#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrl n LYS 13 N 0.00 0.00 -0.04 -0.52 4.76 -1.26 -4.03 118.16 117.07 2wrl n LYS 13 Ca 0.00 0.00 -0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wrl n LYS 13 Cb 0.00 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2wrl n LYS 13 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wrl n GLY 14 N 0.00 0.65 3.92 0.72 0.00 -1.26 -4.71 105.19 104.51 2wrl n GLY 14 Ca 0.00 -0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2wrl n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wrl s VAL 15 N 1.88 1.90 -0.30 1.61 -7.23 -1.26 -4.26 120.40 112.75 2wrl s VAL 15 Ca 0.00 -1.39 -0.02 0.00 -1.81 0.00 0.00 61.98 58.76 2wrl s VAL 15 Cb 0.00 -2.29 0.19 0.00 0.56 0.00 0.00 36.38 34.84 2wrl s VAL 15 CO 0.00 0.00 0.70 -0.44 -0.31 0.00 0.00 175.10 175.05 2wrl s SER 16 N -4.32 -1.22 -0.88 4.85 0.01 -0.03 -4.90 113.70 107.22 2wrl s SER 16 Ca 0.41 0.63 -0.12 0.00 1.31 0.00 0.00 55.95 58.18 2wrl s SER 16 Cb -0.03 1.97 0.23 0.00 0.21 0.00 0.00 66.02 68.40 2wrl s SER 16 CO 0.25 -0.23 0.82 -0.69 0.41 0.00 0.00 173.24 173.81 2wrl s VAL 17 N 2.88 5.55 0.00 3.43 1.01 -1.26 -0.37 120.40 131.63 2wrl s VAL 17 Ca 0.16 -2.76 0.00 0.00 0.00 0.00 0.00 61.98 59.38 2wrl s VAL 17 Cb -0.13 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 31.84 2wrl s VAL 17 CO -0.20 -1.06 0.00 -0.62 0.00 0.00 0.00 175.10 173.22 2wrl n GLU 18 N 3.61 -0.14 -2.77 2.72 -0.58 -0.24 -4.37 120.64 118.88 2wrl n GLU 18 Ca 0.16 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.83 2wrl n GLU 18 Cb 0.44 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 31.30 2wrl n GLU 18 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2wrl n VAL 19 N -1.66 0.00 -3.65 2.62 0.31 -1.26 -4.48 118.33 110.20 2wrl n VAL 19 Ca 0.00 -0.88 0.00 0.00 -0.01 0.00 0.00 64.34 63.45 2wrl n VAL 19 Cb 0.00 0.55 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 2wrl n VAL 19 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wrl n ALA 20 N -1.83 0.00 -1.00 3.52 0.00 -1.18 -4.47 120.51 115.55 2wrl n ALA 20 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2wrl n ALA 20 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2wrl n ALA 20 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wrl n PRO 21 N 0.00 0.00 0.00 0.00 -0.02 -1.26 -4.53 135.00 129.20 2wrl n PRO 21 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.50 2wrl n PRO 21 Cb 0.00 -0.92 -0.02 0.00 -0.02 0.00 0.00 33.50 32.54 2wrl n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wrl n GLY 22 N -0.32 0.48 3.87 -1.23 0.00 -1.26 -4.88 105.19 101.85 2wrl n GLY 22 Ca 0.00 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 2wrl n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wrl s ARG 23 N -1.32 3.63 -0.34 1.61 0.52 -1.26 0.13 118.95 121.90 2wrl s ARG 23 Ca 0.02 0.70 0.04 0.00 -0.52 0.00 0.00 55.73 55.97 2wrl s ARG 23 Cb 0.03 -2.12 0.16 0.00 0.52 0.00 0.00 34.95 33.54 2wrl s ARG 23 CO 0.17 -0.49 0.45 0.08 0.02 0.00 0.00 175.30 175.52 2wrl s VAL 24 N -3.07 -0.61 0.53 3.52 1.01 -1.11 -3.11 120.40 117.57 2wrl s VAL 24 Ca 0.54 -0.48 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 2wrl s VAL 24 Cb -0.11 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 2wrl s VAL 24 CO 0.51 -0.33 1.21 -0.54 0.00 0.00 0.00 175.10 175.94 2wrl s LYS 25 N 2.00 3.31 -0.19 2.72 1.02 -1.26 -2.83 119.74 124.51 2wrl s LYS 25 Ca 0.14 1.84 -0.05 0.00 0.02 0.00 0.00 55.97 57.92 2wrl s LYS 25 Cb -0.12 -2.15 0.07 0.00 -0.52 0.00 0.00 37.83 35.11 2wrl s LYS 25 CO -0.16 -0.94 0.09 0.08 -0.92 0.00 0.00 175.35 173.51 2wrl s VAL 26 N -1.56 -0.04 -0.18 3.17 1.01 -0.80 -1.08 120.40 120.93 2wrl s VAL 26 Ca 0.71 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 62.23 2wrl s VAL 26 Cb -0.30 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2wrl s VAL 26 CO 0.35 -0.36 0.37 -0.54 0.00 0.00 0.00 175.10 174.92 2wrl s LYS 27 N 2.11 4.23 0.00 2.72 1.02 0.50 -1.84 119.74 128.47 2wrl s LYS 27 Ca 0.03 0.19 0.00 0.00 0.02 0.00 0.00 55.97 56.21 2wrl s LYS 27 Cb -0.16 -3.49 0.00 0.00 -0.52 0.00 0.00 37.83 33.66 2wrl s LYS 27 CO -0.14 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.78 2wrl n GLY 28 N 3.66 3.75 0.06 -3.33 0.00 -1.17 -0.85 105.19 107.32 2wrl n GLY 28 Ca -0.09 -1.38 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 2wrl n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wrl h PRO 29 N 0.00 -0.02 -0.18 1.61 0.11 -1.68 -3.36 132.00 128.47 2wrl h PRO 29 Ca 0.00 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.92 2wrl h PRO 29 Cb 0.00 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.12 2wrl h PRO 29 CO 0.00 0.43 -0.66 0.87 -0.21 0.00 0.00 178.00 178.42 2wrl h LYS 30 N -0.48 0.70 0.00 1.05 1.79 -1.59 -3.49 116.57 114.54 2wrl h LYS 30 Ca -0.00 -0.51 0.00 0.00 -2.18 0.00 0.00 60.65 57.96 2wrl h LYS 30 Cb 0.46 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2wrl h LYS 30 CO 0.00 1.13 0.00 0.41 -1.08 0.00 0.00 179.45 179.91 2wrl n GLY 31 N 0.50 -1.33 3.57 3.86 0.00 -1.26 -5.06 105.19 105.48 2wrl n GLY 31 Ca -0.05 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 2wrl n GLY 31 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wrl s GLU 32 N -0.89 2.18 -0.05 1.61 2.12 -1.26 -3.05 118.70 119.35 2wrl s GLU 32 Ca 0.00 -0.98 0.04 0.00 0.36 0.00 0.00 54.97 54.39 2wrl s GLU 32 Cb 0.00 -2.33 -0.00 0.00 0.26 0.00 0.00 34.13 32.06 2wrl s GLU 32 CO 0.00 0.52 -0.18 -0.51 -0.54 0.00 0.00 175.26 174.56 2wrl s LEU 33 N -2.07 1.90 -0.77 2.70 1.43 -0.77 -4.96 118.68 116.15 2wrl s LEU 33 Ca 0.21 -0.37 -0.15 0.00 -1.03 0.00 0.00 54.13 52.78 2wrl s LEU 33 Cb -0.11 -1.01 0.19 0.00 0.03 0.00 0.00 46.19 45.28 2wrl s LEU 33 CO 0.13 0.14 0.74 -1.61 0.23 0.00 0.00 176.35 175.98 2wrl s GLU 34 N 0.14 3.45 -0.77 1.70 0.41 -1.26 -1.90 118.70 120.47 2wrl s GLU 34 Ca -0.07 -2.19 -0.23 0.00 -0.41 0.00 0.00 54.97 52.07 2wrl s GLU 34 Cb -0.13 -4.44 0.06 0.00 -1.78 0.00 0.00 34.13 27.85 2wrl s GLU 34 CO 0.03 -1.35 1.15 0.08 -0.49 0.00 0.00 175.26 174.67 2wrl s VAL 35 N 0.80 4.15 -0.33 2.63 1.01 -1.13 -4.88 120.40 122.65 2wrl s VAL 35 Ca 0.16 -0.36 -0.28 0.00 0.00 0.00 0.00 61.98 61.49 2wrl s VAL 35 Cb -0.14 -4.82 -0.02 0.00 0.00 0.00 0.00 36.38 31.40 2wrl s VAL 35 CO -0.06 -1.65 1.82 -2.16 0.00 0.00 0.00 175.10 173.05 2wrl s PRO 36 N 4.48 3.31 0.30 2.72 0.04 -1.26 -2.77 135.00 141.83 2wrl s PRO 36 Ca 0.31 1.44 0.10 0.00 0.04 0.00 0.00 61.00 62.89 2wrl s PRO 36 Cb -0.10 -4.21 -0.05 0.00 0.04 0.00 0.00 34.50 30.18 2wrl s PRO 36 CO 0.06 -1.89 -0.10 0.08 0.04 0.00 0.00 177.00 175.20 2wrl s VAL 37 N 7.00 2.65 0.24 -0.36 1.01 0.34 -4.99 120.40 126.29 2wrl s VAL 37 Ca 0.80 -2.18 -0.12 0.00 0.00 0.00 0.00 61.98 60.48 2wrl s VAL 37 Cb -0.23 -2.58 -0.08 0.00 0.00 0.00 0.00 36.38 33.50 2wrl s VAL 37 CO 0.33 -0.31 0.61 -0.55 0.00 0.00 0.00 175.10 175.18 2wrl s SER 38 N -3.61 6.73 0.00 3.32 0.15 -1.26 -4.49 113.70 114.54 2wrl s SER 38 Ca 0.32 1.08 0.00 0.00 0.70 0.00 0.00 55.95 58.04 2wrl s SER 38 Cb -0.03 -2.29 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2wrl s SER 38 CO 0.17 -0.07 0.15 -2.65 1.20 0.00 0.00 173.24 172.04 2wrl n PRO 39 N 0.01 0.26 -2.40 5.44 -0.02 -1.26 -4.24 135.00 132.79 2wrl n PRO 39 Ca 0.00 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.08 2wrl n PRO 39 Cb 0.52 -1.17 0.02 0.00 -0.02 0.00 0.00 33.50 32.85 2wrl n PRO 39 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wrl n GLU 40 N 0.46 4.87 0.00 -0.52 -0.58 -1.26 -4.64 120.64 118.98 2wrl n GLU 40 Ca 0.00 -4.24 0.00 0.00 -0.42 0.00 0.00 57.16 52.50 2wrl n GLU 40 Cb 0.08 -2.46 0.00 0.00 -0.57 0.00 0.00 31.44 28.48 2wrl n GLU 40 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 2wrl n MET 41 N 0.21 0.00 -0.92 3.49 0.00 -1.26 -4.42 117.12 114.22 2wrl n MET 41 Ca 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 58.21 2wrl n MET 41 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.48 2wrl n MET 41 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2wrl n ARG 42 N 0.00 0.00 -3.11 2.12 0.63 -1.26 -4.84 116.66 110.20 2wrl n ARG 42 Ca 0.00 0.14 -0.31 0.00 -0.92 0.00 0.00 57.85 56.76 2wrl n ARG 42 Cb 0.00 -0.92 -0.04 0.00 0.45 0.00 0.00 32.46 31.94 2wrl n ARG 42 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2wrl s VAL 43 N -2.62 4.81 0.37 5.15 -7.23 -1.26 -5.00 120.40 114.63 2wrl s VAL 43 Ca 0.00 0.62 0.04 0.00 -1.81 0.00 0.00 61.98 60.83 2wrl s VAL 43 Cb 0.00 -3.67 -0.03 0.00 0.56 0.00 0.00 36.38 33.23 2wrl s VAL 43 CO 0.00 -0.31 0.13 -0.69 -0.31 0.00 0.00 175.10 173.92 2wrl s VAL 44 N -2.11 0.60 0.00 1.32 1.01 -1.26 -4.91 120.40 115.04 2wrl s VAL 44 Ca 0.50 -2.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.43 2wrl s VAL 44 Cb -0.10 -2.45 -0.23 0.00 0.00 0.00 0.00 36.38 33.59 2wrl s VAL 44 CO 0.25 0.00 3.30 0.52 0.00 0.00 0.00 175.10 179.17 2wrl n VAL 45 N -0.79 2.72 -1.23 2.92 0.31 -1.26 -4.01 118.33 116.98 2wrl n VAL 45 Ca -0.03 -1.33 -0.12 0.00 -0.01 0.00 0.00 64.34 62.85 2wrl n VAL 45 Cb 0.65 -1.93 -0.12 0.00 -0.91 0.00 0.00 33.84 31.53 2wrl n VAL 45 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2wrl n GLU 46 N 2.47 0.00 0.00 5.55 0.28 -1.26 -4.49 120.64 123.19 2wrl n GLU 46 Ca 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.37 2wrl n GLU 46 Cb 0.83 -0.95 0.00 0.00 1.43 0.00 0.00 31.44 32.74 2wrl n GLU 46 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2wrl n GLU 47 N 4.84 0.00 0.00 3.44 1.02 -1.26 -4.44 120.64 124.24 2wrl n GLU 47 Ca 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2wrl n GLU 47 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.70 2wrl n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wrl n GLY 48 N 0.00 -1.24 1.30 0.62 0.00 -1.26 -4.90 105.19 99.71 2wrl n GLY 48 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2wrl n GLY 48 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wrl n VAL 49 N -0.02 0.00 -4.20 1.61 0.24 -1.26 -4.39 118.33 110.32 2wrl n VAL 49 Ca 0.00 -0.29 -0.27 0.00 -2.04 0.00 0.00 64.34 61.74 2wrl n VAL 49 Cb 0.00 -1.61 -0.08 0.00 -1.47 0.00 0.00 33.84 30.68 2wrl n VAL 49 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2wrl s VAL 50 N -1.92 3.72 0.31 3.34 1.01 -1.26 -4.10 120.40 121.50 2wrl s VAL 50 Ca 0.26 -1.35 0.08 0.00 0.00 0.00 0.00 61.98 60.97 2wrl s VAL 50 Cb -0.01 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2wrl s VAL 50 CO 0.19 -0.06 0.15 -0.13 0.00 0.00 0.00 175.10 175.25 2wrl s ARG 51 N -2.78 2.51 -0.45 2.72 0.52 -1.26 -4.97 118.95 115.24 2wrl s ARG 51 Ca 0.27 -1.40 0.05 0.00 -0.52 0.00 0.00 55.73 54.13 2wrl s ARG 51 Cb -0.10 -2.29 0.18 0.00 0.52 0.00 0.00 34.95 33.26 2wrl s ARG 51 CO 0.18 0.21 0.50 0.08 0.02 0.00 0.00 175.30 176.28 2wrl s VAL 52 N -2.34 -0.22 0.00 3.52 1.01 -1.26 -4.50 120.40 116.61 2wrl s VAL 52 Ca 0.36 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 60.40 2wrl s VAL 52 Cb -0.05 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.60 2wrl s VAL 52 CO 0.23 -0.73 0.00 1.21 0.00 0.00 0.00 175.10 175.81 2wrl n GLU 53 N 2.92 0.26 -3.64 2.72 0.00 -1.26 -4.83 120.64 116.82 2wrl n GLU 53 Ca 0.25 0.00 -0.09 0.00 0.00 0.00 0.00 57.16 57.31 2wrl n GLU 53 Cb 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 31.44 31.88 2wrl n GLU 53 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 2wrl s ARG 54 N -2.21 0.62 0.00 5.31 1.04 -1.26 -4.62 118.95 117.83 2wrl s ARG 54 Ca 0.00 0.83 0.00 0.00 -1.04 0.00 0.00 55.73 55.52 2wrl s ARG 54 Cb 0.00 0.26 0.00 0.00 -2.04 0.00 0.00 34.95 33.17 2wrl s ARG 54 CO 0.00 -0.09 0.00 -0.35 -0.04 0.00 0.00 175.30 174.82 2wrl n PRO 55 N 2.90 0.00 -0.36 3.89 -0.04 -1.26 -4.87 135.00 135.26 2wrl n PRO 55 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2wrl n PRO 55 Cb 0.56 -0.36 0.00 0.00 -0.04 0.00 0.00 33.50 33.67 2wrl n PRO 55 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2wrl n SER 56 N 0.00 0.29 -0.56 3.54 3.41 -1.26 -5.05 113.62 113.99 2wrl n SER 56 Ca 0.00 -0.31 0.06 0.00 -0.26 0.00 0.00 58.87 58.36 2wrl n SER 56 Cb 0.00 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.15 2wrl n SER 56 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2wrl n ASP 57 N -0.85 1.76 -4.54 4.04 8.00 -1.26 -4.49 116.55 119.21 2wrl n ASP 57 Ca 0.00 -3.80 -0.29 0.00 0.71 0.00 0.00 54.79 51.41 2wrl n ASP 57 Cb 0.00 -0.52 0.20 0.00 -0.02 0.00 0.00 41.12 40.78 2wrl n ASP 57 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2wrl s GLU 58 N -3.16 -0.10 0.09 -1.24 2.02 -1.26 -4.66 118.70 110.39 2wrl s GLU 58 Ca 0.37 0.46 -0.22 0.00 0.02 0.00 0.00 54.97 55.60 2wrl s GLU 58 Cb 0.36 -1.68 -0.14 0.00 0.10 0.00 0.00 34.13 32.77 2wrl s GLU 58 CO -0.06 -3.08 1.73 -0.09 0.02 0.00 0.00 175.26 173.77 2wrl h ARG 59 N -2.14 0.05 -0.52 1.61 2.43 -1.99 -1.21 114.38 112.61 2wrl h ARG 59 Ca -0.55 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 58.70 2wrl h ARG 59 Cb 1.33 -0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.77 2wrl h ARG 59 CO 0.54 0.06 -0.38 0.00 -1.51 0.00 0.00 179.97 178.68 2wrl h ARG 60 N 0.03 -0.22 0.72 0.20 3.08 -1.99 -0.52 114.38 115.68 2wrl h ARG 60 Ca 0.01 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 2wrl h ARG 60 Cb 0.02 0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.12 2wrl h ARG 60 CO -0.00 -0.15 -0.35 0.45 -1.07 0.00 0.00 179.97 178.85 2wrl h HIS 61 N -0.23 -0.90 -0.96 3.04 3.86 -1.83 -0.47 115.15 117.66 2wrl h HIS 61 Ca 0.19 -0.02 0.25 0.00 -1.16 0.00 0.00 60.37 59.62 2wrl h HIS 61 Cb 0.56 0.30 -0.18 0.00 1.06 0.00 0.00 27.41 29.15 2wrl h HIS 61 CO -0.64 -0.56 -0.02 0.87 0.86 0.00 0.00 177.93 178.44 2wrl h LYS 62 N -0.98 0.02 0.89 2.45 1.57 -0.97 0.45 116.57 120.01 2wrl h LYS 62 Ca -0.10 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 2wrl h LYS 62 Cb 0.75 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.06 2wrl h LYS 62 CO 0.16 0.01 -0.43 0.77 -0.57 0.00 0.00 179.45 179.40 2wrl h SER 63 N 0.02 -1.02 -0.94 0.86 0.02 -0.87 -3.08 113.55 108.54 2wrl h SER 63 Ca 0.56 0.04 0.15 0.00 -0.84 0.00 0.00 61.79 61.69 2wrl h SER 63 Cb 1.08 0.26 -0.08 0.00 0.14 0.00 0.00 62.40 63.80 2wrl h SER 63 CO -0.91 -0.68 0.60 -0.07 -1.14 0.00 0.00 176.83 174.63 2wrl h LEU 64 N -1.28 0.75-10.05 5.07 3.38 -0.28 -3.28 115.31 109.61 2wrl h LEU 64 Ca -0.12 0.05 -0.51 0.00 0.09 0.00 0.00 57.88 57.38 2wrl h LEU 64 Cb 0.92 -0.10 0.08 0.00 0.09 0.00 0.00 40.66 41.66 2wrl h LEU 64 CO 0.20 0.37 0.48 -2.28 0.09 0.00 0.00 178.44 177.30 2wrl s HIS 65 N -5.78 2.66 0.00 1.13 2.46 0.08 -2.41 115.29 113.42 2wrl s HIS 65 Ca -0.11 1.52 0.00 0.00 0.47 0.00 0.00 55.06 56.94 2wrl s HIS 65 Cb 0.23 -3.41 0.00 0.00 -0.13 0.00 0.00 32.58 29.26 2wrl s HIS 65 CO 0.80 -1.79 0.00 0.41 -2.47 0.00 0.00 174.74 171.68 2wrl n GLY 66 N 0.40 2.02 0.30 1.59 0.00 -1.26 -4.57 105.19 103.67 2wrl n GLY 66 Ca 0.10 -0.28 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 2wrl n GLY 66 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wrl h LEU 67 N 0.00 -0.91 0.58 0.99 5.85 -1.59 0.13 115.31 120.35 2wrl h LEU 67 Ca 0.00 0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2wrl h LEU 67 Cb 0.00 0.49 0.01 0.00 0.37 0.00 0.00 40.66 41.52 2wrl h LEU 67 CO 0.00 -0.27 -0.28 0.74 -0.34 0.00 0.00 178.44 178.29 2wrl h THR 68 N -0.12 0.38 0.00 1.05 2.02 -1.72 -1.61 112.91 112.91 2wrl h THR 68 Ca 0.25 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.21 2wrl h THR 68 Cb 0.52 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2wrl h THR 68 CO -0.64 0.03 0.65 -1.14 0.37 0.00 0.00 175.52 174.79 2wrl n ARG 69 N -5.37 0.01 -0.01 6.66 0.63 0.09 -0.38 116.66 118.30 2wrl n ARG 69 Ca -0.12 0.31 -0.01 0.00 -0.92 0.00 0.00 57.85 57.10 2wrl n ARG 69 Cb 0.34 -2.17 -0.01 0.00 0.45 0.00 0.00 32.46 31.06 2wrl n ARG 69 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2wrl n THR 70 N -1.48 0.12 0.28 5.15 -1.04 0.21 -3.80 114.28 113.71 2wrl n THR 70 Ca -0.00 -0.06 0.12 0.00 -2.04 0.00 0.00 64.05 62.07 2wrl n THR 70 Cb 0.65 -0.79 0.80 0.00 -1.82 0.00 0.00 70.33 69.16 2wrl n THR 70 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2wrl h LEU 71 N 0.00 0.00 0.00 -4.42 4.07 0.27 -1.13 115.31 114.09 2wrl h LEU 71 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.91 2wrl h LEU 71 Cb 1.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.83 2wrl h LEU 71 CO -0.00 0.02 0.00 -0.38 -1.08 0.00 0.00 178.44 177.00 2wrl n ILE 72 N -4.03 0.00 -0.49 1.22 2.08 -0.29 -0.97 119.36 116.88 2wrl n ILE 72 Ca -0.03 0.99 0.40 0.00 0.56 0.00 0.00 62.75 64.68 2wrl n ILE 72 Cb 0.11 -1.95 0.67 0.00 -0.75 0.00 0.00 39.64 37.72 2wrl n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2wrl n ALA 73 N -1.87 1.39 0.08 -1.39 0.00 -1.08 0.21 120.51 117.85 2wrl n ALA 73 Ca 0.00 0.80 -0.11 0.00 0.00 0.00 0.00 53.44 54.12 2wrl n ALA 73 Cb 0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.32 2wrl n ALA 73 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2wrl h ASN 74 N 0.00 0.23 0.48 0.00 2.35 -1.21 -2.67 115.58 114.76 2wrl h ASN 74 Ca 0.85 -0.24 -0.09 0.00 -0.55 0.00 0.00 56.30 56.27 2wrl h ASN 74 Cb 2.85 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 41.14 2wrl h ASN 74 CO -0.37 1.16 -0.43 0.00 -1.65 0.00 0.00 177.43 176.13 2wrl h ALA 75 N 0.81 1.24 -2.16 -0.83 0.00 0.42 -0.44 119.26 118.30 2wrl h ALA 75 Ca -0.07 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2wrl h ALA 75 Cb 1.81 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.53 2wrl h ALA 75 CO 0.16 0.54 0.00 0.28 0.00 0.00 0.00 179.25 180.23 2wrl n VAL 76 N -3.95 0.00 0.00 0.00 0.31 -0.08 -3.53 118.33 111.08 2wrl n VAL 76 Ca -0.02 0.54 0.00 0.00 -0.01 0.00 0.00 64.34 64.85 2wrl n VAL 76 Cb 0.47 -1.10 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 2wrl n VAL 76 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wrl n LYS 77 N -0.92 0.00 0.24 5.55 5.02 -1.01 -0.10 118.16 126.94 2wrl n LYS 77 Ca 0.00 0.23 0.13 0.00 -2.02 0.00 0.00 58.31 56.66 2wrl n LYS 77 Cb 0.00 -1.56 0.33 0.00 -0.02 0.00 0.00 35.03 33.78 2wrl n LYS 77 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2wrl h GLY 78 N 0.00 0.00 0.00 0.72 0.00 -1.11 -3.00 103.07 99.68 2wrl h GLY 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wrl h GLY 78 CO 0.00 0.00 -0.92 3.33 0.00 0.00 0.00 176.54 178.95 2wrl n VAL 79 N -3.11 0.00 -2.01 4.60 0.24 0.86 -4.18 118.33 114.72 2wrl n VAL 79 Ca 0.03 -0.16 -0.40 0.00 -2.04 0.00 0.00 64.34 61.77 2wrl n VAL 79 Cb 0.46 0.86 0.04 0.00 -1.47 0.00 0.00 33.84 33.73 2wrl n VAL 79 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2wrl n SER 80 N -1.49 7.49 -2.82 -1.34 3.41 -1.14 -1.43 113.62 116.31 2wrl n SER 80 Ca 0.02 -3.82 -0.00 0.00 -0.26 0.00 0.00 58.87 54.81 2wrl n SER 80 Cb 0.28 -1.07 -0.00 0.00 -0.26 0.00 0.00 64.21 63.15 2wrl n SER 80 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wrl n GLU 81 N -0.48 -2.89 -1.66 4.33 1.02 -1.25 -4.93 120.64 114.78 2wrl n GLU 81 Ca 0.53 2.41 0.02 0.00 -0.02 0.00 0.00 57.16 60.10 2wrl n GLU 81 Cb 0.24 -4.42 0.06 0.00 -0.02 0.00 0.00 31.44 27.29 2wrl n GLU 81 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wrl n GLY 82 N 0.91 2.20 0.00 0.62 0.00 -1.20 -4.92 105.19 102.79 2wrl n GLY 82 Ca -0.02 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2wrl n GLY 82 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wrl n TYR 83 N -0.08 0.00 -1.49 1.61 4.02 -0.95 -4.81 117.16 115.46 2wrl n TYR 83 Ca 0.11 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.01 2wrl n TYR 83 Cb 0.99 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 40.31 2wrl n TYR 83 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2wrl n SER 84 N 0.00 -0.73 -1.26 7.72 2.88 -1.20 -4.66 113.62 116.37 2wrl n SER 84 Ca 0.00 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2wrl n SER 84 Cb 0.00 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 2wrl n SER 84 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2wrl n LYS 85 N -0.93 -3.54 -4.08 -1.46 0.00 -1.26 -3.91 118.16 102.97 2wrl n LYS 85 Ca 0.00 2.56 -0.07 0.00 0.00 0.00 0.00 58.31 60.80 2wrl n LYS 85 Cb 0.04 -2.83 -0.10 0.00 0.00 0.00 0.00 35.03 32.15 2wrl n LYS 85 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2wrl s GLU 86 N -2.83 0.59 -0.17 1.64 1.03 -1.26 -0.98 118.70 116.71 2wrl s GLU 86 Ca 0.00 -1.17 0.00 0.00 0.03 0.00 0.00 54.97 53.84 2wrl s GLU 86 Cb 0.00 0.19 0.01 0.00 -0.80 0.00 0.00 34.13 33.53 2wrl s GLU 86 CO 0.00 -0.10 -0.16 -0.51 -1.33 0.00 0.00 175.26 173.15 2wrl s LEU 87 N -2.79 2.35 -0.03 1.83 1.43 0.35 -4.66 118.68 117.16 2wrl s LEU 87 Ca 0.05 -0.55 -0.25 0.00 -1.03 0.00 0.00 54.13 52.35 2wrl s LEU 87 Cb 0.06 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2wrl s LEU 87 CO -0.09 0.03 0.78 -0.76 0.23 0.00 0.00 176.35 176.54 2wrl s LEU 88 N 1.11 4.35 -0.27 1.79 2.01 -1.16 -2.01 118.68 124.51 2wrl s LEU 88 Ca 0.00 1.34 -0.00 0.00 0.01 0.00 0.00 54.13 55.48 2wrl s LEU 88 Cb -0.14 -3.22 0.04 0.00 0.01 0.00 0.00 46.19 42.88 2wrl s LEU 88 CO -0.06 -0.13 -0.06 0.27 1.01 0.00 0.00 176.35 177.38 2wrl s ILE 89 N 0.72 2.66 0.63 -0.59 -5.25 0.32 -1.42 121.20 118.28 2wrl s ILE 89 Ca 0.41 -1.32 0.02 0.00 -0.99 0.00 0.00 60.65 58.77 2wrl s ILE 89 Cb -0.19 -2.46 0.09 0.00 2.95 0.00 0.00 42.46 42.84 2wrl s ILE 89 CO 0.21 0.05 0.88 -0.54 -1.79 0.00 0.00 174.94 173.75 2wrl s LYS 90 N 1.23 2.10 0.00 0.37 -0.14 -0.99 -4.78 119.74 117.52 2wrl s LYS 90 Ca -0.04 -1.08 0.00 0.00 -1.36 0.00 0.00 55.97 53.49 2wrl s LYS 90 Cb -0.18 -2.44 0.00 0.00 -1.68 0.00 0.00 37.83 33.52 2wrl s LYS 90 CO -0.04 -1.08 0.00 0.41 -0.76 0.00 0.00 175.35 173.88 2wrl n GLY 91 N -2.55 0.47 0.00 -3.33 0.00 -1.26 -3.16 105.19 95.36 2wrl n GLY 91 Ca 0.12 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2wrl n GLY 91 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2wrl n ILE 92 N 0.30 0.00 -0.03 -0.61 5.41 -1.26 -4.81 119.36 118.36 2wrl n ILE 92 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 63.75 2wrl n ILE 92 Cb 0.00 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2wrl n ILE 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wrl n GLY 93 N 4.88 0.68 3.49 7.39 0.00 -1.26 -4.69 105.19 115.68 2wrl n GLY 93 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2wrl n GLY 93 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrl s TYR 94 N 2.04 2.79 0.00 1.61 1.51 -1.25 -4.39 117.35 119.66 2wrl s TYR 94 Ca 0.01 -0.18 0.00 0.00 -1.01 0.00 0.00 57.07 55.88 2wrl s TYR 94 Cb 0.00 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.16 2wrl s TYR 94 CO 0.00 0.16 0.00 2.89 -1.11 0.00 0.00 175.55 177.49 2wrl n ARG 95 N 2.51 0.00 -4.17 -0.62 1.85 -1.03 -4.86 116.66 110.34 2wrl n ARG 95 Ca -0.18 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.37 2wrl n ARG 95 Cb 0.52 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.85 2wrl n ARG 95 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wrl s ALA 96 N -2.00 3.22 -0.37 2.89 0.00 -0.89 -1.60 121.76 123.00 2wrl s ALA 96 Ca 0.00 -1.13 0.13 0.00 0.00 0.00 0.00 51.96 50.96 2wrl s ALA 96 Cb 0.00 -1.14 0.42 0.00 0.00 0.00 0.00 23.12 22.40 2wrl s ALA 96 CO 0.00 0.68 0.93 -2.13 0.00 0.00 0.00 175.76 175.25 2wrl n ARG 97 N 0.67 1.68 0.00 0.00 0.63 0.16 -4.83 116.66 114.98 2wrl n ARG 97 Ca -0.12 -3.63 0.00 0.00 -0.92 0.00 0.00 57.85 53.19 2wrl n ARG 97 Cb 0.52 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.83 2wrl n ARG 97 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2wrl n LEU 98 N -0.08 0.00 -4.29 6.15 7.94 -1.26 -4.49 117.00 120.97 2wrl n LEU 98 Ca 0.19 0.00 -0.45 0.00 -1.11 0.00 0.00 56.01 54.64 2wrl n LEU 98 Cb 0.73 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.64 2wrl n LEU 98 CO 0.27 0.00 0.32 -0.69 -1.11 0.00 0.00 177.39 176.18 2wrl s VAL 99 N 0.00 5.27 0.00 1.96 1.01 0.37 -4.92 120.40 124.09 2wrl s VAL 99 Ca 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 61.98 59.63 2wrl s VAL 99 Cb 0.00 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.08 2wrl s VAL 99 CO 0.00 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 174.73 2wrl n GLY 100 N 4.15 0.15 0.19 4.51 0.00 -1.26 -3.10 105.19 109.83 2wrl n GLY 100 Ca 0.08 -1.17 0.15 0.00 0.00 0.00 0.00 46.02 45.08 2wrl n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wrl n ARG 101 N 5.43 1.26 -3.87 1.61 1.74 -1.26 -4.83 116.66 116.75 2wrl n ARG 101 Ca 0.00 -0.39 -0.29 0.00 -0.77 0.00 0.00 57.85 56.40 2wrl n ARG 101 Cb 0.00 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 29.91 2wrl n ARG 101 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wrl s ALA 102 N -2.00 3.95 -0.18 7.54 0.00 -1.18 -4.46 121.76 125.42 2wrl s ALA 102 Ca 0.44 -0.85 -0.04 0.00 0.00 0.00 0.00 51.96 51.50 2wrl s ALA 102 Cb 0.22 -1.88 -0.02 0.00 0.00 0.00 0.00 23.12 21.44 2wrl s ALA 102 CO 0.36 0.68 -0.03 -1.17 0.00 0.00 0.00 175.76 175.60 2wrl s LEU 103 N -2.83 3.15 -0.12 0.00 2.96 -1.11 -0.48 118.68 120.25 2wrl s LEU 103 Ca 0.36 -0.22 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 2wrl s LEU 103 Cb -0.12 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 2wrl s LEU 103 CO 0.28 0.09 -0.10 -0.70 -1.32 0.00 0.00 176.35 174.59 2wrl s GLU 104 N 0.84 3.29 -0.01 1.98 -6.30 -1.26 -0.96 118.70 116.28 2wrl s GLU 104 Ca -0.01 -0.63 0.00 0.00 -2.50 0.00 0.00 54.97 51.83 2wrl s GLU 104 Cb -0.14 -2.66 0.01 0.00 0.00 0.00 0.00 34.13 31.33 2wrl s GLU 104 CO 0.02 0.31 -0.01 -0.48 0.02 0.00 0.00 175.26 175.12 2wrl s LEU 105 N 0.11 1.82 -0.23 2.70 2.34 -0.52 0.40 118.68 125.30 2wrl s LEU 105 Ca -0.04 -0.02 -0.05 0.00 0.06 0.00 0.00 54.13 54.08 2wrl s LEU 105 Cb -0.14 -0.09 -0.01 0.00 -0.56 0.00 0.00 46.19 45.39 2wrl s LEU 105 CO 0.04 -0.01 -0.01 0.42 -1.06 0.00 0.00 176.35 175.73 2wrl s THR 106 N 0.19 3.59 -0.41 5.48 -4.23 -0.63 -0.20 115.64 119.44 2wrl s THR 106 Ca -0.02 -0.44 0.09 0.00 -1.18 0.00 0.00 61.69 60.14 2wrl s THR 106 Cb -0.03 -2.66 0.31 0.00 1.34 0.00 0.00 72.50 71.46 2wrl s THR 106 CO -0.01 0.39 0.80 1.33 -0.54 0.00 0.00 174.62 176.59 2wrl n VAL 107 N 4.83 -0.21 0.00 2.29 0.24 -1.26 -2.45 118.33 121.76 2wrl n VAL 107 Ca -0.18 -3.46 0.00 0.00 -2.04 0.00 0.00 64.34 58.66 2wrl n VAL 107 Cb 0.51 0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 2wrl n VAL 107 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wrl n GLY 108 N 0.63 2.08 3.20 7.63 0.00 -1.26 -5.02 105.19 112.45 2wrl n GLY 108 Ca 0.18 -0.55 -0.48 0.00 0.00 0.00 0.00 46.02 45.16 2wrl n GLY 108 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2wrl n PHE 109 N 0.00 -0.08 -0.55 1.61 3.72 -1.26 -4.68 117.46 116.22 2wrl n PHE 109 Ca 0.00 0.93 -0.08 0.00 -0.05 0.00 0.00 57.45 58.25 2wrl n PHE 109 Cb 0.00 -1.87 -0.08 0.00 -0.94 0.00 0.00 39.48 36.59 2wrl n PHE 109 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2wrl n SER 110 N 1.70 3.03 0.00 4.37 3.41 -1.26 -4.40 113.62 120.46 2wrl n SER 110 Ca 0.17 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.73 2wrl n SER 110 Cb 0.18 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 2wrl n SER 110 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2wrl n HIS 111 N 2.92 0.00 -0.73 7.33 -0.00 -1.26 -5.16 115.22 118.31 2wrl n HIS 111 Ca 0.25 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.65 2wrl n HIS 111 Cb 0.44 0.00 0.15 0.00 -0.00 0.00 0.00 29.99 30.58 2wrl n HIS 111 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2wrl n PRO 112 N 0.00 -0.53 -4.31 1.57 -0.04 -1.26 -4.90 135.00 125.53 2wrl n PRO 112 Ca 0.00 -0.11 -0.35 0.00 -0.04 0.00 0.00 63.50 63.00 2wrl n PRO 112 Cb 0.00 -2.03 -0.09 0.00 -0.04 0.00 0.00 33.50 31.34 2wrl n PRO 112 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wrl s VAL 113 N -2.46 4.44 -0.16 0.52 1.01 0.72 -4.95 120.40 119.52 2wrl s VAL 113 Ca 0.60 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.40 2wrl s VAL 113 Cb -0.21 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.29 2wrl s VAL 113 CO 0.64 0.59 -0.17 0.68 0.00 0.00 0.00 175.10 176.84 2wrl s VAL 114 N -0.78 2.44 -0.38 2.92 -7.23 -1.26 -1.43 120.40 114.68 2wrl s VAL 114 Ca 0.12 -0.84 0.01 0.00 -1.81 0.00 0.00 61.98 59.46 2wrl s VAL 114 Cb -0.12 -2.02 0.13 0.00 0.56 0.00 0.00 36.38 34.93 2wrl s VAL 114 CO 0.02 0.52 0.19 -0.69 -0.31 0.00 0.00 175.10 174.84 2wrl s VAL 115 N 0.92 0.93 0.17 1.32 1.01 -0.13 -5.02 120.40 119.59 2wrl s VAL 115 Ca -0.04 -2.02 -0.30 0.00 0.00 0.00 0.00 61.98 59.62 2wrl s VAL 115 Cb -0.15 -1.67 -0.08 0.00 0.00 0.00 0.00 36.38 34.48 2wrl s VAL 115 CO -0.03 -0.86 1.33 -0.70 0.00 0.00 0.00 175.10 174.85 2wrl s GLU 116 N 0.88 4.36 0.32 2.72 -6.30 -1.26 -2.76 118.70 116.67 2wrl s GLU 116 Ca 0.16 2.06 -0.26 0.00 -2.50 0.00 0.00 54.97 54.42 2wrl s GLU 116 Cb -0.22 -3.21 -0.10 0.00 0.00 0.00 0.00 34.13 30.60 2wrl s GLU 116 CO -0.07 -0.32 0.96 -1.25 0.02 0.00 0.00 175.26 174.61 2wrl s PRO 117 N 0.29 4.57 0.64 4.30 0.04 -1.26 -4.99 135.00 138.59 2wrl s PRO 117 Ca 0.59 1.38 -0.13 0.00 0.04 0.00 0.00 61.00 62.88 2wrl s PRO 117 Cb -0.37 -2.83 -0.02 0.00 0.04 0.00 0.00 34.50 31.32 2wrl s PRO 117 CO 0.36 0.26 1.05 -1.25 0.04 0.00 0.00 177.00 177.45 2wrl s PRO 118 N -2.00 3.24 -0.26 0.56 0.04 -1.26 -4.90 135.00 130.41 2wrl s PRO 118 Ca 0.50 1.00 -0.36 0.00 0.04 0.00 0.00 61.00 62.18 2wrl s PRO 118 Cb -0.20 -2.03 -0.12 0.00 0.04 0.00 0.00 34.50 32.19 2wrl s PRO 118 CO 0.25 -0.86 2.00 -1.91 0.04 0.00 0.00 177.00 176.52 2wrl n GLU 119 N -2.60 1.40 0.00 4.56 2.13 -1.26 -1.95 120.64 122.91 2wrl n GLU 119 Ca 0.08 0.46 0.00 0.00 0.66 0.00 0.00 57.16 58.36 2wrl n GLU 119 Cb 0.53 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.81 2wrl n GLU 119 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wrl n GLY 120 N 5.38 1.43 3.01 8.31 0.00 -1.26 -5.09 105.19 116.97 2wrl n GLY 120 Ca 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.22 2wrl n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wrl s ILE 121 N -2.00 -0.02 0.03 -0.61 1.01 -0.82 -3.62 121.20 115.17 2wrl s ILE 121 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 60.65 60.78 2wrl s ILE 121 Cb 0.00 -0.25 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 2wrl s ILE 121 CO 0.00 0.02 -0.21 -0.89 0.00 0.00 0.00 174.94 173.86 2wrl s THR 122 N 0.45 1.68 -0.26 2.92 2.01 -0.38 -4.67 115.64 117.39 2wrl s THR 122 Ca -0.03 -1.15 -0.10 0.00 0.31 0.00 0.00 61.69 60.72 2wrl s THR 122 Cb -0.04 -1.45 -0.05 0.00 0.01 0.00 0.00 72.50 70.97 2wrl s THR 122 CO -0.02 0.26 0.16 -0.36 -0.69 0.00 0.00 174.62 173.96 2wrl s PHE 123 N -0.75 3.23 -0.23 4.92 0.08 -1.26 -1.43 117.98 122.54 2wrl s PHE 123 Ca 0.08 0.06 -0.21 0.00 0.12 0.00 0.00 56.93 56.98 2wrl s PHE 123 Cb -0.09 -2.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.03 2wrl s PHE 123 CO 0.01 -0.11 0.63 -1.21 -0.10 0.00 0.00 175.22 174.44 2wrl s GLU 124 N 1.47 4.15 -0.48 0.44 0.41 -0.12 -4.99 118.70 119.58 2wrl s GLU 124 Ca 0.07 0.58 0.07 0.00 -0.41 0.00 0.00 54.97 55.28 2wrl s GLU 124 Cb -0.15 -3.62 0.39 0.00 -1.78 0.00 0.00 34.13 28.96 2wrl s GLU 124 CO 0.08 -0.35 0.99 0.28 -0.49 0.00 0.00 175.26 175.77 2wrl n VAL 125 N 5.00 2.28 0.00 2.63 0.31 -1.26 -2.34 118.33 124.95 2wrl n VAL 125 Ca -0.01 -4.99 0.00 0.00 -0.01 0.00 0.00 64.34 59.34 2wrl n VAL 125 Cb 0.49 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 2wrl n VAL 125 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2wrl n PRO 126 N -0.27 0.00 -1.50 5.55 -0.04 -1.26 -4.74 135.00 132.74 2wrl n PRO 126 Ca 0.32 0.17 -0.30 0.00 -0.04 0.00 0.00 63.50 63.65 2wrl n PRO 126 Cb 0.57 -0.98 0.21 0.00 -0.04 0.00 0.00 33.50 33.25 2wrl n PRO 126 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2wrl s GLU 127 N -0.96 -0.17 0.18 0.54 0.41 -1.26 -4.95 118.70 112.49 2wrl s GLU 127 Ca 0.00 -0.18 0.23 0.00 -0.41 0.00 0.00 54.97 54.61 2wrl s GLU 127 Cb 0.00 -1.73 0.07 0.00 -1.78 0.00 0.00 34.13 30.69 2wrl s GLU 127 CO 0.00 -2.99 1.10 -1.00 -0.49 0.00 0.00 175.26 171.87 2wrl h PRO 128 N -2.06 0.00 0.00 0.39 0.13 -1.88 -3.34 132.00 125.24 2wrl h PRO 128 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2wrl h PRO 128 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2wrl h PRO 128 CO 0.39 0.00 -1.73 0.25 -0.23 0.00 0.00 178.00 176.68 2wrl n THR 129 N -2.53 0.00 -4.14 1.56 -2.24 -1.26 -2.10 114.28 103.57 2wrl n THR 129 Ca 0.01 -0.38 -0.30 0.00 -2.27 0.00 0.00 64.05 61.11 2wrl n THR 129 Cb 0.52 0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 2wrl n THR 129 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2wrl s ARG 130 N -3.31 2.48 -0.25 -0.78 0.52 -1.26 -0.52 118.95 115.83 2wrl s ARG 130 Ca -0.04 -0.87 -0.07 0.00 -0.52 0.00 0.00 55.73 54.23 2wrl s ARG 130 Cb 0.14 -2.51 0.12 0.00 0.52 0.00 0.00 34.95 33.22 2wrl s ARG 130 CO 0.85 0.54 0.51 0.08 0.02 0.00 0.00 175.30 177.29 2wrl s VAL 131 N -1.30 -0.79 0.15 3.52 1.01 -0.85 -4.06 120.40 118.07 2wrl s VAL 131 Ca 0.25 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2wrl s VAL 131 Cb -0.12 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 2wrl s VAL 131 CO 0.18 0.02 -0.10 0.00 0.00 0.00 0.00 175.10 175.20 2wrl s ARG 132 N 2.72 2.09 -0.05 2.72 1.70 -0.99 0.13 118.95 127.28 2wrl s ARG 132 Ca 0.01 -1.15 0.01 0.00 -0.47 0.00 0.00 55.73 54.13 2wrl s ARG 132 Cb -0.13 -2.23 -0.03 0.00 -0.57 0.00 0.00 34.95 31.99 2wrl s ARG 132 CO -0.16 0.47 -0.05 0.08 -1.08 0.00 0.00 175.30 174.55 2wrl s VAL 133 N -1.47 3.81 -0.21 4.99 1.01 -0.16 -0.95 120.40 127.43 2wrl s VAL 133 Ca 0.23 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.66 2wrl s VAL 133 Cb -0.10 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 2wrl s VAL 133 CO 0.14 0.54 -0.02 -0.44 0.00 0.00 0.00 175.10 175.33 2wrl s SER 134 N -0.99 4.58 0.02 3.32 0.01 -0.51 -3.23 113.70 116.89 2wrl s SER 134 Ca 0.14 -0.29 -0.18 0.00 1.31 0.00 0.00 55.95 56.92 2wrl s SER 134 Cb -0.11 -1.79 0.04 0.00 0.21 0.00 0.00 66.02 64.37 2wrl s SER 134 CO 0.03 0.02 0.41 -0.83 0.41 0.00 0.00 173.24 173.28 2wrl s GLY 135 N 1.24 -0.26 0.14 3.44 0.00 -1.26 -1.25 107.32 109.37 2wrl s GLY 135 Ca 0.03 0.39 0.25 0.00 0.00 0.00 0.00 44.72 45.39 2wrl s GLY 135 CO 0.00 0.14 1.43 1.39 0.00 0.00 0.00 173.10 176.06 2wrl n ILE 136 N 0.74 0.42 0.00 0.90 -0.00 -1.24 -2.25 119.36 117.93 2wrl n ILE 136 Ca -0.19 -0.28 0.00 0.00 -0.00 0.00 0.00 62.75 62.28 2wrl n ILE 136 Cb 0.59 -0.24 0.00 0.00 -0.00 0.00 0.00 39.64 39.98 2wrl n ILE 136 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2wrl n ASP 137 N -2.15 0.00 0.00 4.38 -0.08 -1.26 -4.36 116.55 113.07 2wrl n ASP 137 Ca 0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 2wrl n ASP 137 Cb 0.44 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.90 2wrl n ASP 137 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2wrl n LYS 138 N 0.00 0.00 0.29 -0.67 4.81 -1.26 -4.83 118.16 116.50 2wrl n LYS 138 Ca 0.00 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.60 2wrl n LYS 138 Cb 0.00 0.00 0.77 0.00 0.02 0.00 0.00 35.03 35.82 2wrl n LYS 138 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 2wrl h GLN 139 N 0.00 0.00 0.06 1.64 5.75 -1.98 0.43 115.11 121.01 2wrl h GLN 139 Ca 0.00 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2wrl h GLN 139 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 2wrl h GLN 139 CO 0.00 0.00 -0.03 0.87 -2.65 0.00 0.00 178.83 177.02 2wrl h LYS 140 N 0.00 -0.08 0.50 1.69 1.57 -2.00 -3.34 116.57 114.92 2wrl h LYS 140 Ca 0.03 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2wrl h LYS 140 Cb 0.81 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2wrl h LYS 140 CO -0.00 -0.05 -0.24 0.28 -0.57 0.00 0.00 179.45 178.87 2wrl h VAL 141 N -0.72 0.45 -1.51 0.50 2.07 -1.41 -1.03 116.25 114.60 2wrl h VAL 141 Ca -0.01 -0.29 0.49 0.00 0.82 0.00 0.00 66.70 67.71 2wrl h VAL 141 Cb 0.06 0.58 -0.12 0.00 -1.52 0.00 0.00 31.29 30.29 2wrl h VAL 141 CO 0.01 0.05 1.01 1.23 0.02 0.00 0.00 177.57 179.89 2wrl h GLY 142 N -0.86 0.99 0.04 2.17 0.00 -0.46 0.76 103.07 105.71 2wrl h GLY 142 Ca -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2wrl h GLY 142 CO 0.11 -0.34 -0.02 1.46 0.00 0.00 0.00 176.54 177.76 2wrl h GLN 143 N 0.02 -0.05 -0.93 4.80 1.08 -1.61 -3.25 115.11 115.17 2wrl h GLN 143 Ca 0.88 0.00 0.27 0.00 -1.45 0.00 0.00 58.65 58.35 2wrl h GLN 143 Cb 3.00 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 30.41 2wrl h GLN 143 CO -0.33 -0.03 0.72 0.28 -0.95 0.00 0.00 178.83 178.51 2wrl h VAL 144 N -0.26 0.43 0.45 -0.54 2.07 0.21 0.42 116.25 119.03 2wrl h VAL 144 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 2wrl h VAL 144 Cb 0.04 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 2wrl h VAL 144 CO 0.01 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 177.37 2wrl h ALA 145 N 1.42 -1.14 0.34 1.67 0.00 0.35 -0.26 119.26 121.64 2wrl h ALA 145 Ca 0.44 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2wrl h ALA 145 Cb 1.88 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.94 2wrl h ALA 145 CO -0.00 -1.10 -0.28 0.00 0.00 0.00 0.00 179.25 177.86 2wrl h ALA 146 N -1.65 -0.62 -0.78 0.00 0.00 -1.29 -0.58 119.26 114.33 2wrl h ALA 146 Ca -0.06 -0.11 0.28 0.00 0.00 0.00 0.00 54.91 55.03 2wrl h ALA 146 Cb 0.49 0.38 -0.14 0.00 0.00 0.00 0.00 17.79 18.51 2wrl h ALA 146 CO 0.09 -0.87 0.26 0.09 0.00 0.00 0.00 179.25 178.81 2wrl n ASN 147 N -5.40 0.12 0.02 0.00 5.03 0.14 0.22 115.26 115.39 2wrl n ASN 147 Ca -0.10 1.31 -0.12 0.00 0.87 0.00 0.00 54.58 56.55 2wrl n ASN 147 Cb 0.31 -0.57 -0.09 0.00 -1.02 0.00 0.00 39.78 38.40 2wrl n ASN 147 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 2wrl h ILE 148 N 0.00 1.13 -0.72 2.41 1.08 -0.12 -3.21 117.51 118.09 2wrl h ILE 148 Ca 0.59 -1.28 0.21 0.00 -0.39 0.00 0.00 64.86 63.99 2wrl h ILE 148 Cb 1.44 1.90 -0.03 0.00 -3.07 0.00 0.00 36.82 37.06 2wrl h ILE 148 CO -0.66 0.29 0.55 -0.09 -0.69 0.00 0.00 178.15 177.56 2wrl h ARG 149 N -0.76 0.00 -0.89 2.37 2.43 0.42 -0.92 114.38 117.03 2wrl h ARG 149 Ca -0.01 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2wrl h ARG 149 Cb 0.57 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.07 2wrl h ARG 149 CO 0.02 0.00 0.58 0.00 -1.51 0.00 0.00 179.97 179.06 2wrl h ALA 150 N 1.57 1.16 -0.95 2.80 0.00 0.29 -2.91 119.26 121.21 2wrl h ALA 150 Ca 0.34 -0.05 0.29 0.00 0.00 0.00 0.00 54.91 55.49 2wrl h ALA 150 Cb 1.45 -0.32 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 2wrl h ALA 150 CO -0.00 0.46 0.10 -0.89 0.00 0.00 0.00 179.25 178.91 2wrl n ILE 151 N -4.51 -0.40 -3.18 0.00 2.08 -0.35 -2.80 119.36 110.20 2wrl n ILE 151 Ca 0.11 2.07 -0.19 0.00 0.56 0.00 0.00 62.75 65.31 2wrl n ILE 151 Cb 0.07 -3.08 -0.03 0.00 -0.75 0.00 0.00 39.64 35.84 2wrl n ILE 151 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 2wrl n ARG 152 N -5.38 1.06 -1.15 0.38 3.00 -1.11 -5.09 116.66 108.36 2wrl n ARG 152 Ca 0.25 -3.44 -0.38 0.00 -0.00 0.00 0.00 57.85 54.28 2wrl n ARG 152 Cb 0.82 -1.71 -0.01 0.00 0.00 0.00 0.00 32.46 31.55 2wrl n ARG 152 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2wrl n LYS 153 N 0.30 0.00 0.00 -0.14 4.81 -1.12 -2.21 118.16 119.80 2wrl n LYS 153 Ca 0.25 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 2wrl n LYS 153 Cb 0.64 -0.86 0.00 0.00 0.02 0.00 0.00 35.03 34.83 2wrl n LYS 153 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2wrl n PRO 154 N 1.05 0.00 0.00 1.64 -0.04 -1.26 -4.64 135.00 131.75 2wrl n PRO 154 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2wrl n PRO 154 Cb 0.30 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.76 2wrl n PRO 154 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2wrl n SER 155 N 0.00 0.00 -4.06 3.54 7.64 -1.26 -4.75 113.62 114.73 2wrl n SER 155 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 2wrl n SER 155 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2wrl n SER 155 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wrl n ALA 156 N 0.18 0.35 0.00 -0.43 0.00 -1.26 -4.05 120.51 115.30 2wrl n ALA 156 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.09 2wrl n ALA 156 Cb 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.07 2wrl n ALA 156 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wrl n TYR 157 N 8.14 0.00 0.00 0.00 4.01 -1.26 -3.48 117.16 124.56 2wrl n TYR 157 Ca 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 2wrl n TYR 157 Cb 0.42 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 2wrl n TYR 157 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 2wrl n HIS 158 N 0.64 -0.24 0.00 -0.72 1.44 -1.26 -4.65 115.22 110.43 2wrl n HIS 158 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2wrl n HIS 158 Cb 0.00 0.05 0.00 0.00 0.12 0.00 0.00 29.99 30.16 2wrl n HIS 158 CO 0.00 0.00 0.00 -1.91 -2.81 0.00 0.00 176.34 171.62 2wrl n GLU 159 N -1.00 0.00 0.00 -1.40 4.07 -1.23 -4.93 120.64 116.15 2wrl n GLU 159 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2wrl n GLU 159 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2wrl n GLU 159 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2wrl n LYS 160 N 0.00 0.00 0.00 5.31 5.02 -1.26 -4.29 118.16 122.94 2wrl n LYS 160 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2wrl n LYS 160 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2wrl n LYS 160 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wrl n GLY 161 N 0.50 3.92 3.41 0.72 0.00 -1.19 -4.56 105.19 108.00 2wrl n GLY 161 Ca 0.00 -1.23 -0.45 0.00 0.00 0.00 0.00 46.02 44.34 2wrl n GLY 161 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wrl s ILE 162 N -2.00 5.09 0.17 -0.61 -4.36 -0.94 -2.36 121.20 116.19 2wrl s ILE 162 Ca 0.00 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.36 2wrl s ILE 162 Cb 0.00 -4.67 0.04 0.00 1.25 0.00 0.00 42.46 39.08 2wrl s ILE 162 CO 0.00 -1.34 0.21 -1.22 0.24 0.00 0.00 174.94 172.83 2wrl n TYR 163 N 5.49 -3.84 0.00 1.37 4.02 -0.51 -4.68 117.16 119.02 2wrl n TYR 163 Ca 0.21 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 2wrl n TYR 163 Cb 0.48 -0.17 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 2wrl n TYR 163 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2wrl n TYR 164 N -2.41 0.00 -1.25 -0.72 4.02 -1.26 -3.01 117.16 112.52 2wrl n TYR 164 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 2wrl n TYR 164 Cb 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 2wrl n TYR 164 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wrl n ALA 165 N -2.19 0.00 -1.00 -0.72 0.00 -1.26 -3.01 120.51 112.33 2wrl n ALA 165 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wrl n ALA 165 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wrl n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrl n GLY 166 N 0.00 -2.02 3.77 0.00 0.00 -1.26 -5.05 105.19 100.63 2wrl n GLY 166 Ca 0.00 -1.50 -0.25 0.00 0.00 0.00 0.00 46.02 44.26 2wrl n GLY 166 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wrl s GLU 167 N -2.54 2.77 -0.24 1.61 2.02 -1.26 -5.10 118.70 115.96 2wrl s GLU 167 Ca 0.00 -0.99 -0.21 0.00 0.02 0.00 0.00 54.97 53.79 2wrl s GLU 167 Cb 0.00 -2.54 -0.02 0.00 0.10 0.00 0.00 34.13 31.67 2wrl s GLU 167 CO 0.00 0.45 0.66 -1.25 0.02 0.00 0.00 175.26 175.14 2wrl s PRO 168 N -3.27 4.14 0.00 0.39 0.04 -1.26 -5.09 135.00 129.96 2wrl s PRO 168 Ca 0.31 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.96 2wrl s PRO 168 Cb -0.09 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.81 2wrl s PRO 168 CO 0.23 -0.39 0.00 1.55 0.04 0.00 0.00 177.00 178.42 2wrl n VAL 169 N 5.11 0.00 0.00 -0.36 3.14 -1.26 -5.10 118.33 119.86 2wrl n VAL 169 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2wrl n VAL 169 Cb 0.49 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.27 2wrl n VAL 169 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2wrl n ARG 170 N 0.00 0.00 -0.40 1.45 1.74 -1.26 -4.98 116.66 113.20 2wrl n ARG 170 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wrl n ARG 170 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2wrl n ARG 170 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2wrl n LEU 171 N 0.00 -0.68 -4.17 0.55 0.00 -1.26 -4.63 117.00 106.81 2wrl n LEU 171 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 56.01 55.52 2wrl n LEU 171 Cb 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 43.42 43.03 2wrl n LEU 171 CO 0.00 0.00 0.21 0.29 0.00 0.00 0.00 177.39 177.89 2wrl n LYS 172 N 1.49 0.00 0.00 1.96 4.76 -1.26 -4.85 118.16 120.26 2wrl n LYS 172 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wrl n LYS 172 Cb 0.00 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 2wrl n LYS 172 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2wrl n PRO 173 N 1.13 0.00 0.00 1.97 -0.04 -1.26 -4.48 135.00 132.32 2wrl n PRO 173 Ca 0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 2wrl n PRO 173 Cb 0.17 -0.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.60 2wrl n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wrl n GLY 174 N 2.81 -0.08 3.57 0.55 0.00 -1.26 -4.33 105.19 106.45 2wrl n GLY 174 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2wrl n GLY 174 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wrl s LYS 175 N -1.79 3.66 0.00 1.61 2.20 -1.26 -4.33 119.74 119.82 2wrl s LYS 175 Ca 0.00 0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.73 2wrl s LYS 175 Cb 0.00 -3.83 0.00 0.00 -1.51 0.00 0.00 37.83 32.49 2wrl s LYS 175 CO 0.00 -0.83 0.00 0.00 -0.36 0.00 0.00 175.35 174.16 2wrl n ALA 176 N 6.27 0.00 0.00 3.13 0.00 -1.26 -4.95 120.51 123.70 2wrl n ALA 176 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2wrl n ALA 176 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2wrl n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrl n GLY 177 N 0.00 1.72 0.00 0.00 0.00 -1.26 -5.24 105.19 100.40 2wrl n GLY 177 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2wrl n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32