.87 0.00 0.00 176.83 175.04 3jwd n SER 173 N -3.35 3.12 -0.69 4.97 3.41 -1.26 -4.87 113.62 114.96 3jwd n SER 173 Ca -0.01 -2.40 -0.09 0.00 -0.26 0.00 0.00 58.87 56.10 3jwd n SER 173 Cb 0.25 -0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 63.60 3jwd n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jwd n GLY 174 N 0.35 1.03 3.39 5.00 0.00 -0.96 -4.96 105.19 109.04 3jwd n GLY 174 Ca 0.13 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 3jwd n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jwd s LEU 175 N -2.05 2.51 0.82 0.99 1.43 -1.26 -4.79 118.68 116.33 3jwd s LEU 175 Ca 0.00 -0.94 -0.07 0.00 -1.03 0.00 0.00 54.13 52.08 3jwd s LEU 175 Cb 0.00 -0.93 0.15 0.00 0.03 0.00 0.00 46.19 45.44 3jwd s LEU 175 CO 0.00 -0.02 1.13 -0.31 0.23 0.00 0.00 176.35 177.38 3jwd s TYR 176 N -2.32 1.69 -0.30 0.29 1.51 -1.06 0.19 117.35 117.34 3jwd s TYR 176 Ca 0.22 0.02 -0.18 0.00 -1.01 0.00 0.00 57.07 56.12 3jwd s TYR 176 Cb -0.05 -3.46 0.19 0.00 -0.11 0.00 0.00 41.96 38.52 3jwd s TYR 176 CO 0.10 -2.07 1.19 0.45 -1.11 0.00 0.00 175.55 174.10 3jwd s SER 177 N -4.78 -0.24 0.41 2.29 0.15 -1.01 -1.83 113.70 108.69 3jwd s SER 177 Ca 0.69 0.33 0.05 0.00 0.70 0.00 0.00 55.95 57.72 3jwd s SER 177 Cb -0.05 1.27 -0.06 0.00 -1.71 0.00 0.00 66.02 65.47 3jwd s SER 177 CO 0.48 -0.05 0.02 -1.48 1.20 0.00 0.00 173.24 173.42 3jwd s LEU 178 N 2.18 2.62 -0.12 3.45 0.05 -0.26 -1.87 118.68 124.73 3jwd s LEU 178 Ca -0.00 -1.42 -0.05 0.00 0.05 0.00 0.00 54.13 52.70 3jwd s LEU 178 Cb -0.02 -0.74 0.06 0.00 -2.05 0.00 0.00 46.19 43.44 3jwd s LEU 178 CO -0.17 -0.56 0.25 -0.94 -0.55 0.00 0.00 176.35 174.39 3jwd s SER 179 N -3.69 0.36 -0.16 1.48 1.04 -1.26 -2.03 113.70 109.45 3jwd s SER 179 Ca 0.31 0.56 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 3jwd s SER 179 Cb 0.08 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.84 3jwd s SER 179 CO 0.15 -0.24 -0.12 -0.55 0.98 0.00 0.00 173.24 173.47 3jwd s SER 180 N 2.35 3.93 0.46 7.02 0.15 -1.22 -2.66 113.70 123.72 3jwd s SER 180 Ca 0.01 -0.40 0.03 0.00 0.70 0.00 0.00 55.95 56.28 3jwd s SER 180 Cb -0.12 -1.62 -0.03 0.00 -1.71 0.00 0.00 66.02 62.54 3jwd s SER 180 CO -0.08 0.09 0.04 0.68 1.20 0.00 0.00 173.24 175.17 3jwd s VAL 181 N 0.82 1.09 -0.28 4.45 -7.23 -0.01 -1.28 120.40 117.96 3jwd s VAL 181 Ca -0.04 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.92 3jwd s VAL 181 Cb -0.15 -2.35 0.10 0.00 0.56 0.00 0.00 36.38 34.54 3jwd s VAL 181 CO 0.00 0.00 0.84 0.54 -0.31 0.00 0.00 175.10 176.17 3jwd s VAL 182 N -2.98 0.00 -0.13 1.32 0.11 -0.48 -1.90 120.40 116.33 3jwd s VAL 182 Ca 0.16 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.08 3jwd s VAL 182 Cb 0.03 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.83 3jwd s VAL 182 CO 0.09 0.00 0.28 0.42 -3.33 0.00 0.00 175.10 172.56 3jwd s THR 183 N 0.80 5.29 0.09 5.04 -4.23 -1.24 -2.46 115.64 118.93 3jwd s THR 183 Ca -0.03 0.53 0.02 0.00 -1.18 0.00 0.00 61.69 61.03 3jwd s THR 183 Cb -0.05 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.15 3jwd s THR 183 CO -0.09 0.45 -0.07 0.68 -0.54 0.00 0.00 174.62 175.06 3jwd s VAL 184 N 0.03 0.67 0.30 2.29 -7.23 -0.39 -4.98 120.40 111.09 3jwd s VAL 184 Ca 0.17 -1.76 -0.30 0.00 -1.81 0.00 0.00 61.98 58.28 3jwd s VAL 184 Cb -0.13 -1.47 -0.12 0.00 0.56 0.00 0.00 36.38 35.22 3jwd s VAL 184 CO 0.05 -0.77 1.52 -2.65 -0.31 0.00 0.00 175.10 172.94 3jwd n PRO 185 N 0.26 2.54 0.23 4.82 -0.02 -1.26 0.15 135.00 141.72 3jwd n PRO 185 Ca -0.14 0.90 0.16 0.00 -2.02 0.00 0.00 63.50 62.40 3jwd n PRO 185 Cb 0.60 -2.63 0.72 0.00 -0.02 0.00 0.00 33.50 32.16 3jwd n PRO 185 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3jwd h SER 186 N 4.17 0.00 1.32 2.55 4.64 -1.67 -1.85 113.55 122.71 3jwd h SER 186 Ca -0.47 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.71 3jwd h SER 186 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 3jwd h SER 186 CO 0.75 0.00 -0.69 0.77 -0.87 0.00 0.00 176.83 176.78 3jwd h SER 187 N 0.00 0.00 -2.25 4.97 4.64 -1.90 -3.36 113.55 115.65 3jwd h SER 187 Ca 0.00 0.00 -0.81 0.00 -0.47 0.00 0.00 61.79 60.51 3jwd h SER 187 Cb 0.32 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.15 3jwd h SER 187 CO 0.00 0.63 1.09 -1.54 -0.87 0.00 0.00 176.83 176.14 3jwd n SER 188 N -3.23 7.31 0.04 4.97 3.41 -0.69 -4.58 113.62 120.85 3jwd n SER 188 Ca 0.01 -3.64 -0.00 0.00 -0.26 0.00 0.00 58.87 54.98 3jwd n SER 188 Cb 0.80 -1.19 -0.00 0.00 -0.26 0.00 0.00 64.21 63.56 3jwd n SER 188 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3jwd n LEU 189 N 0.17 1.02 0.00 1.04 4.77 -1.26 -4.64 117.00 118.10 3jwd n LEU 189 Ca 0.46 0.13 0.07 0.00 -0.03 0.00 0.00 56.01 56.64 3jwd n LEU 189 Cb 0.27 -0.31 0.44 0.00 -2.33 0.00 0.00 43.42 41.48 3jwd n LEU 189 CO 0.55 -0.73 0.66 0.61 -1.33 0.00 0.00 177.39 177.15 3jwd n GLY 190 N 3.46 -0.60 1.78 -0.72 0.00 -1.26 -2.68 105.19 105.16 3jwd n GLY 190 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 3jwd n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3jwd n THR 191 N -0.88 1.30 -3.71 2.61 -2.24 -1.26 -5.07 114.28 105.03 3jwd n THR 191 Ca 0.11 -2.61 -0.14 0.00 -2.27 0.00 0.00 64.05 59.14 3jwd n THR 191 Cb 0.05 0.42 -0.09 0.00 -2.10 0.00 0.00 70.33 68.62 3jwd n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3jwd s GLN 192 N -2.42 0.65 -0.28 -0.78 2.00 -1.09 -5.06 119.66 112.68 3jwd s GLN 192 Ca 0.36 0.25 -0.10 0.00 -2.00 0.00 0.00 55.36 53.86 3jwd s GLN 192 Cb 0.37 0.30 -0.04 0.00 0.80 0.00 0.00 33.01 34.44 3jwd s GLN 192 CO -0.07 -0.15 0.17 0.99 -0.50 0.00 0.00 175.29 175.73 3jwd s THR 193 N -0.58 5.08 -0.25 -0.34 2.01 -1.26 -4.92 115.64 115.38 3jwd s THR 193 Ca -0.07 0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.96 3jwd s THR 193 Cb -0.03 -3.44 0.04 0.00 0.01 0.00 0.00 72.50 69.07 3jwd s THR 193 CO 0.03 0.23 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.79 3jwd s TYR 194 N 1.72 3.11 -0.10 4.92 2.02 -1.26 -5.00 117.35 122.75 3jwd s TYR 194 Ca 0.07 -1.87 0.00 0.00 -0.37 0.00 0.00 57.07 54.90 3jwd s TYR 194 Cb -0.16 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.42 3jwd s TYR 194 CO 0.09 -0.80 -0.09 0.42 -1.57 0.00 0.00 175.55 173.60 3jwd s ILE 195 N 1.24 1.09 0.15 2.71 -1.09 -1.26 -2.31 121.20 121.73 3jwd s ILE 195 Ca -0.03 -0.36 -0.26 0.00 -2.23 0.00 0.00 60.65 57.77 3jwd s ILE 195 Cb -0.17 -1.08 -0.08 0.00 -1.58 0.00 0.00 42.46 39.55 3jwd s ILE 195 CO -0.06 0.37 0.80 0.00 -1.23 0.00 0.00 174.94 174.82 3jwd s ASN 197 N -0.93 5.76 -0.08 0.00 -0.87 -0.01 -2.69 114.94 116.11 3jwd s ASN 197 Ca 0.37 0.14 -0.07 0.00 -1.57 0.00 0.00 52.86 51.73 3jwd s ASN 197 Cb -0.23 -1.66 0.03 0.00 -0.02 0.00 0.00 41.25 39.37 3jwd s ASN 197 CO 0.26 0.24 0.22 -0.69 -2.57 0.00 0.00 177.10 174.56 3jwd s VAL 198 N -1.27 -0.01 -0.29 1.60 1.01 -0.63 -3.28 120.40 117.53 3jwd s VAL 198 Ca 0.26 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.25 3jwd s VAL 198 Cb -0.12 -0.31 0.12 0.00 0.00 0.00 0.00 36.38 36.07 3jwd s VAL 198 CO 0.17 0.01 0.22 0.21 0.00 0.00 0.00 175.10 175.72 3jwd s ASN 199 N 0.35 2.51 -0.93 3.32 2.47 -1.17 -1.82 114.94 119.66 3jwd s ASN 199 Ca -0.02 -1.02 -0.16 0.00 0.42 0.00 0.00 52.86 52.08 3jwd s ASN 199 Cb -0.03 0.12 0.18 0.00 -1.45 0.00 0.00 41.25 40.07 3jwd s ASN 199 CO -0.01 -0.41 1.02 -2.28 -3.72 0.00 0.00 177.10 171.70 3jwd s HIS 200 N 2.22 3.49 0.27 0.43 5.65 0.94 -3.63 115.29 124.66 3jwd s HIS 200 Ca 0.09 -1.79 -0.00 0.00 0.25 0.00 0.00 55.06 53.61 3jwd s HIS 200 Cb -0.15 -4.08 0.50 0.00 -1.18 0.00 0.00 32.58 27.67 3jwd s HIS 200 CO -0.34 -1.25 1.84 0.87 -0.65 0.00 0.00 174.74 175.21 3jwd h LYS 201 N 8.12 0.96 -0.78 2.88 1.57 -1.81 -2.11 116.57 125.39 3jwd h LYS 201 Ca 0.16 -0.06 0.16 0.00 -1.87 0.00 0.00 60.65 59.04 3jwd h LYS 201 Cb 1.00 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 33.05 3jwd h LYS 201 CO 0.98 0.63 0.52 -1.35 -0.57 0.00 0.00 179.45 179.66 3jwd h PRO 202 N 0.99 0.40 -0.13 3.15 0.11 -1.90 -2.06 132.00 132.56 3jwd h PRO 202 Ca 0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.55 3jwd h PRO 202 Cb 0.41 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.43 3jwd h PRO 202 CO -0.25 0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 176.68 3jwd n SER 203 N -4.48 3.01 -3.93 -2.05 3.41 -0.92 -5.00 113.62 103.66 3jwd n SER 203 Ca 0.15 -2.95 -0.40 0.00 -0.26 0.00 0.00 58.87 55.41 3jwd n SER 203 Cb 0.56 -0.45 0.03 0.00 -0.26 0.00 0.00 64.21 64.09 3jwd n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3jwd n ASN 204 N -0.90 -4.60 -4.00 4.04 3.02 -0.78 -4.97 115.26 107.07 3jwd n ASN 204 Ca 0.17 -1.18 -0.26 0.00 -0.03 0.00 0.00 54.58 53.28 3jwd n ASN 204 Cb 0.72 -2.20 -0.17 0.00 -0.61 0.00 0.00 39.78 37.52 3jwd n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3jwd s THR 205 N -3.46 1.16 -0.15 3.41 2.01 -0.93 -5.01 115.64 112.67 3jwd s THR 205 Ca 0.45 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 61.98 3jwd s THR 205 Cb -0.22 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.25 3jwd s THR 205 CO 0.93 0.37 -0.04 -0.54 -0.69 0.00 0.00 174.62 174.65 3jwd s LYS 206 N 0.93 1.25 0.01 4.92 1.02 -1.26 -0.04 119.74 126.56 3jwd s LYS 206 Ca -0.09 -0.38 0.01 0.00 0.02 0.00 0.00 55.97 55.53 3jwd s LYS 206 Cb -0.15 -1.81 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 3jwd s LYS 206 CO 0.00 -0.41 -0.04 0.08 -0.92 0.00 0.00 175.35 174.06 3jwd s VAL 207 N 1.72 0.31 0.11 3.17 1.01 -0.76 -5.00 120.40 120.95 3jwd s VAL 207 Ca 0.02 -0.35 0.08 0.00 0.00 0.00 0.00 61.98 61.72 3jwd s VAL 207 Cb -0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 3jwd s VAL 207 CO -0.07 -0.03 -0.19 -1.81 0.00 0.00 0.00 175.10 172.99 3jwd s ASP 208 N -0.42 2.40 0.05 3.32 1.01 -1.26 -1.60 116.67 120.18 3jwd s ASP 208 Ca -0.02 -0.70 0.04 0.00 0.71 0.00 0.00 52.55 52.58 3jwd s ASP 208 Cb -0.03 -0.12 -0.02 0.00 1.01 0.00 0.00 42.92 43.75 3jwd s ASP 208 CO -0.00 0.02 -0.11 -0.54 0.21 0.00 0.00 175.17 174.74 3jwd s LYS 209 N -2.02 0.71 -0.10 8.23 -0.14 -1.10 -4.98 119.74 120.34 3jwd s LYS 209 Ca 0.06 -0.80 -0.16 0.00 -1.36 0.00 0.00 55.97 53.70 3jwd s LYS 209 Cb -0.09 -0.62 -0.05 0.00 -1.68 0.00 0.00 37.83 35.39 3jwd s LYS 209 CO 0.04 0.14 0.42 0.15 -0.76 0.00 0.00 175.35 175.34 3jwd s LYS 210 N -1.49 4.23 -0.27 1.68 1.02 -1.26 -2.73 119.74 120.93 3jwd s LYS 210 Ca -0.04 0.36 -0.04 0.00 0.02 0.00 0.00 55.97 56.27 3jwd s LYS 210 Cb -0.09 -3.39 0.02 0.00 -0.52 0.00 0.00 37.83 33.85 3jwd s LYS 210 CO 0.01 0.29 -0.01 0.08 -0.92 0.00 0.00 175.35 174.80 3jwd s VAL 211 N 0.23 3.29 0.00 3.17 1.01 -0.98 -4.74 120.40 122.39 3jwd s VAL 211 Ca 0.23 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3jwd s VAL 211 Cb -0.15 -2.68 -0.00 0.00 0.00 0.00 0.00 36.38 33.54 3jwd s VAL 211 CO 0.09 0.15 -0.03 -1.61 0.00 0.00 0.00 175.10 173.71 3jwd s GLU 212 N 1.39 0.22 0.00 2.72 2.02 -1.26 -4.54 118.70 119.25 3jwd s GLU 212 Ca 0.01 -0.13 0.17 0.00 0.02 0.00 0.00 54.97 55.04 3jwd s GLU 212 Cb -0.17 -0.19 1.03 0.00 0.10 0.00 0.00 34.13 34.91 3jwd s GLU 212 CO -0.02 0.05 1.44 -2.30 0.02 0.00 0.00 175.26 174.45