#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cw5 s PRO 3 N 0.00 2.95 -0.15 5.56 0.04 -1.26 -4.59 135.00 137.55 2cw5 s PRO 3 Ca 0.00 1.16 -0.00 0.00 0.04 0.00 0.00 61.00 62.20 2cw5 s PRO 3 Cb 0.00 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2cw5 s PRO 3 CO 0.00 -1.10 -0.13 0.08 0.04 0.00 0.00 177.00 175.88 2cw5 s VAL 4 N -2.67 2.91 -0.22 -0.36 1.01 0.21 -1.41 120.40 119.87 2cw5 s VAL 4 Ca 0.62 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 2cw5 s VAL 4 Cb -0.16 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2cw5 s VAL 4 CO 0.46 0.51 -0.00 -0.31 0.00 0.00 0.00 175.10 175.76 2cw5 s TYR 5 N 0.64 3.01 -0.20 5.22 2.02 -0.15 -0.52 117.35 127.37 2cw5 s TYR 5 Ca -0.07 -0.66 -0.04 0.00 -0.37 0.00 0.00 57.07 55.94 2cw5 s TYR 5 Cb -0.16 -2.13 -0.02 0.00 -0.40 0.00 0.00 41.96 39.26 2cw5 s TYR 5 CO 0.03 -0.40 -0.04 0.12 -1.57 0.00 0.00 175.55 173.68 2cw5 s PHE 6 N 1.34 2.96 0.04 2.71 5.36 0.42 -0.77 117.98 130.04 2cw5 s PHE 6 Ca 0.04 -0.71 0.06 0.00 -0.96 0.00 0.00 56.93 55.37 2cw5 s PHE 6 Cb -0.15 -2.05 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 2cw5 s PHE 6 CO 0.00 -0.37 -0.18 -1.17 -1.46 0.00 0.00 175.22 172.05 2cw5 s LEU 7 N 1.08 2.16 0.18 6.12 0.20 0.32 0.31 118.68 129.05 2cw5 s LEU 7 Ca 0.01 -0.48 -0.23 0.00 0.69 0.00 0.00 54.13 54.13 2cw5 s LEU 7 Cb -0.15 -0.82 0.07 0.00 -0.43 0.00 0.00 46.19 44.87 2cw5 s LEU 7 CO 0.00 0.11 1.02 -0.94 -0.29 0.00 0.00 176.35 176.26 2cw5 s SER 8 N -1.11 -0.03 -0.09 3.68 1.04 -0.42 -0.41 113.70 116.37 2cw5 s SER 8 Ca 0.05 -0.63 0.13 0.00 0.48 0.00 0.00 55.95 55.98 2cw5 s SER 8 Cb -0.08 0.50 0.20 0.00 0.10 0.00 0.00 66.02 66.74 2cw5 s SER 8 CO 0.01 -0.98 1.11 -0.90 0.98 0.00 0.00 173.24 173.46 2cw5 n ASP 9 N -1.09 2.27 0.13 7.02 5.75 -1.24 -3.70 116.55 125.69 2cw5 n ASP 9 Ca -0.04 -2.74 0.01 0.00 -0.01 0.00 0.00 54.79 52.01 2cw5 n ASP 9 Cb 0.60 -0.29 0.11 0.00 -1.03 0.00 0.00 41.12 40.50 2cw5 n ASP 9 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 2cw5 h PHE 10 N 0.04 0.00 0.00 2.11 0.04 -1.83 -3.42 116.94 113.89 2cw5 h PHE 10 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2cw5 h PHE 10 Cb 0.85 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.00 2cw5 h PHE 10 CO 0.01 0.60 0.00 0.41 -0.60 0.00 0.00 178.31 178.73 2cw5 n GLY 11 N 0.80 1.74 0.29 -1.45 0.00 0.15 -4.39 105.19 102.32 2cw5 n GLY 11 Ca 0.00 -1.62 0.11 0.00 0.00 0.00 0.00 46.02 44.51 2cw5 n GLY 11 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cw5 h LEU 12 N 0.00 0.01 0.00 0.99 3.38 -1.97 -2.28 115.31 115.44 2cw5 h LEU 12 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cw5 h LEU 12 Cb 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2cw5 h LEU 12 CO 0.00 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.92 2cw5 n GLU 13 N -4.50 0.50 -2.58 1.13 1.02 -1.26 -4.81 120.64 110.14 2cw5 n GLU 13 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 2cw5 n GLU 13 Cb 0.22 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.11 2cw5 n GLU 13 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2cw5 s ASP 14 N -2.50 7.26 0.66 1.62 -1.08 -0.86 -4.91 116.67 116.86 2cw5 s ASP 14 Ca 0.31 1.85 0.42 0.00 -0.52 0.00 0.00 52.55 54.61 2cw5 s ASP 14 Cb 0.20 -2.58 2.29 0.00 -1.46 0.00 0.00 42.92 41.38 2cw5 s ASP 14 CO 0.45 -0.32 2.32 1.55 0.52 0.00 0.00 175.17 179.69 2cw5 h PRO 15 N 6.53 0.00 -0.91 4.34 0.13 -1.90 -1.47 132.00 138.72 2cw5 h PRO 15 Ca -0.42 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.73 2cw5 h PRO 15 Cb 1.22 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 2cw5 h PRO 15 CO 0.77 0.00 0.60 -0.92 -0.23 0.00 0.00 178.00 178.22 2cw5 h TYR 16 N 0.00 1.14 -0.70 1.56 3.20 -1.94 0.15 116.97 120.38 2cw5 h TYR 16 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2cw5 h TYR 16 Cb 0.06 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 37.91 2cw5 h TYR 16 CO 0.00 0.70 0.36 0.28 -1.64 0.00 0.00 178.16 177.87 2cw5 h VAL 17 N 1.21 1.22 -0.48 1.81 2.07 -1.58 -0.75 116.25 119.76 2cw5 h VAL 17 Ca 0.34 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 67.15 2cw5 h VAL 17 Cb -0.10 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2cw5 h VAL 17 CO -0.08 0.25 -0.16 0.00 0.02 0.00 0.00 177.57 177.60 2cw5 h ALA 18 N 1.18 0.80 -0.15 1.67 0.00 -1.34 -2.26 119.26 119.16 2cw5 h ALA 18 Ca 0.24 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2cw5 h ALA 18 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2cw5 h ALA 18 CO -0.04 0.66 0.09 0.28 0.00 0.00 0.00 179.25 180.24 2cw5 h VAL 19 N 0.82 1.09 -0.40 0.00 2.07 -0.29 0.16 116.25 119.72 2cw5 h VAL 19 Ca 0.12 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.43 2cw5 h VAL 19 Cb 0.71 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 2cw5 h VAL 19 CO 0.05 0.09 0.13 0.58 0.02 0.00 0.00 177.57 178.45 2cw5 h VAL 20 N 0.15 0.87 -0.53 2.57 2.07 -1.05 0.17 116.25 120.51 2cw5 h VAL 20 Ca 0.05 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2cw5 h VAL 20 Cb 0.07 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2cw5 h VAL 20 CO -0.01 0.05 0.30 0.11 0.02 0.00 0.00 177.57 178.04 2cw5 h LYS 21 N 0.29 0.71 -0.33 1.57 1.57 -1.08 -0.24 116.57 119.07 2cw5 h LYS 21 Ca 0.18 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.76 2cw5 h LYS 21 Cb 0.17 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2cw5 h LYS 21 CO -0.19 0.52 -0.33 0.00 -0.57 0.00 0.00 179.45 178.88 2cw5 h ALA 22 N 1.60 0.48 -0.61 3.86 0.00 0.21 -1.54 119.26 123.27 2cw5 h ALA 22 Ca 0.19 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2cw5 h ALA 22 Cb 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2cw5 h ALA 22 CO -0.03 0.54 0.23 0.28 0.00 0.00 0.00 179.25 180.27 2cw5 h VAL 23 N 0.58 1.23 0.00 0.00 2.07 -0.13 -2.08 116.25 117.93 2cw5 h VAL 23 Ca 0.05 -0.74 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 2cw5 h VAL 23 Cb 0.91 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2cw5 h VAL 23 CO 0.08 0.29 -0.26 -0.07 0.02 0.00 0.00 177.57 177.63 2cw5 h LEU 24 N 0.85 0.00 -1.76 2.57 3.38 -0.98 -2.52 115.31 116.84 2cw5 h LEU 24 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2cw5 h LEU 24 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2cw5 h LEU 24 CO -0.01 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.78 2cw5 n ALA 25 N -2.33 2.45 -1.22 1.53 0.00 -0.59 -4.40 120.51 115.95 2cw5 n ALA 25 Ca -0.01 -0.80 -0.38 0.00 0.00 0.00 0.00 53.44 52.24 2cw5 n ALA 25 Cb 0.37 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 2cw5 n ALA 25 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2cw5 n GLU 26 N 0.93 2.13 -3.43 0.00 2.13 -0.82 -4.99 120.64 116.60 2cw5 n GLU 26 Ca 0.18 -1.98 -0.38 0.00 0.66 0.00 0.00 57.16 55.63 2cw5 n GLU 26 Cb 0.45 -2.91 -0.06 0.00 0.27 0.00 0.00 31.44 29.20 2cw5 n GLU 26 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2cw5 s ALA 28 N 4.01 3.66 0.31 4.31 0.00 -1.26 -5.09 121.76 127.70 2cw5 s ALA 28 Ca 0.52 -0.14 -0.25 0.00 0.00 0.00 0.00 51.96 52.09 2cw5 s ALA 28 Cb 0.14 -2.46 -0.10 0.00 0.00 0.00 0.00 23.12 20.70 2cw5 s ALA 28 CO 0.02 0.46 0.90 -1.25 0.00 0.00 0.00 175.76 175.89 2cw5 s PRO 29 N -1.20 4.50 0.30 0.00 0.04 -1.26 -5.20 135.00 132.18 2cw5 s PRO 29 Ca 0.27 1.22 0.03 0.00 0.04 0.00 0.00 61.00 62.57 2cw5 s PRO 29 Cb -0.17 -2.79 -0.06 0.00 0.04 0.00 0.00 34.50 31.52 2cw5 s PRO 29 CO 0.16 0.29 0.05 0.20 0.04 0.00 0.00 177.00 177.74 2cw5 s GLY 30 N -1.65 1.92 0.46 0.56 0.00 -1.26 -5.12 107.32 102.23 2cw5 s GLY 30 Ca 0.49 -1.97 -0.21 0.00 0.00 0.00 0.00 44.72 43.03 2cw5 s GLY 30 CO 0.23 -1.76 1.02 2.56 0.00 0.00 0.00 173.10 175.15 2cw5 s PRO 31 N -3.90 3.96 0.19 2.90 0.04 -1.26 -5.01 135.00 131.91 2cw5 s PRO 31 Ca 0.35 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.42 2cw5 s PRO 31 Cb 0.08 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 2cw5 s PRO 31 CO 0.14 -0.29 1.18 0.00 0.04 0.00 0.00 177.00 178.06 2cw5 s ALA 32 N -1.97 3.42 -0.21 8.56 0.00 -1.26 -4.85 121.76 125.45 2cw5 s ALA 32 Ca 0.65 0.93 -0.00 0.00 0.00 0.00 0.00 51.96 53.53 2cw5 s ALA 32 Cb -0.16 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.59 2cw5 s ALA 32 CO 0.19 -0.34 -0.13 0.08 0.00 0.00 0.00 175.76 175.57 2cw5 s VAL 33 N -0.13 2.49 -0.14 0.00 1.01 -1.26 -0.62 120.40 121.76 2cw5 s VAL 33 Ca 0.52 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.53 2cw5 s VAL 33 Cb -0.32 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 2cw5 s VAL 33 CO 0.37 0.37 -0.14 -0.69 0.00 0.00 0.00 175.10 175.01 2cw5 s VAL 34 N 1.31 2.94 -0.08 2.92 1.01 0.32 -5.00 120.40 123.83 2cw5 s VAL 34 Ca 0.02 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 2cw5 s VAL 34 Cb -0.15 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 2cw5 s VAL 34 CO -0.08 0.52 0.95 -1.81 0.00 0.00 0.00 175.10 174.68 2cw5 s ASP 35 N 0.47 7.23 -0.10 3.32 1.01 -1.26 -0.44 116.67 126.90 2cw5 s ASP 35 Ca -0.10 1.50 -0.24 0.00 0.71 0.00 0.00 52.55 54.43 2cw5 s ASP 35 Cb -0.16 -2.54 -0.21 0.00 1.01 0.00 0.00 42.92 41.03 2cw5 s ASP 35 CO 0.05 -0.36 0.77 -0.07 0.21 0.00 0.00 175.17 175.77 2cw5 h LEU 36 N 7.56 -0.03 0.00 1.23 3.38 -0.48 -3.46 115.31 123.51 2cw5 h LEU 36 Ca -0.35 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 56.91 2cw5 h LEU 36 Cb 1.17 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2cw5 h LEU 36 CO 0.81 0.77 0.00 0.00 0.09 0.00 0.00 178.44 180.11 2cw5 n ALA 37 N -2.58 0.00 -0.17 1.53 0.00 -1.22 -5.03 120.51 113.04 2cw5 n ALA 37 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2cw5 n ALA 37 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2cw5 n ALA 37 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2cw5 n HIS 38 N -0.05 0.00 -1.12 0.00 8.25 -1.24 -1.30 115.22 119.76 2cw5 n HIS 38 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 2cw5 n HIS 38 Cb 0.00 0.00 0.27 0.00 1.12 0.00 0.00 29.99 31.38 2cw5 n HIS 38 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cw5 n ALA 39 N -0.34 4.85 -1.74 -1.41 0.00 -1.25 0.29 120.51 120.90 2cw5 n ALA 39 Ca 0.00 -2.55 -0.36 0.00 0.00 0.00 0.00 53.44 50.53 2cw5 n ALA 39 Cb 0.04 -1.27 0.05 0.00 0.00 0.00 0.00 19.45 18.27 2cw5 n ALA 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2cw5 s LEU 40 N -3.10 3.64 0.18 0.00 1.43 -1.24 -4.86 118.68 114.73 2cw5 s LEU 40 Ca 0.55 2.49 -0.33 0.00 -1.03 0.00 0.00 54.13 55.81 2cw5 s LEU 40 Cb 0.45 -4.60 -0.14 0.00 0.03 0.00 0.00 46.19 41.93 2cw5 s LEU 40 CO 0.12 -1.75 1.46 -2.65 0.23 0.00 0.00 176.35 173.75 2cw5 n PRO 41 N -1.70 1.93 -1.61 1.29 -0.02 -1.26 -4.64 135.00 128.99 2cw5 n PRO 41 Ca 0.14 0.69 -0.53 0.00 -2.02 0.00 0.00 63.50 61.79 2cw5 n PRO 41 Cb 0.49 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.53 2cw5 n PRO 41 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2cw5 n PRO 42 N 2.65 1.21 -1.22 0.52 -0.02 -1.26 -1.96 135.00 134.92 2cw5 n PRO 42 Ca 0.15 0.44 -0.07 0.00 -2.02 0.00 0.00 63.50 61.99 2cw5 n PRO 42 Cb 0.28 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 2cw5 n PRO 42 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2cw5 n GLN 43 N 3.08 -1.63 -2.85 -0.52 1.13 -1.26 -4.94 117.38 110.38 2cw5 n GLN 43 Ca 0.20 0.73 -0.43 0.00 -1.94 0.00 0.00 57.00 55.56 2cw5 n GLN 43 Cb 0.19 -5.08 -0.02 0.00 0.11 0.00 0.00 30.24 25.44 2cw5 n GLN 43 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2cw5 s ASP 44 N -2.31 6.68 0.35 1.08 -1.08 -0.83 -4.84 116.67 115.72 2cw5 s ASP 44 Ca 0.00 -2.11 0.05 0.00 -0.52 0.00 0.00 52.55 49.98 2cw5 s ASP 44 Cb 0.00 -2.44 0.65 0.00 -1.46 0.00 0.00 42.92 39.67 2cw5 s ASP 44 CO 0.00 -1.09 1.90 -0.07 0.52 0.00 0.00 175.17 176.42 2cw5 h LEU 45 N 10.80 0.45 -0.27 -1.34 3.38 -1.92 -2.24 115.31 124.17 2cw5 h LEU 45 Ca 0.20 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2cw5 h LEU 45 Cb 0.99 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2cw5 h LEU 45 CO 1.20 0.52 -0.04 0.03 0.09 0.00 0.00 178.44 180.24 2cw5 h ARG 46 N 0.47 0.49 -0.61 1.13 3.08 -1.90 0.11 114.38 117.16 2cw5 h ARG 46 Ca 0.10 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 2cw5 h ARG 46 Cb 0.30 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 2cw5 h ARG 46 CO 0.01 0.69 0.31 -0.09 -1.07 0.00 0.00 179.97 179.81 2cw5 h ARG 47 N 0.26 0.86 -0.34 0.04 9.65 -1.83 -1.37 114.38 121.66 2cw5 h ARG 47 Ca 0.07 -0.12 -0.07 0.00 -1.10 0.00 0.00 59.98 58.77 2cw5 h ARG 47 Cb 0.49 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2cw5 h ARG 47 CO 0.02 0.68 -0.04 0.00 2.80 0.00 0.00 179.97 183.42 2cw5 h ALA 48 N 1.14 0.46 -0.82 2.80 0.00 -1.31 -1.77 119.26 119.75 2cw5 h ALA 48 Ca 0.21 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2cw5 h ALA 48 Cb 0.09 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 2cw5 h ALA 48 CO -0.03 0.26 0.50 0.00 0.00 0.00 0.00 179.25 179.99 2cw5 h ALA 49 N 0.83 1.13 -0.48 0.00 0.00 -0.54 -1.89 119.26 118.31 2cw5 h ALA 49 Ca 0.09 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2cw5 h ALA 49 Cb 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2cw5 h ALA 49 CO 0.03 0.23 -0.08 -0.92 0.00 0.00 0.00 179.25 178.51 2cw5 h TYR 50 N 0.91 1.01 -0.84 0.00 3.20 -1.07 -1.90 116.97 118.29 2cw5 h TYR 50 Ca 0.36 -0.21 0.08 0.00 3.14 0.00 0.00 58.73 62.11 2cw5 h TYR 50 Cb 0.18 -0.25 -0.07 0.00 1.54 0.00 0.00 36.73 38.13 2cw5 h TYR 50 CO -0.04 0.97 0.50 0.00 -1.64 0.00 0.00 178.16 177.95 2cw5 h ALA 51 N 0.90 1.18 -0.54 1.82 0.00 -0.60 0.23 119.26 122.25 2cw5 h ALA 51 Ca 0.13 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2cw5 h ALA 51 Cb 0.62 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2cw5 h ALA 51 CO 0.04 0.18 0.10 -0.07 0.00 0.00 0.00 179.25 179.50 2cw5 h LEU 52 N 0.87 0.84 -0.61 0.00 3.38 -1.14 -2.26 115.31 116.39 2cw5 h LEU 52 Ca 0.39 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 58.12 2cw5 h LEU 52 Cb 0.28 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2cw5 h LEU 52 CO -0.21 0.87 0.40 0.15 0.09 0.00 0.00 178.44 179.74 2cw5 h PHE 53 N 0.77 0.75 -0.66 1.13 3.57 -0.33 -0.49 116.94 121.67 2cw5 h PHE 53 Ca 0.17 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.70 2cw5 h PHE 53 Cb 0.38 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 2cw5 h PHE 53 CO 0.03 0.46 0.43 0.93 -2.23 0.00 0.00 178.31 177.93 2cw5 h GLU 54 N 0.80 0.84 0.14 1.11 5.08 -0.34 -3.31 114.58 118.90 2cw5 h GLU 54 Ca 0.23 -0.05 -0.32 0.00 -1.00 0.00 0.00 59.36 58.22 2cw5 h GLU 54 Cb -0.06 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 28.99 2cw5 h GLU 54 CO -0.06 0.55 -1.62 0.00 -1.00 0.00 0.00 179.01 176.88 2cw5 h ALA 55 N 1.26 0.25 -0.97 3.43 0.00 -1.19 -3.41 119.26 118.63 2cw5 h ALA 55 Ca 0.25 -1.14 0.17 0.00 0.00 0.00 0.00 54.91 54.20 2cw5 h ALA 55 Cb -0.06 0.35 -0.17 0.00 0.00 0.00 0.00 17.79 17.92 2cw5 h ALA 55 CO -0.07 1.12 -0.32 1.25 0.00 0.00 0.00 179.25 181.22 2cw5 h LEU 56 N 0.08 -1.19 -2.21 0.00 5.85 -1.17 -0.70 115.31 115.97 2cw5 h LEU 56 Ca -0.28 0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2cw5 h LEU 56 Cb 2.04 0.68 -0.00 0.00 0.37 0.00 0.00 40.66 43.75 2cw5 h LEU 56 CO 0.16 -0.30 0.27 -0.65 -0.34 0.00 0.00 178.44 177.58 2cw5 h PRO 57 N -0.01 0.00 -0.02 5.25 0.11 -1.80 -1.97 132.00 133.56 2cw5 h PRO 57 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 2cw5 h PRO 57 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2cw5 h PRO 57 CO -0.98 0.00 -0.27 0.66 -0.21 0.00 0.00 178.00 177.19 2cw5 n TYR 58 N -3.25 0.00 -2.88 0.65 4.01 -0.28 -4.98 117.16 110.43 2cw5 n TYR 58 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.40 2cw5 n TYR 58 Cb 0.35 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.32 2cw5 n TYR 58 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2cw5 s LEU 59 N -2.07 4.10 0.28 7.72 1.43 -0.74 -4.99 118.68 124.42 2cw5 s LEU 59 Ca 0.18 1.64 -0.30 0.00 -1.03 0.00 0.00 54.13 54.63 2cw5 s LEU 59 Cb 0.16 -4.25 -0.13 0.00 0.03 0.00 0.00 46.19 42.00 2cw5 s LEU 59 CO 0.41 -0.23 1.32 -2.65 0.23 0.00 0.00 176.35 175.43 2cw5 n PRO 60 N -0.17 1.99 -1.70 1.29 -0.02 -1.26 -4.86 135.00 130.27 2cw5 n PRO 60 Ca 0.04 0.70 -0.43 0.00 -2.02 0.00 0.00 63.50 61.79 2cw5 n PRO 60 Cb 0.53 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 2cw5 n PRO 60 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2cw5 n GLU 61 N 1.29 2.30 -0.58 -0.52 4.07 -1.26 -1.56 120.64 124.38 2cw5 n GLU 61 Ca 0.09 0.82 0.00 0.00 -0.06 0.00 0.00 57.16 58.00 2cw5 n GLU 61 Cb 0.33 -2.51 0.00 0.00 -0.06 0.00 0.00 31.44 29.20 2cw5 n GLU 61 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cw5 n GLY 62 N 1.97 1.14 3.73 8.31 0.00 -0.20 -5.02 105.19 115.12 2cw5 n GLY 62 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2cw5 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cw5 s ALA 63 N -3.30 2.32 -0.32 4.61 0.00 -0.60 -4.44 121.76 120.02 2cw5 s ALA 63 Ca 0.00 1.19 -0.17 0.00 0.00 0.00 0.00 51.96 52.99 2cw5 s ALA 63 Cb 0.00 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.55 2cw5 s ALA 63 CO 0.00 -1.68 0.44 0.08 0.00 0.00 0.00 175.76 174.60 2cw5 s VAL 64 N -1.45 5.10 -0.48 0.00 1.01 -0.50 -1.15 120.40 122.93 2cw5 s VAL 64 Ca 0.82 0.37 -0.17 0.00 0.00 0.00 0.00 61.98 63.00 2cw5 s VAL 64 Cb -0.37 -3.85 0.06 0.00 0.00 0.00 0.00 36.38 32.21 2cw5 s VAL 64 CO 0.41 -0.07 0.48 -0.69 0.00 0.00 0.00 175.10 175.23 2cw5 s VAL 65 N 2.21 5.09 -0.39 2.92 1.01 0.21 -0.98 120.40 130.47 2cw5 s VAL 65 Ca 0.16 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 2cw5 s VAL 65 Cb -0.16 -4.17 0.01 0.00 0.00 0.00 0.00 36.38 32.06 2cw5 s VAL 65 CO 0.12 -0.63 0.27 -0.22 0.00 0.00 0.00 175.10 174.64 2cw5 s LEU 66 N 2.06 4.89 -0.14 3.92 2.96 0.05 -0.90 118.68 131.52 2cw5 s LEU 66 Ca 0.09 -0.75 -0.00 0.00 -0.22 0.00 0.00 54.13 53.25 2cw5 s LEU 66 Cb -0.21 -2.14 0.03 0.00 0.50 0.00 0.00 46.19 44.36 2cw5 s LEU 66 CO 0.09 -0.38 -0.10 0.00 -1.32 0.00 0.00 176.35 174.64 2cw5 s ALA 67 N 1.69 1.63 -0.52 5.97 0.00 -0.64 -0.52 121.76 129.36 2cw5 s ALA 67 Ca 0.05 -0.78 0.04 0.00 0.00 0.00 0.00 51.96 51.26 2cw5 s ALA 67 Cb -0.18 -1.03 0.14 0.00 0.00 0.00 0.00 23.12 22.05 2cw5 s ALA 67 CO 0.10 -0.47 0.29 0.08 0.00 0.00 0.00 175.76 175.76 2cw5 s VAL 68 N 1.58 2.25 -0.32 0.00 1.01 0.45 -4.14 120.40 121.24 2cw5 s VAL 68 Ca 0.04 -3.24 0.02 0.00 0.00 0.00 0.00 61.98 58.81 2cw5 s VAL 68 Cb -0.13 -2.55 0.09 0.00 0.00 0.00 0.00 36.38 33.79 2cw5 s VAL 68 CO -0.09 -0.87 0.04 -0.69 0.00 0.00 0.00 175.10 173.49 2cw5 s VAL 69 N -0.28 1.87 -0.60 2.92 1.01 -1.26 -3.66 120.40 120.40 2cw5 s VAL 69 Ca 0.19 -1.96 0.06 0.00 0.00 0.00 0.00 61.98 60.27 2cw5 s VAL 69 Cb -0.22 -2.33 0.23 0.00 0.00 0.00 0.00 36.38 34.06 2cw5 s VAL 69 CO -0.03 -0.53 0.63 -0.67 0.00 0.00 0.00 175.10 174.51 2cw5 n ASP 70 N 4.45 2.77 0.15 3.32 2.03 -1.26 -4.83 116.55 123.18 2cw5 n ASP 70 Ca -0.00 -3.21 0.11 0.00 0.52 0.00 0.00 54.79 52.21 2cw5 n ASP 70 Cb 0.42 -0.68 0.55 0.00 -0.72 0.00 0.00 41.12 40.69 2cw5 n ASP 70 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2cw5 n PRO 71 N 1.29 0.16 -0.16 -0.67 -0.04 -1.26 -2.06 135.00 132.26 2cw5 n PRO 71 Ca 0.26 0.55 -0.02 0.00 -0.04 0.00 0.00 63.50 64.25 2cw5 n PRO 71 Cb 0.42 -1.92 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 2cw5 n PRO 71 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cw5 n GLY 72 N -0.73 2.21 3.56 0.55 0.00 -1.26 -4.93 105.19 104.58 2cw5 n GLY 72 Ca 0.00 -0.15 -0.50 0.00 0.00 0.00 0.00 46.02 45.37 2cw5 n GLY 72 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2cw5 n VAL 73 N 0.23 0.84 -3.11 1.61 0.31 -0.88 -1.53 118.33 115.81 2cw5 n VAL 73 Ca 0.07 -0.21 -0.22 0.00 -0.01 0.00 0.00 64.34 63.97 2cw5 n VAL 73 Cb 0.60 -0.70 0.02 0.00 -0.91 0.00 0.00 33.84 32.85 2cw5 n VAL 73 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2cw5 n GLY 74 N 1.99 -0.51 3.27 2.92 0.00 -1.26 -4.98 105.19 106.62 2cw5 n GLY 74 Ca 0.16 0.11 -0.15 0.00 0.00 0.00 0.00 46.02 46.14 2cw5 n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cw5 s THR 75 N -3.06 0.69 -0.34 2.61 -4.23 -0.58 -5.10 115.64 105.62 2cw5 s THR 75 Ca 0.32 -1.99 -0.29 0.00 -1.18 0.00 0.00 61.69 58.55 2cw5 s THR 75 Cb -0.15 -2.29 -0.00 0.00 1.34 0.00 0.00 72.50 71.40 2cw5 s THR 75 CO 0.39 -0.33 1.49 0.00 -0.54 0.00 0.00 174.62 175.64 2cw5 s ALA 76 N -3.66 3.11 -0.28 3.99 0.00 -1.26 -4.93 121.76 118.73 2cw5 s ALA 76 Ca 0.28 0.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.09 2cw5 s ALA 76 Cb 0.06 -3.91 0.11 0.00 0.00 0.00 0.00 23.12 19.38 2cw5 s ALA 76 CO 0.07 -2.25 0.88 -0.98 0.00 0.00 0.00 175.76 173.49 2cw5 s ARG 77 N 4.88 0.61 0.52 0.00 1.04 -1.26 -5.14 118.95 119.60 2cw5 s ARG 77 Ca 0.65 0.82 -0.19 0.00 -1.04 0.00 0.00 55.73 55.97 2cw5 s ARG 77 Cb -0.18 0.24 -0.07 0.00 -2.04 0.00 0.00 34.95 32.91 2cw5 s ARG 77 CO 0.31 -0.09 1.05 1.03 -0.04 0.00 0.00 175.30 177.56 2cw5 s ARG 78 N 0.69 3.62 -0.17 3.89 0.52 -1.26 -4.90 118.95 121.34 2cw5 s ARG 78 Ca -0.02 1.34 -0.04 0.00 -0.52 0.00 0.00 55.73 56.49 2cw5 s ARG 78 Cb -0.05 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.33 2cw5 s ARG 78 CO -0.08 -0.58 -0.03 0.00 0.02 0.00 0.00 175.30 174.64 2cw5 s ALA 79 N -2.09 3.02 0.16 2.13 0.00 -1.26 -0.56 121.76 123.16 2cw5 s ALA 79 Ca 0.67 -0.85 -0.00 0.00 0.00 0.00 0.00 51.96 51.77 2cw5 s ALA 79 Cb -0.17 -1.62 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2cw5 s ALA 79 CO 0.25 0.13 0.06 0.14 0.00 0.00 0.00 175.76 176.34 2cw5 s VAL 80 N 0.50 0.27 -0.03 0.00 -7.23 -0.53 -0.46 120.40 112.93 2cw5 s VAL 80 Ca -0.03 -1.95 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 2cw5 s VAL 80 Cb -0.14 -2.19 -0.00 0.00 0.56 0.00 0.00 36.38 34.60 2cw5 s VAL 80 CO 0.03 -0.35 -0.15 0.00 -0.31 0.00 0.00 175.10 174.32 2cw5 s ALA 81 N -3.94 1.32 -0.02 1.32 0.00 -0.43 -1.61 121.76 118.40 2cw5 s ALA 81 Ca 0.28 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 51.68 2cw5 s ALA 81 Cb 0.07 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 2cw5 s ALA 81 CO 0.05 0.25 -0.16 0.00 0.00 0.00 0.00 175.76 175.91 2cw5 s ALA 82 N -0.01 1.31 -0.15 0.00 0.00 0.58 -0.45 121.76 123.05 2cw5 s ALA 82 Ca -0.02 -0.66 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 2cw5 s ALA 82 Cb -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 2cw5 s ALA 82 CO 0.01 0.30 -0.14 -0.51 0.00 0.00 0.00 175.76 175.43 2cw5 s LEU 83 N -0.26 2.61 0.00 0.00 1.43 0.59 -0.51 118.68 122.54 2cw5 s LEU 83 Ca 0.04 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2cw5 s LEU 83 Cb -0.07 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.55 2cw5 s LEU 83 CO -0.00 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.30 2cw5 n GLY 84 N 3.87 5.06 0.19 -3.19 0.00 -1.26 0.25 105.19 110.12 2cw5 n GLY 84 Ca -0.19 -0.70 0.02 0.00 0.00 0.00 0.00 46.02 45.16 2cw5 n GLY 84 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2cw5 h ARG 85 N 0.00 0.05 -5.67 1.61 2.43 -1.88 -3.43 114.38 107.49 2cw5 h ARG 85 Ca 0.00 -0.02 -0.63 0.00 -0.81 0.00 0.00 59.98 58.52 2cw5 h ARG 85 Cb 0.00 -0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 29.42 2cw5 h ARG 85 CO 0.00 0.39 -0.60 -1.58 -1.51 0.00 0.00 179.97 176.66 2cw5 s TRP 86 N -4.26 2.52 -0.02 2.20 0.51 -1.26 -1.03 118.94 117.59 2cw5 s TRP 86 Ca -0.03 -0.66 0.05 0.00 -2.12 0.00 0.00 56.10 53.34 2cw5 s TRP 86 Cb 0.14 -1.77 -0.03 0.00 -0.81 0.00 0.00 33.47 31.01 2cw5 s TRP 86 CO 0.73 0.45 -0.17 0.99 -0.51 0.00 0.00 176.95 178.44 2cw5 s THR 87 N -2.70 2.82 -0.04 2.01 2.01 -0.30 -4.63 115.64 114.81 2cw5 s THR 87 Ca 0.35 -0.91 0.05 0.00 0.31 0.00 0.00 61.69 61.49 2cw5 s THR 87 Cb 0.10 -2.11 -0.01 0.00 0.01 0.00 0.00 72.50 70.49 2cw5 s THR 87 CO 0.18 0.52 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.14 2cw5 s TYR 88 N -0.76 1.82 -0.11 4.92 2.02 0.34 0.65 117.35 126.21 2cw5 s TYR 88 Ca 0.12 -0.49 -0.01 0.00 -0.37 0.00 0.00 57.07 56.32 2cw5 s TYR 88 Cb -0.10 -1.21 0.03 0.00 -0.40 0.00 0.00 41.96 40.28 2cw5 s TYR 88 CO 0.02 -0.15 -0.03 0.08 -1.57 0.00 0.00 175.55 173.90 2cw5 s VAL 89 N -0.08 0.72 -0.67 0.71 1.01 -0.08 -0.31 120.40 121.71 2cw5 s VAL 89 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.75 2cw5 s VAL 89 Cb -0.11 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.39 2cw5 s VAL 89 CO 0.02 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2cw5 n GLY 90 N 5.03 -1.30 3.77 4.51 0.00 -0.64 -1.63 105.19 114.93 2cw5 n GLY 90 Ca -0.10 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.58 2cw5 n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cw5 s PRO 91 N -1.31 3.71 -1.33 1.61 0.04 -1.26 -1.45 135.00 135.00 2cw5 s PRO 91 Ca 0.00 1.77 -0.09 0.00 0.04 0.00 0.00 61.00 62.72 2cw5 s PRO 91 Cb 0.00 -2.37 0.12 0.00 0.04 0.00 0.00 34.50 32.29 2cw5 s PRO 91 CO 0.00 -0.59 2.11 -3.47 0.04 0.00 0.00 177.00 175.08 2cw5 n ASP 92 N -0.57 5.84 -0.09 6.66 2.03 0.27 -4.43 116.55 126.26 2cw5 n ASP 92 Ca 0.08 -3.05 0.04 0.00 0.52 0.00 0.00 54.79 52.37 2cw5 n ASP 92 Cb 0.48 -1.48 0.05 0.00 -0.72 0.00 0.00 41.12 39.46 2cw5 n ASP 92 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2cw5 n ASN 93 N 3.63 1.65 0.00 1.67 0.23 -1.26 -4.59 115.26 116.58 2cw5 n ASN 93 Ca 0.49 -2.30 0.00 0.00 -0.53 0.00 0.00 54.58 52.24 2cw5 n ASN 93 Cb 0.33 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.84 2cw5 n ASN 93 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2cw5 n GLY 94 N -0.74 0.78 0.37 4.83 0.00 -1.23 -4.76 105.19 104.44 2cw5 n GLY 94 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 2cw5 n GLY 94 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cw5 h LEU 95 N 0.00 0.71 -1.12 0.99 5.85 -1.86 -0.99 115.31 118.89 2cw5 h LEU 95 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2cw5 h LEU 95 Cb 0.00 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2cw5 h LEU 95 CO 0.00 0.29 0.00 0.49 -0.34 0.00 0.00 178.44 178.88 2cw5 n PHE 96 N -4.67 0.39 -0.18 1.25 3.72 -1.26 -4.02 117.46 112.69 2cw5 n PHE 96 Ca 0.21 -0.19 -0.05 0.00 -0.05 0.00 0.00 57.45 57.37 2cw5 n PHE 96 Cb 0.57 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.11 2cw5 n PHE 96 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 2cw5 h THR 97 N 1.84 0.21 -0.11 4.37 2.02 -1.48 0.25 112.91 120.01 2cw5 h THR 97 Ca 0.00 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.03 2cw5 h THR 97 Cb 0.42 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2cw5 h THR 97 CO 0.00 0.00 -0.58 -0.07 0.37 0.00 0.00 175.52 175.24 2cw5 h LEU 98 N -0.17 0.40 -0.87 2.58 3.38 -1.82 -2.87 115.31 115.93 2cw5 h LEU 98 Ca 0.22 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2cw5 h LEU 98 Cb 0.54 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2cw5 h LEU 98 CO -0.64 0.89 0.13 0.00 0.09 0.00 0.00 178.44 178.92 2cw5 h ALA 99 N 1.12 1.08 0.00 1.53 0.00 -1.63 -2.17 119.26 119.19 2cw5 h ALA 99 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2cw5 h ALA 99 Cb 1.09 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2cw5 h ALA 99 CO 0.10 0.61 0.00 0.91 0.00 0.00 0.00 179.25 180.86 2cw5 n TRP 100 N -4.24 0.69 0.05 0.00 8.01 0.01 -0.51 117.44 121.44 2cw5 n TRP 100 Ca 0.04 0.26 -0.13 0.00 -1.31 0.00 0.00 57.50 56.35 2cw5 n TRP 100 Cb 0.25 -0.91 -0.03 0.00 -2.01 0.00 0.00 31.31 28.61 2cw5 n TRP 100 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 2cw5 h LEU 101 N 0.00 0.59 0.11 -0.99 3.38 -1.18 -2.18 115.31 115.04 2cw5 h LEU 101 Ca 0.00 -0.44 -0.26 0.00 0.09 0.00 0.00 57.88 57.26 2cw5 h LEU 101 Cb 0.41 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2cw5 h LEU 101 CO 0.00 1.23 -1.20 -0.07 0.09 0.00 0.00 178.44 178.49 2cw5 h LEU 102 N 0.29 0.36 -6.54 1.67 3.38 -1.28 -3.41 115.31 109.78 2cw5 h LEU 102 Ca -0.07 -0.39 -0.59 0.00 0.09 0.00 0.00 57.88 56.92 2cw5 h LEU 102 Cb 1.50 -0.12 -0.39 0.00 0.09 0.00 0.00 40.66 41.74 2cw5 h LEU 102 CO 0.16 1.30 -0.89 -0.62 0.09 0.00 0.00 178.44 178.48 2cw5 s ASP 103 N -7.09 2.25 -0.04 -0.43 2.15 0.33 -5.08 116.67 108.77 2cw5 s ASP 103 Ca -0.03 -3.00 -0.32 0.00 0.43 0.00 0.00 52.55 49.63 2cw5 s ASP 103 Cb 0.07 -0.62 -0.10 0.00 -0.30 0.00 0.00 42.92 41.97 2cw5 s ASP 103 CO 0.87 -0.19 1.94 -2.65 -0.17 0.00 0.00 175.17 174.98 2cw5 n PRO 104 N 2.97 2.48 -1.72 4.34 -0.02 -0.82 -4.36 135.00 137.87 2cw5 n PRO 104 Ca 0.24 0.90 -0.42 0.00 -2.02 0.00 0.00 63.50 62.20 2cw5 n PRO 104 Cb 0.44 -2.83 -0.01 0.00 -0.02 0.00 0.00 33.50 31.08 2cw5 n PRO 104 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2cw5 n PRO 105 N 7.17 2.26 -0.06 0.52 -0.02 -1.26 -4.80 135.00 138.82 2cw5 n PRO 105 Ca 0.22 0.80 -0.12 0.00 -2.02 0.00 0.00 63.50 62.37 2cw5 n PRO 105 Cb 0.35 -2.42 -0.14 0.00 -0.02 0.00 0.00 33.50 31.27 2cw5 n PRO 105 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2cw5 n ARG 106 N 0.67 0.67 -3.97 -0.52 1.74 0.14 -4.95 116.66 110.45 2cw5 n ARG 106 Ca 0.04 0.16 -0.09 0.00 -0.77 0.00 0.00 57.85 57.20 2cw5 n ARG 106 Cb 0.36 -1.65 -0.10 0.00 -1.02 0.00 0.00 32.46 30.06 2cw5 n ARG 106 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2cw5 s ARG 107 N -2.54 0.56 0.01 5.56 0.52 -1.04 -4.87 118.95 117.15 2cw5 s ARG 107 Ca -0.13 -0.84 -0.01 0.00 -0.52 0.00 0.00 55.73 54.23 2cw5 s ARG 107 Cb 0.07 0.21 -0.01 0.00 0.52 0.00 0.00 34.95 35.74 2cw5 s ARG 107 CO 0.79 -0.13 0.00 0.00 0.02 0.00 0.00 175.30 175.99 2cw5 s ALA 108 N -2.75 0.02 0.01 2.13 0.00 -1.25 -0.30 121.76 119.62 2cw5 s ALA 108 Ca -0.04 -0.37 0.01 0.00 0.00 0.00 0.00 51.96 51.56 2cw5 s ALA 108 Cb -0.00 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 2cw5 s ALA 108 CO -0.05 -0.13 -0.04 -0.06 0.00 0.00 0.00 175.76 175.47 2cw5 s PHE 109 N -1.08 0.39 -0.14 0.00 0.08 0.41 -1.01 117.98 116.63 2cw5 s PHE 109 Ca -0.12 -0.23 -0.21 0.00 0.12 0.00 0.00 56.93 56.50 2cw5 s PHE 109 Cb -0.07 -0.25 -0.03 0.00 -0.57 0.00 0.00 43.02 42.10 2cw5 s PHE 109 CO -0.00 -0.05 0.61 -1.17 -0.10 0.00 0.00 175.22 174.51 2cw5 s LEU 110 N -0.62 4.23 -0.55 -0.37 0.20 -0.14 -1.31 118.68 120.12 2cw5 s LEU 110 Ca -0.04 0.93 -0.26 0.00 0.69 0.00 0.00 54.13 55.46 2cw5 s LEU 110 Cb -0.05 -2.90 0.04 0.00 -0.43 0.00 0.00 46.19 42.85 2cw5 s LEU 110 CO -0.00 -0.16 1.03 -0.76 -0.29 0.00 0.00 176.35 176.17 2cw5 s LEU 111 N 1.26 3.86 0.14 -0.68 1.43 0.40 -3.72 118.68 121.37 2cw5 s LEU 111 Ca 0.31 -0.15 -0.26 0.00 -1.03 0.00 0.00 54.13 53.00 2cw5 s LEU 111 Cb -0.16 -2.98 -0.07 0.00 0.03 0.00 0.00 46.19 43.01 2cw5 s LEU 111 CO 0.13 -1.30 0.80 -1.61 0.23 0.00 0.00 176.35 174.59 2cw5 s GLU 112 N 4.29 4.58 0.62 1.70 2.02 -1.16 -4.68 118.70 126.07 2cw5 s GLU 112 Ca 0.35 1.18 -0.17 0.00 0.02 0.00 0.00 54.97 56.36 2cw5 s GLU 112 Cb -0.11 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.81 2cw5 s GLU 112 CO 0.22 0.48 1.12 -1.25 0.02 0.00 0.00 175.26 175.85 2cw5 s PRO 113 N -0.82 2.97 0.23 0.39 0.04 -1.26 -4.97 135.00 131.58 2cw5 s PRO 113 Ca 0.38 1.49 0.23 0.00 0.04 0.00 0.00 61.00 63.14 2cw5 s PRO 113 Cb -0.23 -1.96 0.93 0.00 0.04 0.00 0.00 34.50 33.28 2cw5 s PRO 113 CO 0.26 -1.13 1.71 -0.35 0.04 0.00 0.00 177.00 177.53 2cw5 n PRO 114 N -2.02 0.19 0.00 0.56 -0.04 -1.26 -5.18 135.00 127.25 2cw5 n PRO 114 Ca 0.11 0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 2cw5 n PRO 114 Cb 0.51 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 2cw5 n PRO 114 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cw5 n GLY 134 N 0.23 1.76 0.00 0.55 0.00 -1.26 -5.23 105.19 101.25 2cw5 n GLY 134 Ca 0.03 -0.71 0.13 0.00 0.00 0.00 0.00 46.02 45.47 2cw5 n GLY 134 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2cw5 n ARG 135 N 0.14 0.29 0.00 1.61 1.85 -1.26 -3.29 116.66 116.00 2cw5 n ARG 135 Ca 0.00 0.04 0.08 0.00 -1.00 0.00 0.00 57.85 56.97 2cw5 n ARG 135 Cb 0.00 -1.50 0.46 0.00 -1.05 0.00 0.00 32.46 30.37 2cw5 n ARG 135 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 2cw5 n ASP 136 N -1.33 0.00 0.03 2.89 5.68 -1.26 -1.99 116.55 120.57 2cw5 n ASP 136 Ca 0.11 -0.68 0.07 0.00 -0.50 0.00 0.00 54.79 53.79 2cw5 n ASP 136 Cb 0.23 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.11 2cw5 n ASP 136 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2cw5 n VAL 137 N -0.92 0.56 0.34 2.12 0.24 -1.21 -4.50 118.33 114.97 2cw5 n VAL 137 Ca 0.12 -0.59 -0.17 0.00 -2.04 0.00 0.00 64.34 61.66 2cw5 n VAL 137 Cb 0.05 -0.30 -0.08 0.00 -1.47 0.00 0.00 33.84 32.04 2cw5 n VAL 137 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 2cw5 h PHE 138 N 0.00 -0.79 -0.19 6.34 0.04 -1.65 -2.66 116.94 118.02 2cw5 h PHE 138 Ca -0.08 -0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.71 2cw5 h PHE 138 Cb 1.23 0.26 -0.04 0.00 2.20 0.00 0.00 35.95 39.60 2cw5 h PHE 138 CO 0.00 -0.46 -0.06 0.00 -0.60 0.00 0.00 178.31 177.19 2cw5 h ALA 139 N -0.69 0.11 -0.99 2.45 0.00 -1.80 -1.00 119.26 117.33 2cw5 h ALA 139 Ca -0.09 0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2cw5 h ALA 139 Cb 0.69 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 2cw5 h ALA 139 CO 0.14 -0.49 0.63 -1.35 0.00 0.00 0.00 179.25 178.19 2cw5 h PRO 140 N -0.03 1.08 -0.44 0.00 0.11 -1.79 -0.78 132.00 130.16 2cw5 h PRO 140 Ca 0.10 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.09 2cw5 h PRO 140 Cb 0.17 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.02 2cw5 h PRO 140 CO -0.21 0.72 0.07 0.00 -0.21 0.00 0.00 178.00 178.36 2cw5 h ALA 141 N 1.47 0.58 -0.41 -0.75 0.00 -1.06 -0.92 119.26 118.18 2cw5 h ALA 141 Ca 0.44 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2cw5 h ALA 141 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2cw5 h ALA 141 CO -0.20 0.31 0.26 0.00 0.00 0.00 0.00 179.25 179.62 2cw5 h ALA 142 N 0.94 0.52 -0.51 0.00 0.00 -0.46 -0.90 119.26 118.86 2cw5 h ALA 142 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2cw5 h ALA 142 Cb 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2cw5 h ALA 142 CO 0.01 -0.00 0.29 0.00 0.00 0.00 0.00 179.25 179.55 2cw5 h ALA 143 N 1.13 0.65 -0.47 0.00 0.00 -1.00 0.93 119.26 120.50 2cw5 h ALA 143 Ca 0.15 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.02 2cw5 h ALA 143 Cb -0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2cw5 h ALA 143 CO -0.03 0.15 0.22 1.25 0.00 0.00 0.00 179.25 180.84 2cw5 h HIS 144 N 0.67 0.41 -0.17 0.00 6.17 -0.80 -1.75 115.15 119.69 2cw5 h HIS 144 Ca 0.18 0.02 -0.17 0.00 0.71 0.00 0.00 60.37 61.11 2cw5 h HIS 144 Cb 0.02 -0.12 -0.00 0.00 2.52 0.00 0.00 27.41 29.83 2cw5 h HIS 144 CO -0.02 0.20 -0.61 -0.07 0.71 0.00 0.00 177.93 178.13 2cw5 h LEU 145 N 0.44 0.65 -1.32 0.26 3.38 -0.87 -2.48 115.31 115.37 2cw5 h LEU 145 Ca 0.21 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2cw5 h LEU 145 Cb 0.13 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2cw5 h LEU 145 CO -0.15 1.11 0.21 0.00 0.09 0.00 0.00 178.44 179.70 2cw5 h ALA 146 N 0.90 1.47 0.00 1.53 0.00 -0.44 -0.78 119.26 121.93 2cw5 h ALA 146 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2cw5 h ALA 146 Cb 1.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2cw5 h ALA 146 CO 0.12 0.42 0.00 1.28 0.00 0.00 0.00 179.25 181.06 2cw5 n LEU 147 N -4.37 0.00 -0.21 0.00 4.77 -0.69 -1.03 117.00 115.46 2cw5 n LEU 147 Ca 0.04 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.32 2cw5 n LEU 147 Cb 0.14 -0.32 -0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2cw5 n LEU 147 CO 0.37 -0.04 -0.02 0.61 -1.33 0.00 0.00 177.39 176.97 2cw5 n GLY 148 N 0.96 0.39 3.85 -0.72 0.00 -0.30 -4.96 105.19 104.41 2cw5 n GLY 148 Ca 0.11 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 2cw5 n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cw5 s LEU 149 N -0.57 3.61 -0.09 0.99 1.43 -0.94 -4.96 118.68 118.15 2cw5 s LEU 149 Ca 0.00 1.53 -0.37 0.00 -1.03 0.00 0.00 54.13 54.26 2cw5 s LEU 149 Cb 0.00 -4.47 -0.15 0.00 0.03 0.00 0.00 46.19 41.60 2cw5 s LEU 149 CO 0.00 -0.59 1.64 -2.65 0.23 0.00 0.00 176.35 174.98 2cw5 n PRO 150 N -1.63 1.48 0.27 1.29 -0.02 -1.26 -4.73 135.00 130.40 2cw5 n PRO 150 Ca 0.06 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.22 2cw5 n PRO 150 Cb 0.54 -2.26 0.82 0.00 -0.02 0.00 0.00 33.50 32.58 2cw5 n PRO 150 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2cw5 h PRO 151 N 6.74 0.00 -0.39 0.52 0.13 -1.95 -1.28 132.00 135.77 2cw5 h PRO 151 Ca -0.47 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.77 2cw5 h PRO 151 Cb 1.31 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 2cw5 h PRO 151 CO 0.90 0.00 0.36 0.93 -0.23 0.00 0.00 178.00 179.96 2cw5 h GLU 152 N 0.00 0.00 0.00 0.86 3.07 -1.88 -0.67 114.58 115.96 2cw5 h GLU 152 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2cw5 h GLU 152 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 2cw5 h GLU 152 CO -0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 2cw5 n GLY 153 N -1.51 -1.14 0.08 -3.84 0.00 -0.48 -3.40 105.19 94.90 2cw5 n GLY 153 Ca 0.07 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2cw5 n GLY 153 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cw5 h LEU 154 N 0.00 0.17 0.00 0.99 3.38 -1.30 -3.50 115.31 115.05 2cw5 h LEU 154 Ca 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2cw5 h LEU 154 Cb 0.30 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2cw5 h LEU 154 CO 0.00 1.15 0.00 0.61 0.09 0.00 0.00 178.44 180.29 2cw5 n GLY 155 N 1.43 -1.20 3.77 0.83 0.00 -1.22 -3.01 105.19 105.78 2cw5 n GLY 155 Ca -0.04 -1.31 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 2cw5 n GLY 155 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cw5 s PRO 156 N -1.99 3.85 0.37 1.61 0.04 -1.24 -4.68 135.00 132.96 2cw5 s PRO 156 Ca 0.00 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 62.72 2cw5 s PRO 156 Cb 0.00 -2.56 -0.10 0.00 0.04 0.00 0.00 34.50 31.88 2cw5 s PRO 156 CO 0.00 -0.52 0.97 -2.00 0.04 0.00 0.00 177.00 175.49 2cw5 s GLU 157 N -2.48 4.38 0.17 4.56 2.12 -1.26 -0.96 118.70 125.22 2cw5 s GLU 157 Ca 0.61 1.29 0.02 0.00 0.36 0.00 0.00 54.97 57.24 2cw5 s GLU 157 Cb -0.32 -2.53 -0.05 0.00 0.26 0.00 0.00 34.13 31.49 2cw5 s GLU 157 CO 0.40 0.09 -0.00 0.14 -0.54 0.00 0.00 175.26 175.35 2cw5 s VAL 158 N -1.82 0.66 0.41 3.70 -7.23 -0.18 -4.88 120.40 111.06 2cw5 s VAL 158 Ca 0.56 -1.98 -0.26 0.00 -1.81 0.00 0.00 61.98 58.50 2cw5 s VAL 158 Cb -0.16 -2.09 -0.08 0.00 0.56 0.00 0.00 36.38 34.60 2cw5 s VAL 158 CO 0.21 -0.50 1.26 -2.84 -0.31 0.00 0.00 175.10 172.93 2cw5 s PRO 159 N -3.91 3.96 0.23 4.82 0.02 -1.26 -3.89 135.00 134.97 2cw5 s PRO 159 Ca 0.23 2.06 0.05 0.00 0.02 0.00 0.00 61.00 63.36 2cw5 s PRO 159 Cb 0.06 -2.72 0.23 0.00 0.02 0.00 0.00 34.50 32.09 2cw5 s PRO 159 CO 0.03 -0.47 1.54 -0.39 -0.33 0.00 0.00 177.00 177.39 2cw5 h VAL 160 N 2.39 1.41 0.00 3.83 -1.51 -1.91 -3.08 116.25 117.37 2cw5 h VAL 160 Ca -0.49 -2.09 -0.00 0.00 -1.23 0.00 0.00 66.70 62.89 2cw5 h VAL 160 Cb 1.24 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 32.49 2cw5 h VAL 160 CO 0.62 0.61 -0.02 -0.33 -1.23 0.00 0.00 177.57 177.23 2cw5 h GLU 161 N 0.15 0.00 0.00 5.19 4.39 -1.94 -1.99 114.58 120.37 2cw5 h GLU 161 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2cw5 h GLU 161 Cb 1.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2cw5 h GLU 161 CO 0.10 0.02 0.00 0.25 -1.16 0.00 0.00 179.01 178.21 2cw5 n THR 162 N -3.45 0.42 -1.91 1.13 -2.24 -1.16 -4.85 114.28 102.22 2cw5 n THR 162 Ca -0.03 -0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 2cw5 n THR 162 Cb 0.11 -0.68 -0.02 0.00 -2.10 0.00 0.00 70.33 67.64 2cw5 n THR 162 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2cw5 s LEU 163 N -3.55 4.37 0.38 3.22 1.43 -0.75 -4.95 118.68 118.82 2cw5 s LEU 163 Ca 0.11 2.77 -0.27 0.00 -1.03 0.00 0.00 54.13 55.71 2cw5 s LEU 163 Cb 0.15 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.65 2cw5 s LEU 163 CO 0.48 -0.80 1.25 0.00 0.23 0.00 0.00 176.35 177.52 2cw5 s ALA 164 N 0.21 3.29 0.04 4.21 0.00 -1.26 -5.03 121.76 123.21 2cw5 s ALA 164 Ca 0.63 1.15 0.04 0.00 0.00 0.00 0.00 51.96 53.78 2cw5 s ALA 164 Cb -0.44 -3.45 -0.02 0.00 0.00 0.00 0.00 23.12 19.21 2cw5 s ALA 164 CO 0.43 -0.66 -0.12 1.03 0.00 0.00 0.00 175.76 176.43 2cw5 s ARG 165 N -2.10 0.83 0.53 0.00 1.81 -1.26 -3.48 118.95 115.28 2cw5 s ARG 165 Ca 0.54 -0.71 -0.17 0.00 -1.72 0.00 0.00 55.73 53.68 2cw5 s ARG 165 Cb -0.36 -0.80 -0.07 0.00 -0.45 0.00 0.00 34.95 33.27 2cw5 s ARG 165 CO 0.47 0.20 1.01 -0.51 -0.68 0.00 0.00 175.30 175.79 2cw5 s LEU 166 N -1.11 3.62 -1.06 2.53 1.43 -1.26 -4.85 118.68 117.99 2cw5 s LEU 166 Ca -0.00 1.70 -0.07 0.00 -1.03 0.00 0.00 54.13 54.74 2cw5 s LEU 166 Cb -0.08 -4.53 -0.07 0.00 0.03 0.00 0.00 46.19 41.55 2cw5 s LEU 166 CO 0.01 -0.80 2.39 -0.81 0.23 0.00 0.00 176.35 177.36 2cw5 n PRO 167 N -1.62 2.49 -4.52 1.29 -0.04 -1.26 -4.82 135.00 126.53 2cw5 n PRO 167 Ca 0.08 -1.61 -0.26 0.00 -0.04 0.00 0.00 63.50 61.66 2cw5 n PRO 167 Cb 0.53 -2.51 -0.13 0.00 -0.04 0.00 0.00 33.50 31.35 2cw5 n PRO 167 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2cw5 s LEU 168 N 0.11 2.23 -0.16 1.53 1.43 -1.26 -5.13 118.68 117.43 2cw5 s LEU 168 Ca 0.48 -0.62 -0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2cw5 s LEU 168 Cb 0.13 -1.02 0.06 0.00 0.03 0.00 0.00 46.19 45.39 2cw5 s LEU 168 CO -0.04 0.14 0.37 0.00 0.23 0.00 0.00 176.35 177.05 2cw5 s ALA 169 N -0.96 -0.93 0.07 4.21 0.00 -1.26 -5.05 121.76 117.84 2cw5 s ALA 169 Ca 0.09 1.36 -0.28 0.00 0.00 0.00 0.00 51.96 53.13 2cw5 s ALA 169 Cb -0.10 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.99 2cw5 s ALA 169 CO 0.03 -0.41 0.87 -0.51 0.00 0.00 0.00 175.76 175.74 2cw5 s LEU 170 N 1.78 4.46 0.12 0.00 1.43 -1.26 -4.86 118.68 120.35 2cw5 s LEU 170 Ca -0.06 1.61 0.03 0.00 -1.03 0.00 0.00 54.13 54.67 2cw5 s LEU 170 Cb -0.10 -3.41 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 2cw5 s LEU 170 CO -0.12 -0.05 -0.08 0.28 0.23 0.00 0.00 176.35 176.61 2cw5 s THR 171 N 0.08 0.92 -0.26 5.49 -1.32 -0.12 -4.97 115.64 115.47 2cw5 s THR 171 Ca 0.43 -1.96 0.27 0.00 -1.21 0.00 0.00 61.69 59.22 2cw5 s THR 171 Cb -0.22 -1.72 0.35 0.00 -1.51 0.00 0.00 72.50 69.40 2cw5 s THR 171 CO 0.26 -0.79 1.77 -0.33 -2.21 0.00 0.00 174.62 173.33 2cw5 h GLU 172 N 2.94 0.00 0.00 7.08 4.39 -1.92 -0.11 114.58 126.96 2cw5 h GLU 172 Ca -0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.34 2cw5 h GLU 172 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2cw5 h GLU 172 CO 0.63 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.89 2cw5 n GLY 173 N 0.64 -1.24 0.11 -3.84 0.00 -1.26 -4.64 105.19 94.96 2cw5 n GLY 173 Ca 0.03 -2.10 0.13 0.00 0.00 0.00 0.00 46.02 44.07 2cw5 n GLY 173 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cw5 n PRO 174 N 0.00 0.23 -3.32 1.61 -0.04 -1.26 -5.02 135.00 127.20 2cw5 n PRO 174 Ca 0.00 0.26 -0.38 0.00 -0.04 0.00 0.00 63.50 63.34 2cw5 n PRO 174 Cb 0.00 -1.80 -0.06 0.00 -0.04 0.00 0.00 33.50 31.60 2cw5 n PRO 174 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2cw5 s GLU 175 N -3.15 4.34 0.00 0.54 2.56 -1.26 -0.13 118.70 121.59 2cw5 s GLU 175 Ca 0.09 0.44 0.00 0.00 0.00 0.00 0.00 54.97 55.50 2cw5 s GLU 175 Cb 0.12 -3.44 0.00 0.00 2.00 0.00 0.00 34.13 32.81 2cw5 s GLU 175 CO 0.53 0.16 0.00 0.41 -0.56 0.00 0.00 175.26 175.80 2cw5 n GLY 176 N 3.27 4.82 3.48 -1.50 0.00 0.61 -4.92 105.19 110.95 2cw5 n GLY 176 Ca -0.07 -1.29 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 2cw5 n GLY 176 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2cw5 s GLU 177 N 1.06 1.32 -0.16 1.61 -1.05 -1.26 -1.59 118.70 118.63 2cw5 s GLU 177 Ca 0.00 -0.85 -0.29 0.00 -0.15 0.00 0.00 54.97 53.68 2cw5 s GLU 177 Cb 0.00 0.51 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 2cw5 s GLU 177 CO 0.00 -0.55 1.23 0.08 0.95 0.00 0.00 175.26 176.97 2cw5 s VAL 178 N -3.87 4.33 -0.12 1.83 1.01 -1.26 -1.24 120.40 121.09 2cw5 s VAL 178 Ca 0.09 1.61 -0.07 0.00 0.00 0.00 0.00 61.98 63.61 2cw5 s VAL 178 Cb -0.00 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2cw5 s VAL 178 CO -0.04 -0.12 0.11 0.25 0.00 0.00 0.00 175.10 175.30 2cw5 h LEU 179 N 9.46 0.00 0.00 3.92 5.85 0.27 0.13 115.31 134.94 2cw5 h LEU 179 Ca -0.27 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2cw5 h LEU 179 Cb 1.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.14 2cw5 h LEU 179 CO 0.96 0.65 0.00 1.07 -0.34 0.00 0.00 178.44 180.78 2cw5 n THR 180 N -4.72 0.00 -4.22 1.05 5.66 -1.01 -4.69 114.28 106.35 2cw5 n THR 180 Ca -0.04 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.83 2cw5 n THR 180 Cb 0.14 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.82 2cw5 n THR 180 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 2cw5 s PHE 181 N -7.83 1.14 0.39 1.09 0.08 -1.26 0.15 117.98 111.74 2cw5 s PHE 181 Ca 0.00 -0.88 0.05 0.00 0.12 0.00 0.00 56.93 56.23 2cw5 s PHE 181 Cb 0.00 -0.62 0.05 0.00 -0.57 0.00 0.00 43.02 41.88 2cw5 s PHE 181 CO 0.00 -0.07 0.45 -0.40 -0.10 0.00 0.00 175.22 175.10 2cw5 n ASP 182 N -0.16 1.76 0.30 1.36 5.68 -0.90 -4.93 116.55 119.65 2cw5 n ASP 182 Ca -0.10 -2.16 0.16 0.00 -0.50 0.00 0.00 54.79 52.19 2cw5 n ASP 182 Cb 0.61 -0.19 0.94 0.00 -1.14 0.00 0.00 41.12 41.34 2cw5 n ASP 182 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2cw5 h ARG 183 N 0.00 0.00 -0.01 0.11 0.11 -2.02 -2.31 114.38 110.26 2cw5 h ARG 183 Ca -0.21 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.87 2cw5 h ARG 183 Cb 0.87 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.95 2cw5 h ARG 183 CO 0.31 0.02 -0.27 1.19 0.10 0.00 0.00 179.97 181.32 2cw5 n PHE 184 N -3.65 0.00 -0.15 4.08 3.72 -1.26 -4.93 117.46 115.27 2cw5 n PHE 184 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2cw5 n PHE 184 Cb 0.11 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 2cw5 n PHE 184 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cw5 n GLY 185 N 1.34 0.77 3.75 1.37 0.00 -0.87 -4.22 105.19 107.33 2cw5 n GLY 185 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2cw5 n GLY 185 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cw5 s ASN 186 N -2.44 6.84 -0.16 1.61 0.01 -1.26 -0.94 114.94 118.59 2cw5 s ASN 186 Ca 0.00 2.55 -0.18 0.00 -0.71 0.00 0.00 52.86 54.52 2cw5 s ASN 186 Cb 0.00 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.99 2cw5 s ASN 186 CO 0.00 -0.53 0.48 0.00 -1.51 0.00 0.00 177.10 175.54 2cw5 s ALA 187 N -0.51 3.52 -0.19 0.60 0.00 0.14 -2.11 121.76 123.20 2cw5 s ALA 187 Ca 0.53 -0.32 -0.14 0.00 0.00 0.00 0.00 51.96 52.02 2cw5 s ALA 187 Cb -0.38 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2cw5 s ALA 187 CO 0.45 -0.21 0.32 0.42 0.00 0.00 0.00 175.76 176.74 2cw5 s ILE 188 N 1.10 5.27 0.47 0.00 -1.09 0.12 -0.60 121.20 126.47 2cw5 s ILE 188 Ca 0.24 0.56 0.07 0.00 -2.23 0.00 0.00 60.65 59.30 2cw5 s ILE 188 Cb -0.15 -3.66 0.01 0.00 -1.58 0.00 0.00 42.46 37.09 2cw5 s ILE 188 CO 0.09 0.32 0.46 0.42 -1.23 0.00 0.00 174.94 175.00 2cw5 s THR 189 N 0.94 2.34 -2.31 2.92 -4.23 -0.62 0.92 115.64 115.60 2cw5 s THR 189 Ca 0.16 -1.31 0.21 0.00 -1.18 0.00 0.00 61.69 59.57 2cw5 s THR 189 Cb -0.14 -2.65 0.44 0.00 1.34 0.00 0.00 72.50 71.49 2cw5 s THR 189 CO 0.06 0.00 1.50 0.35 -0.54 0.00 0.00 174.62 175.98 2cw5 n THR 190 N -1.73 0.29 -2.75 3.99 -2.24 -0.37 -4.49 114.28 106.98 2cw5 n THR 190 Ca 0.04 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 2cw5 n THR 190 Cb 0.62 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 69.32 2cw5 n THR 190 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2cw5 s LEU 191 N -1.52 4.33 0.00 3.22 1.43 -1.26 -0.95 118.68 123.94 2cw5 s LEU 191 Ca 0.33 1.57 0.27 0.00 -1.03 0.00 0.00 54.13 55.27 2cw5 s LEU 191 Cb 0.18 -3.50 0.89 0.00 0.03 0.00 0.00 46.19 43.79 2cw5 s LEU 191 CO 0.27 -0.29 1.67 0.18 0.23 0.00 0.00 176.35 178.41 2cw5 n LEU 192 N 4.17 0.37 -4.25 1.79 4.77 -0.06 -0.42 117.00 123.37 2cw5 n LEU 192 Ca 0.06 0.14 -0.28 0.00 -0.03 0.00 0.00 56.01 55.91 2cw5 n LEU 192 Cb 0.50 -0.31 -0.15 0.00 -2.33 0.00 0.00 43.42 41.13 2cw5 n LEU 192 CO 0.51 0.08 -0.54 -0.13 -1.33 0.00 0.00 177.39 175.99 2cw5 s ARG 193 N -2.87 1.69 -0.45 3.23 1.81 -1.26 -4.77 118.95 116.33 2cw5 s ARG 193 Ca 0.16 -0.84 0.06 0.00 -1.72 0.00 0.00 55.73 53.39 2cw5 s ARG 193 Cb 0.19 -1.68 0.21 0.00 -0.45 0.00 0.00 34.95 33.21 2cw5 s ARG 193 CO 0.59 0.45 0.46 0.00 -0.68 0.00 0.00 175.30 176.12 2cw5 n ALA 194 N 2.34 2.87 -1.76 2.13 0.00 -1.26 -4.67 120.51 120.15 2cw5 n ALA 194 Ca -0.16 -3.51 -0.41 0.00 0.00 0.00 0.00 53.44 49.36 2cw5 n ALA 194 Cb 0.53 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 2cw5 n ALA 194 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2cw5 s PRO 195 N -0.78 2.95 0.28 0.00 0.04 -1.26 -4.72 135.00 131.50 2cw5 s PRO 195 Ca 0.34 1.59 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2cw5 s PRO 195 Cb 0.09 -4.36 -0.13 0.00 0.04 0.00 0.00 34.50 30.14 2cw5 s PRO 195 CO -0.15 -2.31 1.35 0.28 0.04 0.00 0.00 177.00 176.20 2cw5 n VAL 196 N 7.65 1.39 0.00 -0.36 0.31 -1.26 -0.90 118.33 125.15 2cw5 n VAL 196 Ca 0.28 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2cw5 n VAL 196 Cb 0.48 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 2cw5 n VAL 196 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2cw5 n GLY 197 N 1.60 1.63 0.00 2.92 0.00 -0.51 -5.01 105.19 105.83 2cw5 n GLY 197 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2cw5 n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cw5 n GLY 198 N -2.00 0.54 3.02 -0.02 0.00 -0.08 -4.86 105.19 101.79 2cw5 n GLY 198 Ca 0.00 -1.90 -0.09 0.00 0.00 0.00 0.00 46.02 44.03 2cw5 n GLY 198 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cw5 s PHE 199 N 0.26 0.27 -0.03 1.61 0.08 -1.26 -1.39 117.98 117.53 2cw5 s PHE 199 Ca 0.00 -0.57 0.04 0.00 0.12 0.00 0.00 56.93 56.52 2cw5 s PHE 199 Cb 0.00 -0.20 -0.01 0.00 -0.57 0.00 0.00 43.02 42.24 2cw5 s PHE 199 CO 0.00 -0.24 -0.15 0.54 -0.10 0.00 0.00 175.22 175.27 2cw5 s VAL 200 N -1.89 1.25 -0.20 -0.44 0.11 0.40 -0.87 120.40 118.76 2cw5 s VAL 200 Ca -0.12 -0.64 -0.09 0.00 -2.93 0.00 0.00 61.98 58.20 2cw5 s VAL 200 Cb -0.07 -1.06 -0.05 0.00 -1.53 0.00 0.00 36.38 33.67 2cw5 s VAL 200 CO -0.02 0.36 0.11 -0.70 -3.33 0.00 0.00 175.10 171.52 2cw5 s GLU 201 N -0.09 4.13 -0.13 1.54 2.12 0.10 -0.15 118.70 126.22 2cw5 s GLU 201 Ca 0.00 -0.26 -0.04 0.00 0.36 0.00 0.00 54.97 55.04 2cw5 s GLU 201 Cb -0.09 -3.37 0.06 0.00 0.26 0.00 0.00 34.13 31.00 2cw5 s GLU 201 CO 0.01 0.28 0.18 0.54 -0.54 0.00 0.00 175.26 175.74 2cw5 s VAL 202 N 0.39 -0.28 -0.37 3.70 0.11 -0.63 -1.16 120.40 122.16 2cw5 s VAL 202 Ca 0.07 0.18 0.00 0.00 -2.93 0.00 0.00 61.98 59.30 2cw5 s VAL 202 Cb -0.11 -0.44 0.00 0.00 -1.53 0.00 0.00 36.38 34.30 2cw5 s VAL 202 CO -0.01 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.38 2cw5 n GLY 203 N 5.32 0.64 1.24 6.54 0.00 -1.26 -2.59 105.19 115.07 2cw5 n GLY 203 Ca -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2cw5 n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cw5 n GLY 204 N -2.06 0.90 3.83 -0.02 0.00 -1.26 -5.05 105.19 101.53 2cw5 n GLY 204 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2cw5 n GLY 204 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cw5 s ARG 205 N -0.59 3.25 -0.28 1.61 0.52 -1.07 -5.08 118.95 117.32 2cw5 s ARG 205 Ca 0.00 -0.34 -0.21 0.00 -0.52 0.00 0.00 55.73 54.65 2cw5 s ARG 205 Cb 0.00 -3.00 -0.01 0.00 0.52 0.00 0.00 34.95 32.46 2cw5 s ARG 205 CO 0.00 0.69 0.69 1.03 0.02 0.00 0.00 175.30 177.73 2cw5 s ARG 206 N -1.53 4.02 -0.15 3.54 0.52 -1.26 -1.60 118.95 122.49 2cw5 s ARG 206 Ca 0.21 0.53 -0.02 0.00 -0.52 0.00 0.00 55.73 55.93 2cw5 s ARG 206 Cb -0.12 -3.69 -0.02 0.00 0.52 0.00 0.00 34.95 31.64 2cw5 s ARG 206 CO 0.12 -0.53 -0.08 0.08 0.02 0.00 0.00 175.30 174.91 2cw5 s VAL 207 N 2.68 3.50 0.28 3.52 1.01 0.79 -4.94 120.40 127.23 2cw5 s VAL 207 Ca 0.28 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 2cw5 s VAL 207 Cb -0.15 -2.51 -0.10 0.00 0.00 0.00 0.00 36.38 33.62 2cw5 s VAL 207 CO 0.10 0.50 1.15 -2.16 0.00 0.00 0.00 175.10 174.70 2cw5 s PRO 208 N 0.42 4.57 -0.22 2.72 0.04 -1.26 -0.45 135.00 140.81 2cw5 s PRO 208 Ca -0.07 1.90 -0.14 0.00 0.04 0.00 0.00 61.00 62.73 2cw5 s PRO 208 Cb -0.15 -3.17 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 2cw5 s PRO 208 CO 0.04 0.10 0.33 0.08 0.04 0.00 0.00 177.00 177.59 2cw5 s VAL 209 N -1.04 5.24 0.29 -0.36 1.01 -0.49 -0.60 120.40 124.46 2cw5 s VAL 209 Ca 0.46 0.55 0.03 0.00 0.00 0.00 0.00 61.98 63.02 2cw5 s VAL 209 Cb -0.34 -3.66 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 2cw5 s VAL 209 CO 0.43 0.27 0.07 -0.13 0.00 0.00 0.00 175.10 175.74 2cw5 s ARG 210 N 1.29 1.54 0.33 2.72 1.81 0.11 -1.43 118.95 125.32 2cw5 s ARG 210 Ca 0.16 -1.84 0.06 0.00 -1.72 0.00 0.00 55.73 52.38 2cw5 s ARG 210 Cb -0.14 -0.61 0.57 0.00 -0.45 0.00 0.00 34.95 34.31 2cw5 s ARG 210 CO 0.07 -0.22 1.80 0.00 -0.68 0.00 0.00 175.30 176.27 2cw5 h ARG 211 N 2.24 0.37 -3.87 3.54 3.08 -1.95 -3.38 114.38 114.40 2cw5 h ARG 211 Ca -0.40 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.44 2cw5 h ARG 211 Cb 1.24 -0.03 -0.13 0.00 0.08 0.00 0.00 29.97 31.13 2cw5 h ARG 211 CO 0.66 0.56 -0.35 -0.08 -1.07 0.00 0.00 179.97 179.69 2cw5 s THR 212 N -4.58 0.10 -0.75 2.04 -1.32 -1.26 -4.70 115.64 105.17 2cw5 s THR 212 Ca -0.06 -1.32 0.22 0.00 -1.21 0.00 0.00 61.69 59.32 2cw5 s THR 212 Cb 0.14 -1.65 0.22 0.00 -1.51 0.00 0.00 72.50 69.70 2cw5 s THR 212 CO 0.76 -0.44 1.68 2.22 -2.21 0.00 0.00 174.62 176.63 2cw5 n PHE 213 N -0.15 0.49 1.06 9.09 1.16 -1.26 -3.05 117.46 124.79 2cw5 n PHE 213 Ca -0.10 0.18 0.13 0.00 -1.87 0.00 0.00 57.45 55.78 2cw5 n PHE 213 Cb 0.63 -0.78 0.46 0.00 -1.61 0.00 0.00 39.48 38.18 2cw5 n PHE 213 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2cw5 n GLY 214 N 0.44 -1.32 0.64 4.97 0.00 -1.26 -3.96 105.19 104.70 2cw5 n GLY 214 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2cw5 n GLY 214 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cw5 n GLU 215 N -1.42 0.82 -3.97 1.61 1.02 -1.17 -4.75 120.64 112.78 2cw5 n GLU 215 Ca 0.07 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.13 2cw5 n GLU 215 Cb 0.33 -1.32 -0.09 0.00 -0.02 0.00 0.00 31.44 30.34 2cw5 n GLU 215 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2cw5 s VAL 216 N -0.67 0.17 0.66 2.62 -7.23 -1.25 -5.09 120.40 109.60 2cw5 s VAL 216 Ca 0.00 -1.36 -0.17 0.00 -1.81 0.00 0.00 61.98 58.64 2cw5 s VAL 216 Cb 0.00 -1.21 -0.01 0.00 0.56 0.00 0.00 36.38 35.71 2cw5 s VAL 216 CO 0.00 -0.75 1.09 -2.65 -0.31 0.00 0.00 175.10 172.48 2cw5 n PRO 217 N 0.34 0.83 -1.70 4.82 -0.02 -1.26 -4.88 135.00 133.13 2cw5 n PRO 217 Ca -0.16 0.34 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 2cw5 n PRO 217 Cb 0.60 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2cw5 n PRO 217 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2cw5 n GLU 218 N -1.66 2.74 -0.37 -0.52 2.13 -1.26 -1.34 120.64 120.36 2cw5 n GLU 218 Ca 0.14 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.96 2cw5 n GLU 218 Cb 0.48 -2.86 0.00 0.00 0.27 0.00 0.00 31.44 29.33 2cw5 n GLU 218 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2cw5 n GLY 219 N 4.08 0.84 3.86 8.31 0.00 0.27 -4.98 105.19 117.57 2cw5 n GLY 219 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2cw5 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cw5 s ALA 220 N -2.82 3.71 0.32 4.61 0.00 -0.45 -4.79 121.76 122.35 2cw5 s ALA 220 Ca 0.00 -0.36 -0.28 0.00 0.00 0.00 0.00 51.96 51.32 2cw5 s ALA 220 Cb 0.00 -2.29 -0.09 0.00 0.00 0.00 0.00 23.12 20.73 2cw5 s ALA 220 CO 0.00 0.55 1.12 -2.14 0.00 0.00 0.00 175.76 175.30 2cw5 s PRO 221 N -1.88 4.45 -0.07 0.00 0.02 -1.26 -2.12 135.00 134.14 2cw5 s PRO 221 Ca 0.33 1.81 -0.21 0.00 0.02 0.00 0.00 61.00 62.95 2cw5 s PRO 221 Cb -0.14 -3.00 0.05 0.00 0.02 0.00 0.00 34.50 31.42 2cw5 s PRO 221 CO 0.18 0.04 0.49 0.54 -0.33 0.00 0.00 177.00 177.92 2cw5 s VAL 222 N -1.27 0.02 0.09 3.83 0.11 0.28 -4.47 120.40 118.99 2cw5 s VAL 222 Ca 0.49 -0.19 0.08 0.00 -2.93 0.00 0.00 61.98 59.43 2cw5 s VAL 222 Cb -0.31 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 33.73 2cw5 s VAL 222 CO 0.40 -0.10 -0.18 0.00 -3.33 0.00 0.00 175.10 171.88 2cw5 s ALA 223 N -0.85 2.65 0.20 1.54 0.00 0.23 -0.65 121.76 124.87 2cw5 s ALA 223 Ca -0.09 -1.29 -0.23 0.00 0.00 0.00 0.00 51.96 50.35 2cw5 s ALA 223 Cb -0.03 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.46 2cw5 s ALA 223 CO 0.05 0.59 0.70 1.52 0.00 0.00 0.00 175.76 178.62 2cw5 s TYR 224 N -1.06 -0.35 -0.24 0.00 -0.85 -0.79 0.10 117.35 114.16 2cw5 s TYR 224 Ca 0.17 0.04 -0.27 0.00 -0.52 0.00 0.00 57.07 56.48 2cw5 s TYR 224 Cb -0.11 0.63 0.00 0.00 0.38 0.00 0.00 41.96 42.86 2cw5 s TYR 224 CO 0.08 -0.98 0.94 -1.17 -1.52 0.00 0.00 175.55 172.90 2cw5 s LEU 225 N -2.81 4.08 1.12 -3.49 2.96 -1.26 -0.38 118.68 118.89 2cw5 s LEU 225 Ca 0.06 1.18 -0.19 0.00 -0.22 0.00 0.00 54.13 54.96 2cw5 s LEU 225 Cb -0.03 -3.37 0.26 0.00 0.50 0.00 0.00 46.19 43.56 2cw5 s LEU 225 CO -0.03 -0.61 1.23 -0.83 -1.32 0.00 0.00 176.35 174.78 2cw5 s GLY 226 N 1.31 1.70 0.41 7.98 0.00 0.31 -4.90 107.32 114.13 2cw5 s GLY 226 Ca 0.40 -1.18 0.29 0.00 0.00 0.00 0.00 44.72 44.22 2cw5 s GLY 226 CO 0.07 -0.30 1.87 1.48 0.00 0.00 0.00 173.10 176.23 2cw5 h SER 227 N -2.24 0.00 -0.40 1.64 4.64 -1.96 -2.21 113.55 113.03 2cw5 h SER 227 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2cw5 h SER 227 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2cw5 h SER 227 CO 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.27 2cw5 n ALA 228 N -1.88 2.67 -1.01 5.18 0.00 -1.26 -4.96 120.51 119.24 2cw5 n ALA 228 Ca -0.01 -1.64 -0.00 0.00 0.00 0.00 0.00 53.44 51.79 2cw5 n ALA 228 Cb 0.13 -0.67 -0.00 0.00 0.00 0.00 0.00 19.45 18.90 2cw5 n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cw5 n GLY 229 N 0.34 0.46 3.46 0.00 0.00 -0.83 -4.98 105.19 103.64 2cw5 n GLY 229 Ca 0.18 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2cw5 n GLY 229 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cw5 s LEU 230 N -0.10 2.62 0.21 0.99 1.43 -1.26 -4.59 118.68 117.98 2cw5 s LEU 230 Ca 0.00 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.34 2cw5 s LEU 230 Cb 0.00 -1.52 -0.09 0.00 0.03 0.00 0.00 46.19 44.61 2cw5 s LEU 230 CO 0.00 0.24 1.42 -0.22 0.23 0.00 0.00 176.35 178.02 2cw5 s LEU 231 N -1.56 4.39 0.18 1.79 0.20 0.44 -0.53 118.68 123.58 2cw5 s LEU 231 Ca 0.15 2.56 0.11 0.00 0.69 0.00 0.00 54.13 57.64 2cw5 s LEU 231 Cb -0.10 -3.61 -0.04 0.00 -0.43 0.00 0.00 46.19 42.00 2cw5 s LEU 231 CO 0.06 -0.66 -0.23 -1.61 -0.29 0.00 0.00 176.35 173.61 2cw5 s GLU 232 N 0.02 1.45 -0.10 1.98 2.02 0.48 -1.59 118.70 122.95 2cw5 s GLU 232 Ca 0.60 -1.48 0.04 0.00 0.02 0.00 0.00 54.97 54.15 2cw5 s GLU 232 Cb -0.40 -1.74 0.00 0.00 0.10 0.00 0.00 34.13 32.09 2cw5 s GLU 232 CO 0.39 0.38 -0.22 0.08 0.02 0.00 0.00 175.26 175.91 2cw5 s VAL 233 N -1.67 1.94 0.25 2.63 1.01 0.23 -1.88 120.40 122.91 2cw5 s VAL 233 Ca 0.19 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.24 2cw5 s VAL 233 Cb -0.08 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2cw5 s VAL 233 CO 0.09 0.53 0.18 0.00 0.00 0.00 0.00 175.10 175.90 2cw5 s ALA 234 N 0.45 1.47 -0.20 5.51 0.00 0.18 0.25 121.76 129.42 2cw5 s ALA 234 Ca -0.17 -1.83 0.01 0.00 0.00 0.00 0.00 51.96 49.97 2cw5 s ALA 234 Cb -0.17 1.39 0.04 0.00 0.00 0.00 0.00 23.12 24.38 2cw5 s ALA 234 CO 0.07 -0.60 -0.11 0.08 0.00 0.00 0.00 175.76 175.19 2cw5 s VAL 235 N -3.88 1.70 -0.27 0.00 1.01 -1.26 -0.55 120.40 117.14 2cw5 s VAL 235 Ca 0.39 -1.02 -0.39 0.00 0.00 0.00 0.00 61.98 60.97 2cw5 s VAL 235 Cb 0.05 -1.74 -0.14 0.00 0.00 0.00 0.00 36.38 34.55 2cw5 s VAL 235 CO 0.18 0.20 1.85 -3.20 0.00 0.00 0.00 175.10 174.13 2cw5 n ASN 236 N 4.67 2.49 -0.97 3.32 5.15 -0.90 0.73 115.26 129.75 2cw5 n ASN 236 Ca -0.15 0.95 -0.13 0.00 -0.60 0.00 0.00 54.58 54.65 2cw5 n ASN 236 Cb 0.47 -1.19 -0.05 0.00 -0.53 0.00 0.00 39.78 38.47 2cw5 n ASN 236 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2cw5 n ARG 237 N 6.10 -1.16 -0.69 1.20 1.74 -1.26 -0.56 116.66 122.03 2cw5 n ARG 237 Ca 0.29 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 58.29 2cw5 n ARG 237 Cb 0.17 -5.08 0.00 0.00 -1.02 0.00 0.00 32.46 26.53 2cw5 n ARG 237 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cw5 n GLY 238 N -0.86 4.92 2.99 -0.13 0.00 0.22 -4.87 105.19 107.46 2cw5 n GLY 238 Ca -0.13 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.04 2cw5 n GLY 238 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cw5 s SER 239 N 0.31 4.28 0.23 1.61 0.15 -1.26 -4.40 113.70 114.63 2cw5 s SER 239 Ca 0.00 -1.50 -0.07 0.00 0.70 0.00 0.00 55.95 55.08 2cw5 s SER 239 Cb 0.00 -1.39 0.27 0.00 -1.71 0.00 0.00 66.02 63.19 2cw5 s SER 239 CO 0.00 -0.26 1.88 0.00 1.20 0.00 0.00 173.24 176.05 2cw5 h ALA 240 N 7.82 1.14 -0.04 5.45 0.00 -1.76 0.31 119.26 132.18 2cw5 h ALA 240 Ca -0.15 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2cw5 h ALA 240 Cb 1.04 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 2cw5 h ALA 240 CO 0.46 0.38 -0.23 -0.09 0.00 0.00 0.00 179.25 179.77 2cw5 h ARG 241 N 1.07 -0.32 0.31 0.00 2.43 -1.37 0.11 114.38 116.60 2cw5 h ARG 241 Ca 0.35 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 2cw5 h ARG 241 Cb 0.03 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2cw5 h ARG 241 CO -0.12 -0.21 -0.15 1.49 -1.51 0.00 0.00 179.97 179.46 2cw5 h GLU 242 N -0.33 -0.40 -0.99 0.20 4.81 -1.77 -0.24 114.58 115.86 2cw5 h GLU 242 Ca 0.07 0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.50 2cw5 h GLU 242 Cb 0.44 0.09 -0.09 0.00 0.63 0.00 0.00 28.75 29.81 2cw5 h GLU 242 CO -0.24 -0.27 0.61 0.00 -0.73 0.00 0.00 179.01 178.39 2cw5 h ALA 243 N -1.12 1.70 -0.11 2.92 0.00 -0.43 -1.71 119.26 120.52 2cw5 h ALA 243 Ca -0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2cw5 h ALA 243 Cb 0.32 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2cw5 h ALA 243 CO 0.07 -0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.58 2cw5 n LEU 244 N -4.68 3.04 -3.73 0.00 4.77 0.39 -4.98 117.00 111.82 2cw5 n LEU 244 Ca 0.21 -1.11 -0.24 0.00 -0.03 0.00 0.00 56.01 54.84 2cw5 n LEU 244 Cb 0.52 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 2cw5 n LEU 244 CO 0.25 0.55 0.05 0.61 -1.33 0.00 0.00 177.39 177.51 2cw5 n GLY 245 N 1.34 -0.40 3.82 -0.72 0.00 -0.62 -4.95 105.19 103.66 2cw5 n GLY 245 Ca 0.15 0.16 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2cw5 n GLY 245 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cw5 s LEU 246 N -6.92 3.92 0.04 0.99 1.43 -0.20 -5.03 118.68 112.92 2cw5 s LEU 246 Ca 0.29 1.65 0.02 0.00 -1.03 0.00 0.00 54.13 55.05 2cw5 s LEU 246 Cb -0.14 -4.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.55 2cw5 s LEU 246 CO 0.80 -0.37 -0.07 -0.54 0.23 0.00 0.00 176.35 176.40 2cw5 s LYS 247 N -3.26 0.51 0.38 1.70 1.02 -1.26 -4.87 119.74 113.97 2cw5 s LYS 247 Ca 0.61 -0.79 -0.27 0.00 0.02 0.00 0.00 55.97 55.54 2cw5 s LYS 247 Cb -0.09 -0.19 -0.10 0.00 -0.52 0.00 0.00 37.83 36.92 2cw5 s LYS 247 CO 0.15 0.02 1.39 -1.21 -0.92 0.00 0.00 175.35 174.79 2cw5 s GLU 248 N -1.80 4.09 0.00 1.68 8.01 -1.26 -4.69 118.70 124.73 2cw5 s GLU 248 Ca -0.09 2.37 0.00 0.00 0.01 0.00 0.00 54.97 57.26 2cw5 s GLU 248 Cb -0.08 -2.91 0.00 0.00 -4.31 0.00 0.00 34.13 26.83 2cw5 s GLU 248 CO -0.01 -0.47 0.00 0.41 0.01 0.00 0.00 175.26 175.20 2cw5 n GLY 249 N 0.61 0.07 3.45 -1.39 0.00 0.46 -4.96 105.19 103.44 2cw5 n GLY 249 Ca 0.02 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 2cw5 n GLY 249 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2cw5 s PRO 251 N -0.89 2.29 0.03 1.61 0.02 -1.26 -4.61 135.00 132.18 2cw5 s PRO 251 Ca 0.00 -0.83 0.02 0.00 0.02 0.00 0.00 61.00 60.20 2cw5 s PRO 251 Cb 0.00 -2.26 -0.02 0.00 0.02 0.00 0.00 34.50 32.24 2cw5 s PRO 251 CO 0.00 0.58 -0.06 0.08 -0.33 0.00 0.00 177.00 177.27 2cw5 s VAL 252 N -0.79 0.41 -0.17 3.83 1.01 -0.62 -4.26 120.40 119.81 2cw5 s VAL 252 Ca 0.13 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 2cw5 s VAL 252 Cb -0.10 -0.48 0.06 0.00 0.00 0.00 0.00 36.38 35.85 2cw5 s VAL 252 CO 0.02 -0.33 0.41 -0.60 0.00 0.00 0.00 175.10 174.61 2cw5 s ARG 253 N -1.30 0.41 0.16 2.72 3.52 -0.31 -0.28 118.95 123.87 2cw5 s ARG 253 Ca -0.09 0.76 -0.30 0.00 -0.13 0.00 0.00 55.73 55.96 2cw5 s ARG 253 Cb -0.09 0.02 -0.07 0.00 -1.56 0.00 0.00 34.95 33.25 2cw5 s ARG 253 CO 0.00 -0.14 1.18 -0.51 -0.81 0.00 0.00 175.30 175.02 2cw5 s LEU 254 N 1.19 4.44 0.00 -0.88 1.43 0.81 0.02 118.68 125.69 2cw5 s LEU 254 Ca -0.08 2.16 0.27 0.00 -1.03 0.00 0.00 54.13 55.45 2cw5 s LEU 254 Cb -0.07 -3.60 0.83 0.00 0.03 0.00 0.00 46.19 43.38 2cw5 s LEU 254 CO -0.10 -0.36 1.62 0.18 0.23 0.00 0.00 176.35 177.91