#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wtc s LEU 7 N 0.00 1.57 0.85 7.52 1.43 -1.26 -4.96 118.68 123.83 1wtc s LEU 7 Ca 0.00 -0.09 -0.11 0.00 -1.03 0.00 0.00 54.13 52.91 1wtc s LEU 7 Cb 0.00 -0.31 0.10 0.00 0.03 0.00 0.00 46.19 46.01 1wtc s LEU 7 CO 0.00 -0.02 1.10 -2.84 0.23 0.00 0.00 176.35 174.83 1wtc s PRO 8 N 0.51 1.64 0.33 1.29 0.02 -1.26 -5.07 135.00 132.45 1wtc s PRO 8 Ca -0.06 1.18 0.03 0.00 0.02 0.00 0.00 61.00 62.18 1wtc s PRO 8 Cb -0.09 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 1wtc s PRO 8 CO -0.00 -2.08 0.14 0.95 -0.33 0.00 0.00 177.00 175.67 1wtc s THR 9 N -2.83 0.50 0.39 0.99 -4.23 -1.26 -5.00 115.64 104.20 1wtc s THR 9 Ca 0.63 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.31 1wtc s THR 9 Cb -0.19 -2.51 0.38 0.00 1.34 0.00 0.00 72.50 71.52 1wtc s THR 9 CO 0.57 0.00 1.79 0.22 -0.54 0.00 0.00 174.62 176.66 1wtc h TYR 10 N 2.10 0.67 -0.54 3.99 3.20 -1.98 -0.28 116.97 124.13 1wtc h TYR 10 Ca -0.35 0.02 0.11 0.00 3.14 0.00 0.00 58.73 61.65 1wtc h TYR 10 Cb 1.25 -0.20 -0.09 0.00 1.54 0.00 0.00 36.73 39.24 1wtc h TYR 10 CO 1.09 0.10 -0.01 -0.44 -1.64 0.00 0.00 178.16 177.26 1wtc h ASP 11 N 0.44 -0.26 -0.50 -2.11 3.32 -1.95 0.27 116.42 115.63 1wtc h ASP 11 Ca 0.56 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.72 1wtc h ASP 11 Cb 1.36 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 41.13 1wtc h ASP 11 CO -0.27 -0.09 0.24 0.44 -1.72 0.00 0.00 179.24 177.83 1wtc h ASP 12 N 0.11 0.68 -0.51 6.45 5.19 -1.44 0.22 116.42 127.11 1wtc h ASP 12 Ca 0.28 -0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.53 1wtc h ASP 12 Cb 0.43 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 1wtc h ASP 12 CO -0.47 0.59 -0.01 0.58 -3.12 0.00 0.00 179.24 176.81 1wtc h VAL 13 N 0.76 1.26 -0.39 -1.35 2.07 -0.74 0.34 116.25 118.20 1wtc h VAL 13 Ca 0.19 -1.11 -0.08 0.00 0.82 0.00 0.00 66.70 66.52 1wtc h VAL 13 Cb 0.10 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1wtc h VAL 13 CO -0.02 0.39 -0.07 0.00 0.02 0.00 0.00 177.57 177.89 1wtc h ALA 14 N 0.94 1.14 -0.08 1.67 0.00 0.36 -1.07 119.26 122.21 1wtc h ALA 14 Ca 0.14 -0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 1wtc h ALA 14 Cb 0.54 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.18 1wtc h ALA 14 CO 0.03 0.55 -0.76 0.66 0.00 0.00 0.00 179.25 179.73 1wtc h SER 15 N 0.62 0.80 -0.98 0.00 4.64 -0.29 -2.99 113.55 115.35 1wtc h SER 15 Ca 0.12 -0.68 0.09 0.00 -0.47 0.00 0.00 61.79 60.85 1wtc h SER 15 Cb 0.50 -0.24 -0.07 0.00 -0.31 0.00 0.00 62.40 62.27 1wtc h SER 15 CO 0.03 1.36 0.63 0.00 -0.87 0.00 0.00 176.83 177.98 1wtc h ALA 16 N 0.46 1.50 -0.57 5.18 0.00 -0.06 0.27 119.26 126.03 1wtc h ALA 16 Ca -0.07 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1wtc h ALA 16 Cb 1.41 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1wtc h ALA 16 CO 0.15 0.31 0.30 0.77 0.00 0.00 0.00 179.25 180.78 1wtc h SER 17 N 1.05 0.44 -0.27 0.00 0.02 -1.10 -0.62 113.55 113.06 1wtc h SER 17 Ca 0.45 0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 61.29 1wtc h SER 17 Cb 0.34 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1wtc h SER 17 CO -0.21 0.29 -0.34 -0.08 -1.14 0.00 0.00 176.83 175.35 1wtc h GLU 18 N 0.57 0.80 0.00 3.45 4.57 -0.94 -2.06 114.58 120.97 1wtc h GLU 18 Ca 0.25 -0.39 -0.07 0.00 -1.18 0.00 0.00 59.36 57.98 1wtc h GLU 18 Cb 0.16 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1wtc h GLU 18 CO -0.17 1.02 -0.31 -0.09 -1.18 0.00 0.00 179.01 178.28 1wtc h ARG 19 N 0.67 0.00 -0.01 1.92 2.43 0.21 -3.19 114.38 116.41 1wtc h ARG 19 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1wtc h ARG 19 Cb 0.89 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1wtc h ARG 19 CO 0.08 0.31 -0.27 0.44 -1.51 0.00 0.00 179.97 179.02 1wtc n ILE 20 N -3.74 0.00 -0.25 1.20 -5.35 -0.31 -4.70 119.36 106.21 1wtc n ILE 20 Ca -0.01 -0.37 0.22 0.00 -0.27 0.00 0.00 62.75 62.32 1wtc n ILE 20 Cb 0.41 1.16 0.55 0.00 -1.74 0.00 0.00 39.64 40.02 1wtc n ILE 20 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1wtc h LYS 21 N 1.52 0.32 0.00 6.28 2.10 -1.35 -0.13 116.57 125.31 1wtc h LYS 21 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1wtc h LYS 21 Cb 0.46 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1wtc h LYS 21 CO 0.00 0.21 0.00 0.87 -2.00 0.00 0.00 179.45 178.53 1wtc h LYS 22 N 0.33 0.00 0.00 0.07 1.57 -1.84 -3.37 116.57 113.33 1wtc h LYS 22 Ca 0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1wtc h LYS 22 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1wtc h LYS 22 CO -0.17 0.00 -0.71 1.19 -0.57 0.00 0.00 179.45 179.19 1wtc n PHE 23 N -2.51 0.00 -1.80 -1.35 3.72 -0.41 -5.08 117.46 110.02 1wtc n PHE 23 Ca 0.02 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.10 1wtc n PHE 23 Cb 0.29 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.86 1wtc n PHE 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wtc s ALA 24 N -1.69 2.62 0.02 4.37 0.00 -0.20 -4.94 121.76 121.95 1wtc s ALA 24 Ca 0.00 0.34 -0.14 0.00 0.00 0.00 0.00 51.96 52.16 1wtc s ALA 24 Cb 0.00 -3.24 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1wtc s ALA 24 CO 0.00 -1.09 0.42 -0.80 0.00 0.00 0.00 175.76 174.29 1wtc s ASN 25 N -3.03 6.79 -1.06 0.00 0.01 -1.26 -4.91 114.94 111.48 1wtc s ASN 25 Ca 0.63 0.95 -0.17 0.00 -0.71 0.00 0.00 52.86 53.56 1wtc s ASN 25 Cb -0.17 -2.24 0.14 0.00 0.41 0.00 0.00 41.25 39.39 1wtc s ASN 25 CO 0.44 0.29 1.29 -0.54 -1.51 0.00 0.00 177.10 177.07 1wtc s LYS 26 N -1.25 3.80 0.43 -0.60 -0.14 -1.26 -4.92 119.74 115.80 1wtc s LYS 26 Ca 0.26 -2.04 -0.24 0.00 -1.36 0.00 0.00 55.97 52.58 1wtc s LYS 26 Cb -0.16 -5.03 -0.10 0.00 -1.68 0.00 0.00 37.83 30.86 1wtc s LYS 26 CO 0.14 -1.82 1.12 0.25 -0.76 0.00 0.00 175.35 174.28 1wtc n THR 27 N 5.30 2.58 -1.55 2.17 -2.24 -1.26 -4.96 114.28 114.31 1wtc n THR 27 Ca 0.31 -0.50 -0.31 0.00 -2.27 0.00 0.00 64.05 61.27 1wtc n THR 27 Cb 0.47 -1.33 0.06 0.00 -2.10 0.00 0.00 70.33 67.43 1wtc n THR 27 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1wtc s PRO 28 N -2.14 2.74 -0.27 -0.78 0.04 -1.26 -4.77 135.00 128.57 1wtc s PRO 28 Ca 0.63 1.12 -0.06 0.00 0.04 0.00 0.00 61.00 62.73 1wtc s PRO 28 Cb -0.53 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.04 1wtc s PRO 28 CO 0.57 -1.26 0.05 0.08 0.04 0.00 0.00 177.00 176.47 1wtc s VAL 29 N -2.83 3.92 0.18 -0.36 1.01 -1.26 -1.96 120.40 119.11 1wtc s VAL 29 Ca 0.61 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.11 1wtc s VAL 29 Cb -0.16 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 1wtc s VAL 29 CO 0.51 0.22 0.29 -0.76 0.00 0.00 0.00 175.10 175.37 1wtc s LEU 30 N 1.53 4.28 0.05 3.92 1.43 0.52 -4.87 118.68 125.53 1wtc s LEU 30 Ca 0.04 0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1wtc s LEU 30 Cb -0.16 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.19 1wtc s LEU 30 CO 0.01 0.02 -0.07 0.42 0.23 0.00 0.00 176.35 176.96 1wtc s THR 31 N -1.82 0.52 -0.07 5.49 -4.23 -1.26 -1.51 115.64 112.77 1wtc s THR 31 Ca 0.34 -1.23 -0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1wtc s THR 31 Cb -0.10 -0.79 0.03 0.00 1.34 0.00 0.00 72.50 72.97 1wtc s THR 31 CO 0.28 -0.49 -0.02 -0.55 -0.54 0.00 0.00 174.62 173.29 1wtc s SER 32 N -1.86 1.48 0.36 3.99 0.15 -1.26 -5.00 113.70 111.57 1wtc s SER 32 Ca -0.06 -0.13 0.08 0.00 0.70 0.00 0.00 55.95 56.54 1wtc s SER 32 Cb -0.07 -0.50 0.70 0.00 -1.71 0.00 0.00 66.02 64.44 1wtc s SER 32 CO -0.01 -0.14 1.87 0.28 1.20 0.00 0.00 173.24 176.45 1wtc h SER 33 N 7.95 0.27 -0.46 5.45 0.02 -1.99 -1.68 113.55 123.11 1wtc h SER 33 Ca -0.27 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.59 1wtc h SER 33 Cb 1.13 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 1wtc h SER 33 CO 0.35 0.45 0.16 0.74 -1.14 0.00 0.00 176.83 177.39 1wtc h THR 34 N 0.26 1.22 -0.38 -2.27 2.02 -1.98 -0.99 112.91 110.79 1wtc h THR 34 Ca 0.05 -0.71 -0.07 0.00 0.77 0.00 0.00 66.41 66.46 1wtc h THR 34 Cb 0.44 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1wtc h THR 34 CO 0.03 0.26 -0.03 0.58 0.37 0.00 0.00 175.52 176.72 1wtc h VAL 35 N 0.61 1.27 -0.70 3.16 2.07 -1.87 -2.37 116.25 118.41 1wtc h VAL 35 Ca 0.15 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1wtc h VAL 35 Cb 0.24 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1wtc h VAL 35 CO -0.01 0.36 0.45 0.78 0.02 0.00 0.00 177.57 179.17 1wtc h ASN 36 N 0.52 0.77 -0.40 0.57 4.21 -1.11 -0.66 115.58 119.47 1wtc h ASN 36 Ca 0.10 -0.01 -0.02 0.00 1.21 0.00 0.00 56.30 57.58 1wtc h ASN 36 Cb 0.52 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 1wtc h ASN 36 CO 0.03 0.54 0.16 0.11 -1.29 0.00 0.00 177.43 176.98 1wtc h LYS 37 N 0.91 0.59 -0.44 0.81 6.56 -1.12 0.66 116.57 124.54 1wtc h LYS 37 Ca 0.27 -0.11 0.05 0.00 -1.06 0.00 0.00 60.65 59.80 1wtc h LYS 37 Cb -0.05 -0.10 -0.05 0.00 -0.57 0.00 0.00 32.23 31.47 1wtc h LYS 37 CO -0.08 0.56 0.18 1.49 -2.06 0.00 0.00 179.45 179.54 1wtc h GLU 38 N 0.50 0.35 0.00 3.15 4.81 -0.99 -2.71 114.58 119.69 1wtc h GLU 38 Ca 0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1wtc h GLU 38 Cb 0.19 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.49 1wtc h GLU 38 CO -0.01 0.23 -0.46 1.19 -0.73 0.00 0.00 179.01 179.23 1wtc n PHE 39 N -4.98 0.21 -3.67 0.92 3.01 -0.29 -4.94 117.46 107.71 1wtc n PHE 39 Ca 0.03 0.06 -0.23 0.00 1.01 0.00 0.00 57.45 58.33 1wtc n PHE 39 Cb 0.15 -0.44 0.05 0.00 -0.01 0.00 0.00 39.48 39.23 1wtc n PHE 39 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1wtc n VAL 40 N -1.72 -4.02 -3.07 -4.37 0.31 0.22 -4.07 118.33 101.60 1wtc n VAL 40 Ca 0.05 -0.31 -0.01 0.00 -0.01 0.00 0.00 64.34 64.06 1wtc n VAL 40 Cb 0.37 -3.87 0.00 0.00 -0.91 0.00 0.00 33.84 29.43 1wtc n VAL 40 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wtc n ALA 41 N -4.46 -0.16 -3.81 3.52 0.00 -0.74 0.65 120.51 115.51 1wtc n ALA 41 Ca -0.17 -0.11 -0.34 0.00 0.00 0.00 0.00 53.44 52.82 1wtc n ALA 41 Cb 0.62 0.09 -0.15 0.00 0.00 0.00 0.00 19.45 20.01 1wtc n ALA 41 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wtc s GLU 42 N -2.01 3.07 -0.08 0.00 2.02 -0.86 -4.39 118.70 116.46 1wtc s GLU 42 Ca 0.01 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.21 1wtc s GLU 42 Cb -0.00 -2.83 -0.03 0.00 0.10 0.00 0.00 34.13 31.37 1wtc s GLU 42 CO 0.01 -0.26 -0.08 0.08 0.02 0.00 0.00 175.26 175.03 1wtc s VAL 43 N 1.36 3.55 -0.14 2.63 1.01 -1.26 -1.08 120.40 126.46 1wtc s VAL 43 Ca 0.04 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1wtc s VAL 43 Cb -0.14 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.79 1wtc s VAL 43 CO -0.07 0.58 -0.22 -0.36 0.00 0.00 0.00 175.10 175.03 1wtc s PHE 44 N -0.58 2.66 -0.30 5.22 0.08 0.35 -4.54 117.98 120.86 1wtc s PHE 44 Ca 0.09 -1.36 -0.08 0.00 0.12 0.00 0.00 56.93 55.70 1wtc s PHE 44 Cb -0.12 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 1wtc s PHE 44 CO 0.02 -0.62 0.11 -0.06 -0.10 0.00 0.00 175.22 174.57 1wtc s PHE 45 N 0.85 3.16 -0.43 0.36 0.08 -0.57 0.22 117.98 121.65 1wtc s PHE 45 Ca -0.06 -0.82 -0.21 0.00 0.12 0.00 0.00 56.93 55.96 1wtc s PHE 45 Cb -0.15 -2.30 0.02 0.00 -0.57 0.00 0.00 43.02 40.02 1wtc s PHE 45 CO -0.03 -0.53 0.69 0.21 -0.10 0.00 0.00 175.22 175.46 1wtc s LYS 46 N 1.55 3.36 -1.01 0.44 2.47 -0.46 -0.36 119.74 125.74 1wtc s LYS 46 Ca 0.03 -0.24 -0.15 0.00 -1.56 0.00 0.00 55.97 54.06 1wtc s LYS 46 Cb -0.17 -3.93 0.18 0.00 -1.46 0.00 0.00 37.83 32.45 1wtc s LYS 46 CO 0.04 -1.02 1.12 0.00 0.16 0.00 0.00 175.35 175.66 1wtc n GLU 48 N 5.20 0.81 0.19 0.00 -0.58 -0.34 -2.16 120.64 123.75 1wtc n GLU 48 Ca 0.25 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 57.14 1wtc n GLU 48 Cb 0.46 -1.50 0.57 0.00 -0.57 0.00 0.00 31.44 30.39 1wtc n GLU 48 CO 0.00 0.00 0.00 -2.95 -0.48 0.00 0.00 177.13 173.70 1wtc h ASN 49 N 0.00 0.00 -0.08 1.62 -1.07 -1.75 -2.10 115.58 112.21 1wtc h ASN 49 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 1wtc h ASN 49 Cb 0.04 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.29 1wtc h ASN 49 CO 0.00 0.00 0.00 0.49 0.07 0.00 0.00 177.43 177.99 1wtc n PHE 50 N -2.59 0.08 -1.30 4.14 3.72 -0.92 -4.40 117.46 116.20 1wtc n PHE 50 Ca 0.02 -0.04 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 1wtc n PHE 50 Cb 0.27 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.90 1wtc n PHE 50 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1wtc s GLN 51 N -1.92 2.17 0.27 -1.08 2.00 -0.80 -4.87 119.66 115.43 1wtc s GLN 51 Ca 0.33 1.07 -0.30 0.00 -2.00 0.00 0.00 55.36 54.47 1wtc s GLN 51 Cb 0.20 -1.89 -0.14 0.00 0.80 0.00 0.00 33.01 31.98 1wtc s GLN 51 CO 0.31 -1.67 1.25 1.63 -0.50 0.00 0.00 175.29 176.31 1wtc n LYS 52 N -3.53 1.78 -0.11 1.67 4.76 -1.26 -0.48 118.16 120.99 1wtc n LYS 52 Ca 0.08 0.63 0.00 0.00 -2.87 0.00 0.00 58.31 56.16 1wtc n LYS 52 Cb 0.54 -2.18 0.00 0.00 -1.84 0.00 0.00 35.03 31.55 1wtc n LYS 52 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wtc n MET 53 N 1.30 0.00 -0.38 1.97 0.00 -1.26 -3.84 117.12 114.90 1wtc n MET 53 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.80 1wtc n MET 53 Cb 0.32 -2.23 0.00 0.00 0.00 0.00 0.00 33.22 31.31 1wtc n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1wtc n GLY 54 N -2.00 0.78 3.39 3.17 0.00 0.37 -4.92 105.19 105.97 1wtc n GLY 54 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1wtc n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wtc s ALA 55 N -2.18 -1.29 0.50 4.61 0.00 -1.16 -1.04 121.76 121.20 1wtc s ALA 55 Ca 0.00 0.58 0.25 0.00 0.00 0.00 0.00 51.96 52.79 1wtc s ALA 55 Cb 0.00 0.36 1.32 0.00 0.00 0.00 0.00 23.12 24.80 1wtc s ALA 55 CO 0.00 -0.49 1.91 0.27 0.00 0.00 0.00 175.76 177.45 1wtc h PHE 56 N 2.84 0.18 -1.19 0.00 -5.15 -1.33 -2.87 116.94 109.42 1wtc h PHE 56 Ca -0.31 0.01 0.34 0.00 -0.20 0.00 0.00 57.97 57.81 1wtc h PHE 56 Cb 1.21 -0.06 -0.05 0.00 0.22 0.00 0.00 35.95 37.28 1wtc h PHE 56 CO 0.37 0.05 1.05 0.87 -2.00 0.00 0.00 178.31 178.66 1wtc h LYS 57 N 0.14 0.00 -0.83 6.09 1.79 -1.93 1.00 116.57 122.83 1wtc h LYS 57 Ca 0.39 0.00 0.11 0.00 -2.18 0.00 0.00 60.65 58.96 1wtc h LYS 57 Cb 1.32 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.91 1wtc h LYS 57 CO -0.06 0.00 0.54 0.35 -1.08 0.00 0.00 179.45 179.20 1wtc h PHE 58 N 0.00 0.81 0.86 -1.35 3.57 -1.76 -1.78 116.94 117.29 1wtc h PHE 58 Ca 0.56 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 62.05 1wtc h PHE 58 Cb 2.67 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 41.15 1wtc h PHE 58 CO 0.00 0.36 -0.46 0.00 -2.23 0.00 0.00 178.31 175.98 1wtc h ARG 59 N 0.74 -1.17 -0.70 1.11 3.08 -1.06 -0.03 114.38 116.35 1wtc h ARG 59 Ca 0.39 0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.48 1wtc h ARG 59 Cb 0.50 0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 1wtc h ARG 59 CO -0.16 -0.78 0.27 0.78 -1.07 0.00 0.00 179.97 179.01 1wtc h GLY 60 N -1.22 1.10 0.82 0.04 0.00 -1.67 -0.77 103.07 101.38 1wtc h GLY 60 Ca -0.12 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.62 1wtc h GLY 60 CO 0.16 0.55 -0.06 0.00 0.00 0.00 0.00 176.54 177.19 1wtc h ALA 61 N 1.29 -0.17 -0.24 3.60 0.00 -1.29 -1.31 119.26 121.14 1wtc h ALA 61 Ca 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1wtc h ALA 61 Cb 0.20 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wtc h ALA 61 CO -0.02 -0.50 0.14 1.25 0.00 0.00 0.00 179.25 180.12 1wtc h LEU 62 N -0.35 0.29 -0.63 0.00 5.85 -0.88 -0.30 115.31 119.29 1wtc h LEU 62 Ca -0.02 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.71 1wtc h LEU 62 Cb 0.28 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1wtc h LEU 62 CO 0.03 0.28 0.31 -1.13 -0.34 0.00 0.00 178.44 177.59 1wtc h ASN 63 N 0.29 0.42 -0.30 1.25 -1.24 -1.11 0.11 115.58 115.01 1wtc h ASN 63 Ca 0.09 0.05 -0.08 0.00 0.71 0.00 0.00 56.30 57.07 1wtc h ASN 63 Cb 0.04 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 1wtc h ASN 63 CO -0.01 0.27 -0.11 0.00 -1.29 0.00 0.00 177.43 176.28 1wtc h ALA 64 N 1.37 0.41 0.00 1.57 0.00 -0.96 -3.13 119.26 118.52 1wtc h ALA 64 Ca 0.30 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1wtc h ALA 64 Cb 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1wtc h ALA 64 CO -0.22 0.27 -0.39 -0.07 0.00 0.00 0.00 179.25 178.84 1wtc h LEU 65 N 0.36 0.00 0.00 0.00 3.38 -0.70 -2.46 115.31 115.89 1wtc h LEU 65 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1wtc h LEU 65 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1wtc h LEU 65 CO 0.04 0.39 0.00 -1.20 0.09 0.00 0.00 178.44 177.76 1wtc n SER 66 N -3.82 0.00 -0.76 -0.43 7.64 0.34 -2.83 113.62 113.77 1wtc n SER 66 Ca -0.01 0.41 0.08 0.00 1.01 0.00 0.00 58.87 60.36 1wtc n SER 66 Cb 0.46 -0.46 0.22 0.00 -1.01 0.00 0.00 64.21 63.41 1wtc n SER 66 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wtc n GLN 67 N -1.46 2.84 -3.15 1.43 6.02 -0.92 -5.01 117.38 117.13 1wtc n GLN 67 Ca 0.05 -2.57 -0.31 0.00 -0.01 0.00 0.00 57.00 54.17 1wtc n GLN 67 Cb 0.19 -1.64 -0.04 0.00 1.02 0.00 0.00 30.24 29.77 1wtc n GLN 67 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wtc s LEU 68 N -2.25 4.01 0.68 1.08 1.43 -1.13 -5.08 118.68 117.42 1wtc s LEU 68 Ca 0.35 1.01 -0.10 0.00 -1.03 0.00 0.00 54.13 54.36 1wtc s LEU 68 Cb 0.27 -3.84 0.02 0.00 0.03 0.00 0.00 46.19 42.67 1wtc s LEU 68 CO 0.10 -0.24 1.05 0.54 0.23 0.00 0.00 176.35 178.03 1wtc s ASN 69 N -2.81 5.42 0.22 2.29 2.20 -1.26 -4.81 114.94 116.19 1wtc s ASN 69 Ca 0.49 0.99 -0.10 0.00 -0.94 0.00 0.00 52.86 53.31 1wtc s ASN 69 Cb -0.11 -1.82 0.32 0.00 -2.00 0.00 0.00 41.25 37.65 1wtc s ASN 69 CO 0.26 -1.31 1.67 -0.08 -2.94 0.00 0.00 177.10 174.71 1wtc h GLU 70 N -0.55 0.16 -0.48 3.55 4.57 -1.98 -0.34 114.58 119.51 1wtc h GLU 70 Ca -0.45 -0.01 0.05 0.00 -1.18 0.00 0.00 59.36 57.77 1wtc h GLU 70 Cb 1.26 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.77 1wtc h GLU 70 CO 0.63 0.11 0.23 0.00 -1.18 0.00 0.00 179.01 178.79 1wtc h ALA 71 N 1.55 0.60 -0.48 2.92 0.00 -1.99 0.60 119.26 122.47 1wtc h ALA 71 Ca 0.34 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.20 1wtc h ALA 71 Cb 0.54 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1wtc h ALA 71 CO -0.50 -0.14 0.00 1.96 0.00 0.00 0.00 179.25 180.57 1wtc h GLN 72 N 0.44 0.85 -0.51 0.00 4.20 -1.70 -0.87 115.11 117.52 1wtc h GLN 72 Ca 0.21 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1wtc h GLN 72 Cb 0.15 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1wtc h GLN 72 CO -0.17 0.89 0.19 0.00 -0.67 0.00 0.00 178.83 179.07 1wtc h ARG 73 N 0.70 0.74 -0.02 1.46 3.08 -0.62 0.21 114.38 119.95 1wtc h ARG 73 Ca 0.14 -0.11 -0.22 0.00 0.07 0.00 0.00 59.98 59.85 1wtc h ARG 73 Cb 0.51 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1wtc h ARG 73 CO 0.02 0.63 -0.91 0.87 -1.07 0.00 0.00 179.97 179.51 1wtc h LYS 74 N 0.73 0.43 -0.17 0.04 1.57 -0.70 -3.26 116.57 115.21 1wtc h LYS 74 Ca 0.17 -0.45 -0.19 0.00 -1.87 0.00 0.00 60.65 58.31 1wtc h LYS 74 Cb 0.17 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1wtc h LYS 74 CO -0.01 1.10 -0.67 0.00 -0.57 0.00 0.00 179.45 179.30 1wtc h ALA 75 N 0.75 0.48 0.00 3.86 0.00 -0.73 -3.45 119.26 120.17 1wtc h ALA 75 Ca -0.07 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1wtc h ALA 75 Cb 1.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1wtc h ALA 75 CO 0.16 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.52 1wtc n GLY 76 N 0.50 1.17 3.63 0.00 0.00 0.72 -4.79 105.19 106.42 1wtc n GLY 76 Ca -0.05 -2.08 -0.28 0.00 0.00 0.00 0.00 46.02 43.60 1wtc n GLY 76 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wtc s VAL 77 N -1.62 1.80 -0.08 1.61 -7.23 -0.20 -1.50 120.40 113.18 1wtc s VAL 77 Ca 0.00 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.08 1wtc s VAL 77 Cb 0.00 -2.84 0.02 0.00 0.56 0.00 0.00 36.38 34.12 1wtc s VAL 77 CO 0.00 0.00 0.24 -0.22 -0.31 0.00 0.00 175.10 174.81 1wtc s LEU 78 N -3.72 1.10 0.05 1.32 0.20 -0.32 -1.67 118.68 115.64 1wtc s LEU 78 Ca 0.30 0.40 0.02 0.00 0.69 0.00 0.00 54.13 55.54 1wtc s LEU 78 Cb 0.08 0.85 -0.03 0.00 -0.43 0.00 0.00 46.19 46.67 1wtc s LEU 78 CO 0.15 -0.14 -0.08 0.28 -0.29 0.00 0.00 176.35 176.28 1wtc s THR 79 N -0.11 0.60 -0.00 3.68 -1.32 -0.42 -4.33 115.64 113.73 1wtc s THR 79 Ca -0.02 -1.20 0.00 0.00 -1.21 0.00 0.00 61.69 59.26 1wtc s THR 79 Cb -0.02 -0.77 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 1wtc s THR 79 CO 0.01 -0.43 0.59 2.22 -2.21 0.00 0.00 174.62 174.79 1wtc n PHE 80 N 1.26 0.00 -2.24 9.09 1.16 -1.26 -0.87 117.46 124.60 1wtc n PHE 80 Ca -0.21 -0.04 -0.40 0.00 -1.87 0.00 0.00 57.45 54.93 1wtc n PHE 80 Cb 0.55 -0.01 -0.02 0.00 -1.61 0.00 0.00 39.48 38.39 1wtc n PHE 80 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1wtc s SER 81 N -0.19 6.78 0.00 5.98 0.15 -1.26 -4.90 113.70 120.26 1wtc s SER 81 Ca 0.00 2.50 0.28 0.00 0.70 0.00 0.00 55.95 59.44 1wtc s SER 81 Cb 0.00 -2.63 1.16 0.00 -1.71 0.00 0.00 66.02 62.84 1wtc s SER 81 CO 0.00 -0.51 1.81 -1.54 1.20 0.00 0.00 173.24 174.20 1wtc n SER 82 N 0.64 1.20 -2.14 5.45 3.41 -1.26 -4.47 113.62 116.45 1wtc n SER 82 Ca 0.01 -1.34 -0.01 0.00 -0.26 0.00 0.00 58.87 57.27 1wtc n SER 82 Cb 0.44 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1wtc n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wtc n GLY 83 N 1.17 2.20 0.32 5.00 0.00 -1.26 -4.99 105.19 107.63 1wtc n GLY 83 Ca 0.19 -2.14 0.20 0.00 0.00 0.00 0.00 46.02 44.27 1wtc n GLY 83 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1wtc h ASN 84 N 0.01 0.00 -0.74 1.61 2.35 -1.97 -2.58 115.58 114.26 1wtc h ASN 84 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1wtc h ASN 84 Cb 0.06 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 1wtc h ASN 84 CO 0.02 0.00 0.47 -0.74 -1.65 0.00 0.00 177.43 175.53 1wtc h HIS 85 N 0.00 0.96 -0.14 1.19 2.76 -1.94 -1.31 115.15 116.68 1wtc h HIS 85 Ca 0.00 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 1wtc h HIS 85 Cb 0.18 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 28.79 1wtc h HIS 85 CO 0.00 0.62 -0.04 0.00 -1.30 0.00 0.00 177.93 177.21 1wtc h ALA 86 N 1.50 0.09 0.00 5.26 0.00 -1.68 0.11 119.26 124.53 1wtc h ALA 86 Ca 0.27 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1wtc h ALA 86 Cb -0.08 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1wtc h ALA 86 CO -0.05 -0.49 -0.23 1.96 0.00 0.00 0.00 179.25 180.44 1wtc h GLN 87 N -0.01 0.00 -0.27 0.00 7.50 -1.70 -0.63 115.11 120.01 1wtc h GLN 87 Ca 0.07 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.17 1wtc h GLN 87 Cb 0.11 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.63 1wtc h GLN 87 CO -0.14 0.23 0.01 0.00 -1.50 0.00 0.00 178.83 177.43 1wtc h ALA 88 N 1.77 0.37 -0.28 3.87 0.00 -0.57 -1.34 119.26 123.08 1wtc h ALA 88 Ca -0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1wtc h ALA 88 Cb 0.98 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1wtc h ALA 88 CO 0.03 0.10 0.02 0.82 0.00 0.00 0.00 179.25 180.22 1wtc h ILE 89 N 0.27 1.25 -0.23 0.00 1.08 -0.64 -1.67 117.51 117.56 1wtc h ILE 89 Ca 0.08 -0.87 0.05 0.00 -0.39 0.00 0.00 64.86 63.72 1wtc h ILE 89 Cb 0.41 1.28 -0.04 0.00 -3.07 0.00 0.00 36.82 35.39 1wtc h ILE 89 CO 0.01 0.28 -0.06 0.00 -0.69 0.00 0.00 178.15 177.69 1wtc h ALA 90 N 0.84 0.15 -0.30 1.87 0.00 -0.96 0.67 119.26 121.53 1wtc h ALA 90 Ca 0.08 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1wtc h ALA 90 Cb 0.39 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1wtc h ALA 90 CO 0.01 -0.47 -0.26 1.25 0.00 0.00 0.00 179.25 179.78 1wtc h LEU 91 N -0.00 0.75 -0.35 0.00 5.85 -1.25 -2.15 115.31 118.16 1wtc h LEU 91 Ca 0.11 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.38 1wtc h LEU 91 Cb 0.17 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1wtc h LEU 91 CO -0.24 1.05 0.22 0.28 -0.34 0.00 0.00 178.44 179.42 1wtc h SER 92 N 0.47 0.40 -0.79 1.25 0.02 -1.09 -0.74 113.55 113.08 1wtc h SER 92 Ca 0.05 -0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1wtc h SER 92 Cb 0.82 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.21 1wtc h SER 92 CO 0.07 0.31 0.49 0.00 -1.14 0.00 0.00 176.83 176.56 1wtc h ALA 93 N 1.11 1.05 -0.49 3.77 0.00 -0.81 -0.30 119.26 123.59 1wtc h ALA 93 Ca 0.13 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1wtc h ALA 93 Cb -0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1wtc h ALA 93 CO -0.03 0.28 0.07 -0.22 0.00 0.00 0.00 179.25 179.35 1wtc h LYS 94 N 0.94 0.82 -0.85 0.00 3.64 -1.07 0.47 116.57 120.52 1wtc h LYS 94 Ca 0.33 -0.23 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1wtc h LYS 94 Cb 0.07 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 1wtc h LYS 94 CO -0.13 0.83 0.56 0.82 -2.27 0.00 0.00 179.45 179.26 1wtc h ILE 95 N 0.70 1.19 -0.16 2.00 2.04 -0.38 -2.51 117.51 120.39 1wtc h ILE 95 Ca 0.15 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1wtc h ILE 95 Cb 0.41 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1wtc h ILE 95 CO 0.01 0.20 0.00 0.18 0.00 0.00 0.00 178.15 178.55 1wtc n LEU 96 N -4.42 1.95 -0.91 1.44 4.77 -0.19 -4.94 117.00 114.70 1wtc n LEU 96 Ca 0.10 -0.78 -0.08 0.00 -0.03 0.00 0.00 56.01 55.22 1wtc n LEU 96 Cb 0.05 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1wtc n LEU 96 CO 0.36 0.39 -0.10 0.61 -1.33 0.00 0.00 177.39 177.32 1wtc n GLY 97 N 1.20 0.22 3.62 -0.72 0.00 -0.26 -5.03 105.19 104.22 1wtc n GLY 97 Ca 0.17 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1wtc n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wtc s ILE 98 N -2.40 4.63 0.38 -0.61 1.01 0.15 -4.93 121.20 119.43 1wtc s ILE 98 Ca 0.00 -0.09 -0.26 0.00 0.00 0.00 0.00 60.65 60.30 1wtc s ILE 98 Cb 0.00 -3.07 -0.09 0.00 0.01 0.00 0.00 42.46 39.31 1wtc s ILE 98 CO 0.00 0.47 1.19 -2.16 0.00 0.00 0.00 174.94 174.45 1wtc s PRO 99 N 0.31 4.14 -0.04 2.79 0.04 -1.26 -4.09 135.00 136.88 1wtc s PRO 99 Ca 0.02 1.92 0.01 0.00 0.04 0.00 0.00 61.00 62.99 1wtc s PRO 99 Cb -0.13 -2.79 0.02 0.00 0.04 0.00 0.00 34.50 31.65 1wtc s PRO 99 CO 0.01 -0.27 -0.04 0.00 0.04 0.00 0.00 177.00 176.74 1wtc s ALA 100 N -1.34 0.67 -0.14 8.56 0.00 -1.26 -1.03 121.76 127.21 1wtc s ALA 100 Ca 0.55 -0.05 -0.03 0.00 0.00 0.00 0.00 51.96 52.42 1wtc s ALA 100 Cb -0.33 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 1wtc s ALA 100 CO 0.42 -0.03 -0.03 0.15 0.00 0.00 0.00 175.76 176.27 1wtc s LYS 101 N 0.95 3.57 -0.21 0.00 1.02 -0.67 -0.38 119.74 124.03 1wtc s LYS 101 Ca -0.11 -0.50 0.02 0.00 0.02 0.00 0.00 55.97 55.40 1wtc s LYS 101 Cb -0.14 -2.90 0.04 0.00 -0.52 0.00 0.00 37.83 34.30 1wtc s LYS 101 CO -0.00 0.31 -0.16 0.42 -0.92 0.00 0.00 175.35 175.00 1wtc s ILE 102 N 0.17 2.02 -0.22 2.17 -1.09 0.28 -1.31 121.20 123.24 1wtc s ILE 102 Ca -0.01 -1.15 -0.23 0.00 -2.23 0.00 0.00 60.65 57.03 1wtc s ILE 102 Cb -0.14 -1.96 -0.01 0.00 -1.58 0.00 0.00 42.46 38.77 1wtc s ILE 102 CO 0.03 0.31 0.75 -0.63 -1.23 0.00 0.00 174.94 174.17 1wtc s ILE 103 N 1.25 4.91 0.08 2.92 1.01 -0.05 -1.06 121.20 130.27 1wtc s ILE 103 Ca -0.00 1.42 0.04 0.00 0.00 0.00 0.00 60.65 62.11 1wtc s ILE 103 Cb -0.16 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1wtc s ILE 103 CO -0.10 0.01 -0.10 -0.04 0.00 0.00 0.00 174.94 174.71 1wtc s MET 104 N 2.40 0.78 0.55 2.79 -1.94 0.13 -4.56 119.30 119.44 1wtc s MET 104 Ca 0.33 -1.05 -0.20 0.00 -1.71 0.00 0.00 55.69 53.06 1wtc s MET 104 Cb -0.16 -0.52 -0.05 0.00 2.01 0.00 0.00 34.83 36.11 1wtc s MET 104 CO 0.09 0.09 1.16 -2.14 -0.01 0.00 0.00 175.02 174.21 1wtc s PRO 105 N -2.41 3.29 0.47 2.03 0.02 -1.26 -1.38 135.00 135.76 1wtc s PRO 105 Ca 0.01 1.71 0.20 0.00 0.02 0.00 0.00 61.00 62.94 1wtc s PRO 105 Cb -0.05 -2.03 1.20 0.00 0.02 0.00 0.00 34.50 33.63 1wtc s PRO 105 CO 0.00 -0.92 1.95 -0.07 -0.33 0.00 0.00 177.00 177.63 1wtc h LEU 106 N 1.21 0.23 -3.72 -5.54 3.38 -1.30 -1.52 115.31 108.05 1wtc h LEU 106 Ca -0.50 0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.24 1wtc h LEU 106 Cb 1.27 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 41.85 1wtc h LEU 106 CO 0.57 0.12 0.28 -0.90 0.09 0.00 0.00 178.44 178.59 1wtc n ASP 107 N -4.43 4.49 -4.69 -0.43 5.75 -1.26 -5.01 116.55 110.97 1wtc n ASP 107 Ca 0.12 -3.30 -0.39 0.00 -0.01 0.00 0.00 54.79 51.21 1wtc n ASP 107 Cb 0.56 -0.74 0.04 0.00 -1.03 0.00 0.00 41.12 39.95 1wtc n ASP 107 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wtc n ALA 108 N -0.37 1.08 -1.67 2.12 0.00 -0.57 -4.87 120.51 116.22 1wtc n ALA 108 Ca 0.42 0.13 -0.44 0.00 0.00 0.00 0.00 53.44 53.54 1wtc n ALA 108 Cb 1.37 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.54 1wtc n ALA 108 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1wtc n PRO 109 N -0.74 2.04 -0.12 0.00 -0.02 -1.26 -4.82 135.00 130.08 1wtc n PRO 109 Ca 0.11 0.72 -0.08 0.00 -2.02 0.00 0.00 63.50 62.23 1wtc n PRO 109 Cb 0.44 -2.37 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 1wtc n PRO 109 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1wtc h GLU 110 N 3.96 -0.27 -0.88 -0.52 5.08 -2.00 -1.53 114.58 118.42 1wtc h GLU 110 Ca -0.45 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.08 1wtc h GLU 110 Cb 1.28 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 30.49 1wtc h GLU 110 CO 0.74 -0.18 0.47 0.00 -1.00 0.00 0.00 179.01 179.04 1wtc h ALA 111 N 0.65 1.36 -0.38 3.43 0.00 -1.99 0.89 119.26 123.22 1wtc h ALA 111 Ca 0.16 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 1wtc h ALA 111 Cb 0.56 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1wtc h ALA 111 CO -0.55 -0.08 -0.27 -0.22 0.00 0.00 0.00 179.25 178.13 1wtc h LYS 112 N 0.65 0.80 -0.33 0.00 3.64 -1.69 -0.10 116.57 119.55 1wtc h LYS 112 Ca 0.49 -0.35 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1wtc h LYS 112 Cb 0.70 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1wtc h LYS 112 CO -0.37 0.97 -0.01 0.28 -2.27 0.00 0.00 179.45 178.06 1wtc h VAL 113 N 0.69 1.26 -0.54 2.00 2.07 -0.26 -1.48 116.25 119.99 1wtc h VAL 113 Ca 0.08 -0.98 -0.07 0.00 0.82 0.00 0.00 66.70 66.56 1wtc h VAL 113 Cb 0.80 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1wtc h VAL 113 CO 0.07 0.32 0.07 0.00 0.02 0.00 0.00 177.57 178.04 1wtc h ALA 114 N 0.84 1.10 -0.38 1.67 0.00 -0.77 -1.31 119.26 120.42 1wtc h ALA 114 Ca 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1wtc h ALA 114 Cb 0.46 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1wtc h ALA 114 CO 0.02 0.58 0.13 0.00 0.00 0.00 0.00 179.25 179.98 1wtc h ALA 115 N 1.25 0.49 -0.52 0.00 0.00 -0.85 0.14 119.26 119.77 1wtc h ALA 115 Ca 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1wtc h ALA 115 Cb 0.39 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1wtc h ALA 115 CO 0.01 0.12 0.30 1.15 0.00 0.00 0.00 179.25 180.83 1wtc h THR 116 N 0.46 1.17 0.00 0.00 2.02 -0.99 -0.59 112.91 114.98 1wtc h THR 116 Ca 0.12 -0.39 -0.11 0.00 0.77 0.00 0.00 66.41 66.79 1wtc h THR 116 Cb 0.23 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1wtc h THR 116 CO -0.01 0.17 -0.54 0.11 0.37 0.00 0.00 175.52 175.62 1wtc h LYS 117 N 0.69 0.00 0.00 6.66 1.57 -1.10 -1.08 116.57 123.31 1wtc h LYS 117 Ca 0.18 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1wtc h LYS 117 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1wtc h LYS 117 CO -0.03 0.54 -0.24 0.78 -0.57 0.00 0.00 179.45 179.93 1wtc h GLY 118 N 2.04 0.00 -1.58 3.86 0.00 -0.02 -1.24 103.07 106.13 1wtc h GLY 118 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1wtc h GLY 118 CO 0.07 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.89 1wtc n TYR 119 N -3.65 0.60 -1.02 5.60 4.01 -0.29 -4.91 117.16 117.51 1wtc n TYR 119 Ca -0.01 -0.28 -0.01 0.00 -0.16 0.00 0.00 57.90 57.44 1wtc n TYR 119 Cb 0.37 -0.04 -0.00 0.00 -0.31 0.00 0.00 39.34 39.36 1wtc n TYR 119 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wtc n GLY 120 N 1.05 0.46 3.76 2.72 0.00 -0.47 -4.51 105.19 108.21 1wtc n GLY 120 Ca 0.14 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1wtc n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wtc s GLY 121 N -2.18 2.99 -0.49 -0.02 0.00 -0.47 -4.69 107.32 102.46 1wtc s GLY 121 Ca 0.00 0.88 -0.20 0.00 0.00 0.00 0.00 44.72 45.40 1wtc s GLY 121 CO 0.00 1.44 0.65 1.20 0.00 0.00 0.00 173.10 176.39 1wtc s GLN 122 N -1.71 3.18 -0.04 2.90 -0.21 0.48 -4.43 119.66 119.83 1wtc s GLN 122 Ca 0.48 -0.68 -0.29 0.00 0.02 0.00 0.00 55.36 54.89 1wtc s GLN 122 Cb -0.30 -4.05 -0.03 0.00 1.00 0.00 0.00 33.01 29.64 1wtc s GLN 122 CO 0.39 -1.17 0.95 0.08 -2.12 0.00 0.00 175.29 173.41 1wtc s VAL 123 N 2.78 4.87 -0.16 1.09 1.01 -1.26 -0.55 120.40 128.18 1wtc s VAL 123 Ca 0.18 1.97 0.02 0.00 0.00 0.00 0.00 61.98 64.15 1wtc s VAL 123 Cb -0.17 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 31.95 1wtc s VAL 123 CO 0.15 0.13 -0.20 -0.63 0.00 0.00 0.00 175.10 174.54 1wtc s ILE 124 N 1.28 1.99 0.19 2.22 1.01 -0.22 -4.94 121.20 122.72 1wtc s ILE 124 Ca 0.49 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 60.27 1wtc s ILE 124 Cb -0.20 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1wtc s ILE 124 CO 0.24 0.53 0.26 -0.04 0.00 0.00 0.00 174.94 175.93 1wtc s MET 125 N 1.12 3.25 0.07 2.79 -1.94 -1.26 -0.69 119.30 122.64 1wtc s MET 125 Ca 0.00 -0.76 -0.04 0.00 -1.71 0.00 0.00 55.69 53.17 1wtc s MET 125 Cb -0.14 -2.82 -0.02 0.00 2.01 0.00 0.00 34.83 33.86 1wtc s MET 125 CO -0.08 0.47 0.07 1.52 -0.01 0.00 0.00 175.02 176.99 1wtc s TYR 126 N -1.86 0.35 -0.22 -0.03 -0.85 -0.48 -4.90 117.35 109.36 1wtc s TYR 126 Ca 0.33 -0.85 -0.29 0.00 -0.52 0.00 0.00 57.07 55.75 1wtc s TYR 126 Cb -0.10 -0.24 0.01 0.00 0.38 0.00 0.00 41.96 42.01 1wtc s TYR 126 CO 0.27 -0.45 1.07 0.34 -1.52 0.00 0.00 175.55 175.26 1wtc s ASP 127 N -2.89 7.08 0.35 -0.18 2.15 -1.26 -0.75 116.67 121.16 1wtc s ASP 127 Ca 0.06 1.43 0.07 0.00 0.43 0.00 0.00 52.55 54.54 1wtc s ASP 127 Cb 0.06 -2.54 0.77 0.00 -0.30 0.00 0.00 42.92 40.91 1wtc s ASP 127 CO -0.10 -0.68 1.88 0.08 -0.17 0.00 0.00 175.17 176.17 1wtc h ARG 128 N 7.56 0.73 0.00 4.34 0.11 -1.95 -1.02 114.38 124.14 1wtc h ARG 128 Ca -0.20 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 59.82 1wtc h ARG 128 Cb 1.07 -0.16 -0.00 0.00 1.11 0.00 0.00 29.97 31.98 1wtc h ARG 128 CO 0.98 0.48 -0.05 1.88 0.10 0.00 0.00 179.97 183.36 1wtc h TYR 129 N 0.75 0.00 -3.10 4.08 0.05 -2.05 -3.21 116.97 113.49 1wtc h TYR 129 Ca 0.44 0.00 -0.63 0.00 0.05 0.00 0.00 58.73 58.59 1wtc h TYR 129 Cb 0.62 0.00 -0.41 0.00 1.01 0.00 0.00 36.73 37.95 1wtc h TYR 129 CO -0.00 0.05 -0.53 1.17 -1.05 0.00 0.00 178.16 177.80 1wtc n LYS 130 N -3.47 1.92 -1.77 4.88 4.81 -0.39 -5.01 118.16 119.13 1wtc n LYS 130 Ca -0.02 -4.50 -0.36 0.00 -0.87 0.00 0.00 58.31 52.56 1wtc n LYS 130 Cb 0.17 -2.30 -0.05 0.00 0.02 0.00 0.00 35.03 32.86 1wtc n LYS 130 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1wtc n ASP 131 N 1.97 3.09 -1.92 3.14 2.03 -1.21 -4.59 116.55 119.05 1wtc n ASP 131 Ca 0.20 -2.72 -0.21 0.00 0.52 0.00 0.00 54.79 52.58 1wtc n ASP 131 Cb 0.35 -1.51 0.15 0.00 -0.72 0.00 0.00 41.12 39.39 1wtc n ASP 131 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1wtc n ASP 132 N 10.92 4.45 0.15 1.67 5.75 -1.26 -4.74 116.55 133.49 1wtc n ASP 132 Ca 0.47 -3.72 -0.16 0.00 -0.01 0.00 0.00 54.79 51.37 1wtc n ASP 132 Cb 0.44 -0.77 -0.10 0.00 -1.03 0.00 0.00 41.12 39.67 1wtc n ASP 132 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1wtc h ARG 133 N 1.36 -0.76 -0.76 0.11 3.08 -1.96 -1.22 114.38 114.23 1wtc h ARG 133 Ca 0.48 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.73 1wtc h ARG 133 Cb 1.89 0.17 -0.09 0.00 0.08 0.00 0.00 29.97 32.01 1wtc h ARG 133 CO 0.98 -0.50 0.32 0.93 -1.07 0.00 0.00 179.97 180.63 1wtc h GLU 134 N -0.79 0.45 -0.06 0.04 5.08 -1.95 0.54 114.58 117.90 1wtc h GLU 134 Ca -0.02 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1wtc h GLU 134 Cb 0.76 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 1wtc h GLU 134 CO -0.23 0.30 -0.13 -0.22 -1.00 0.00 0.00 179.01 177.74 1wtc h LYS 135 N 0.47 -0.18 -0.67 2.33 3.64 -1.83 0.81 116.57 121.14 1wtc h LYS 135 Ca 0.42 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.79 1wtc h LYS 135 Cb 0.62 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 1wtc h LYS 135 CO -0.39 -0.12 0.36 0.52 -2.27 0.00 0.00 179.45 177.55 1wtc h MET 136 N -0.19 0.94 -0.78 1.90 2.86 0.14 -1.95 114.93 117.86 1wtc h MET 136 Ca 0.06 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1wtc h MET 136 Cb 0.27 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.71 1wtc h MET 136 CO -0.17 0.72 0.48 0.00 1.06 0.00 0.00 176.91 179.00 1wtc h ALA 137 N 1.18 0.99 -0.20 6.32 0.00 0.57 0.18 119.26 128.30 1wtc h ALA 137 Ca 0.24 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1wtc h ALA 137 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1wtc h ALA 137 CO -0.04 0.44 -0.08 -0.22 0.00 0.00 0.00 179.25 179.36 1wtc h LYS 138 N 1.06 0.41 -0.07 0.00 3.64 -0.60 -0.17 116.57 120.85 1wtc h LYS 138 Ca 0.28 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1wtc h LYS 138 Cb -0.06 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1wtc h LYS 138 CO -0.05 0.69 0.01 1.49 -2.27 0.00 0.00 179.45 179.32 1wtc h GLU 139 N 0.11 0.04 -0.14 1.90 4.22 -1.15 -1.81 114.58 117.76 1wtc h GLU 139 Ca 0.05 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.45 1wtc h GLU 139 Cb 0.55 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1wtc h GLU 139 CO 0.03 0.03 -0.06 0.82 -2.18 0.00 0.00 179.01 177.64 1wtc h ILE 140 N 0.04 1.31 -0.42 2.32 2.04 -0.97 -2.26 117.51 119.58 1wtc h ILE 140 Ca 0.03 -1.08 -0.06 0.00 1.00 0.00 0.00 64.86 64.75 1wtc h ILE 140 Cb 0.02 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1wtc h ILE 140 CO -0.04 0.31 0.02 0.77 0.00 0.00 0.00 178.15 179.21 1wtc h SER 141 N -0.04 0.63 -0.04 1.72 4.64 -1.01 -1.43 113.55 118.02 1wtc h SER 141 Ca 0.03 -0.13 -0.24 0.00 -0.47 0.00 0.00 61.79 60.98 1wtc h SER 141 Cb 0.52 -0.17 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1wtc h SER 141 CO 0.02 0.69 -0.91 -0.33 -0.87 0.00 0.00 176.83 175.44 1wtc h GLU 142 N 0.64 0.72 -0.16 4.77 5.08 -1.37 0.22 114.58 124.48 1wtc h GLU 142 Ca 0.13 -0.67 -0.12 0.00 -1.00 0.00 0.00 59.36 57.70 1wtc h GLU 142 Cb 0.37 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1wtc h GLU 142 CO 0.01 1.27 -0.40 -0.09 -1.00 0.00 0.00 179.01 178.80 1wtc h ARG 143 N 0.45 0.37 -0.26 2.33 2.43 -1.26 -3.21 114.38 115.23 1wtc h ARG 143 Ca -0.09 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1wtc h ARG 143 Cb 1.54 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.09 1wtc h ARG 143 CO 0.18 0.71 0.00 0.39 -1.51 0.00 0.00 179.97 179.74 1wtc n GLU 144 N -4.03 2.00 -3.30 0.20 1.02 -0.55 -4.99 120.64 111.00 1wtc n GLU 144 Ca -0.01 -1.85 -0.21 0.00 -0.02 0.00 0.00 57.16 55.07 1wtc n GLU 144 Cb 0.49 -1.33 0.06 0.00 -0.02 0.00 0.00 31.44 30.64 1wtc n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wtc n GLY 145 N 0.88 -0.40 3.86 0.62 0.00 -0.25 -4.91 105.19 104.99 1wtc n GLY 145 Ca 0.13 0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 1wtc n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wtc s LEU 146 N -6.47 4.23 -0.13 0.99 1.43 0.63 -4.65 118.68 114.71 1wtc s LEU 146 Ca 0.44 1.01 -0.08 0.00 -1.03 0.00 0.00 54.13 54.47 1wtc s LEU 146 Cb -0.19 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 1wtc s LEU 146 CO 0.54 -0.01 0.14 -0.89 0.23 0.00 0.00 176.35 176.37 1wtc s THR 147 N -1.68 5.48 -0.23 5.49 2.01 -0.56 -4.70 115.64 121.45 1wtc s THR 147 Ca 0.44 0.22 -0.02 0.00 0.31 0.00 0.00 61.69 62.63 1wtc s THR 147 Cb -0.13 -3.42 0.01 0.00 0.01 0.00 0.00 72.50 68.98 1wtc s THR 147 CO 0.20 0.59 -0.06 -0.63 -0.69 0.00 0.00 174.62 174.02 1wtc s ILE 148 N -0.77 3.01 -0.21 1.82 1.01 -1.26 -1.17 121.20 123.63 1wtc s ILE 148 Ca 0.14 -0.80 -0.17 0.00 0.00 0.00 0.00 60.65 59.82 1wtc s ILE 148 Cb -0.12 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 1wtc s ILE 148 CO 0.03 0.32 0.44 -0.63 0.00 0.00 0.00 174.94 175.09 1wtc s ILE 149 N 1.39 5.16 0.35 2.92 -1.09 -1.26 -5.04 121.20 123.62 1wtc s ILE 149 Ca 0.03 0.77 -0.27 0.00 -2.23 0.00 0.00 60.65 58.95 1wtc s ILE 149 Cb -0.15 -3.76 -0.12 0.00 -1.58 0.00 0.00 42.46 36.84 1wtc s ILE 149 CO -0.05 0.21 1.25 -2.65 -1.23 0.00 0.00 174.94 172.47 1wtc n PRO 150 N 4.72 1.99 0.23 2.79 -0.02 -1.26 -4.88 135.00 138.57 1wtc n PRO 150 Ca -0.07 0.70 0.16 0.00 -2.02 0.00 0.00 63.50 62.27 1wtc n PRO 150 Cb 0.51 -2.27 0.71 0.00 -0.02 0.00 0.00 33.50 32.42 1wtc n PRO 150 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1wtc h PRO 151 N 2.39 0.00 0.00 0.52 0.13 -1.98 -3.42 132.00 129.64 1wtc h PRO 151 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1wtc h PRO 151 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1wtc h PRO 151 CO 0.62 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.87 1wtc n TYR 152 N -2.76 0.00 -1.63 1.56 0.18 -1.26 -4.90 117.16 108.36 1wtc n TYR 152 Ca 0.00 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.38 1wtc n TYR 152 Cb 0.22 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.16 1wtc n TYR 152 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 1wtc n ASP 153 N -1.34 7.13 -3.75 9.48 2.03 -1.26 -4.31 116.55 124.52 1wtc n ASP 153 Ca 0.00 -2.79 -0.12 0.00 0.52 0.00 0.00 54.79 52.40 1wtc n ASP 153 Cb 0.00 -1.54 -0.12 0.00 -0.72 0.00 0.00 41.12 38.74 1wtc n ASP 153 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1wtc s HIS 154 N 1.67 -0.32 0.32 -0.67 2.46 -1.26 -4.85 115.29 112.63 1wtc s HIS 154 Ca 0.59 0.77 0.03 0.00 0.47 0.00 0.00 55.06 56.91 1wtc s HIS 154 Cb 0.16 0.09 0.61 0.00 -0.13 0.00 0.00 32.58 33.30 1wtc s HIS 154 CO -0.07 -0.19 1.93 -1.00 -2.47 0.00 0.00 174.74 172.94 1wtc h PRO 155 N 6.48 0.90 -0.12 2.88 0.13 -1.95 -1.40 132.00 138.93 1wtc h PRO 155 Ca -0.33 -0.05 -0.19 0.00 -0.87 0.00 0.00 66.00 64.56 1wtc h PRO 155 Cb 1.18 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.10 1wtc h PRO 155 CO 0.36 0.60 -0.70 0.45 -0.23 0.00 0.00 178.00 178.48 1wtc h HIS 156 N 0.93 0.69 -0.01 1.56 3.86 -1.96 -2.53 115.15 117.69 1wtc h HIS 156 Ca 0.36 -0.29 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1wtc h HIS 156 Cb 0.23 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.58 1wtc h HIS 156 CO -0.00 1.05 0.00 0.28 0.86 0.00 0.00 177.93 180.12 1wtc h VAL 157 N 0.36 1.24 -0.15 2.45 2.07 -1.61 -2.53 116.25 118.09 1wtc h VAL 157 Ca -0.03 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.71 1wtc h VAL 157 Cb 1.27 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 1wtc h VAL 157 CO 0.13 0.19 -0.22 0.17 0.02 0.00 0.00 177.57 177.85 1wtc h LEU 158 N -0.27 0.25 -0.68 2.57 8.10 -1.33 -1.93 115.31 122.02 1wtc h LEU 158 Ca 0.00 -0.07 -0.09 0.00 0.11 0.00 0.00 57.88 57.84 1wtc h LEU 158 Cb 0.31 -0.07 -0.02 0.00 -0.44 0.00 0.00 40.66 40.44 1wtc h LEU 158 CO 0.00 0.48 0.04 0.00 -4.11 0.00 0.00 178.44 174.85 1wtc h ALA 159 N 1.54 0.89 -0.10 0.17 0.00 -1.42 -1.91 119.26 118.44 1wtc h ALA 159 Ca 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1wtc h ALA 159 Cb 0.53 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1wtc h ALA 159 CO 0.04 0.66 0.03 0.78 0.00 0.00 0.00 179.25 180.76 1wtc h GLY 160 N 1.01 0.17 0.58 0.00 0.00 -0.98 -2.81 103.07 101.05 1wtc h GLY 160 Ca 0.18 -0.11 0.10 0.00 0.00 0.00 0.00 47.33 47.51 1wtc h GLY 160 CO 0.02 0.10 0.63 1.46 0.00 0.00 0.00 176.54 178.75 1wtc h GLN 161 N -0.03 0.98 -0.06 4.80 1.08 -1.25 -1.11 115.11 119.52 1wtc h GLN 161 Ca 0.03 -0.06 0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1wtc h GLN 161 Cb 0.23 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1wtc h GLN 161 CO -0.00 0.65 0.15 0.78 -0.95 0.00 0.00 178.83 179.46 1wtc h GLY 162 N 1.01 0.00 2.00 3.46 0.00 -1.08 -2.15 103.07 106.31 1wtc h GLY 162 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1wtc h GLY 162 CO -0.23 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 175.40 1wtc h THR 163 N 0.00 0.00 -0.12 4.70 1.35 -1.17 -2.38 112.91 115.30 1wtc h THR 163 Ca 0.03 -0.21 -0.07 0.00 -0.55 0.00 0.00 66.41 65.61 1wtc h THR 163 Cb 0.33 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1wtc h THR 163 CO -0.00 0.00 -0.21 0.00 -0.25 0.00 0.00 175.52 175.06 1wtc h ALA 164 N 2.09 0.18 -0.52 6.62 0.00 -1.57 -2.23 119.26 123.84 1wtc h ALA 164 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1wtc h ALA 164 Cb 0.25 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1wtc h ALA 164 CO 0.00 0.14 0.24 0.00 0.00 0.00 0.00 179.25 179.62 1wtc h ALA 165 N 0.53 0.67 -0.47 0.00 0.00 -1.64 -2.14 119.26 116.21 1wtc h ALA 165 Ca 0.01 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.88 1wtc h ALA 165 Cb 0.80 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 1wtc h ALA 165 CO 0.05 0.25 -0.04 -0.22 0.00 0.00 0.00 179.25 179.28 1wtc h LYS 166 N 0.69 0.07 -0.47 0.00 3.64 -1.40 -1.51 116.57 117.59 1wtc h LYS 166 Ca 0.18 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1wtc h LYS 166 Cb 0.14 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1wtc h LYS 166 CO -0.02 0.04 0.05 0.93 -2.27 0.00 0.00 179.45 178.19 1wtc h GLU 167 N 0.07 0.75 0.43 1.90 5.08 -1.10 -2.75 114.58 118.96 1wtc h GLU 167 Ca 0.23 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1wtc h GLU 167 Cb 0.35 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1wtc h GLU 167 CO -0.43 0.72 -0.43 1.25 -1.00 0.00 0.00 179.01 179.13 1wtc h LEU 168 N 0.71 -1.16 -1.10 1.33 5.85 -0.62 -2.17 115.31 118.15 1wtc h LEU 168 Ca 0.15 0.10 0.09 0.00 0.84 0.00 0.00 57.88 59.05 1wtc h LEU 168 Cb 0.36 0.39 -0.07 0.00 0.37 0.00 0.00 40.66 41.71 1wtc h LEU 168 CO 0.01 -0.58 0.61 -0.26 -0.34 0.00 0.00 178.44 177.88 1wtc h PHE 169 N -0.87 1.08 0.00 1.25 0.04 -1.44 -0.17 116.94 116.83 1wtc h PHE 169 Ca -0.04 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 1wtc h PHE 169 Cb 0.77 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 1wtc h PHE 169 CO -0.23 0.51 -0.21 0.93 -0.60 0.00 0.00 178.31 178.72 1wtc h GLU 170 N 1.01 0.00 0.09 1.51 5.08 -1.17 1.01 114.58 122.11 1wtc h GLU 170 Ca 0.44 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.46 1wtc h GLU 170 Cb 0.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1wtc h GLU 170 CO -0.19 0.21 -1.86 1.49 -1.00 0.00 0.00 179.01 177.66 1wtc h GLU 171 N 0.00 0.20 0.00 2.33 4.81 -0.64 -3.42 114.58 117.85 1wtc h GLU 171 Ca -0.00 -0.34 -0.18 0.00 -0.13 0.00 0.00 59.36 58.71 1wtc h GLU 171 Cb 0.37 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1wtc h GLU 171 CO 0.03 1.01 -1.69 1.33 -0.73 0.00 0.00 179.01 178.96 1wtc n VAL 172 N -3.36 0.69 0.00 0.32 0.24 -0.18 -5.12 118.33 110.92 1wtc n VAL 172 Ca -0.26 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 1wtc n VAL 172 Cb 1.05 -0.83 0.00 0.00 -1.47 0.00 0.00 33.84 32.59 1wtc n VAL 172 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wtc n GLY 173 N 2.61 -1.77 3.32 7.63 0.00 0.35 -5.02 105.19 112.31 1wtc n GLY 173 Ca -0.19 -2.22 -0.37 0.00 0.00 0.00 0.00 46.02 43.25 1wtc n GLY 173 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1wtc n PRO 174 N -0.49 0.13 -3.98 1.61 -0.02 -1.26 -4.60 135.00 126.39 1wtc n PRO 174 Ca 0.00 0.07 -0.09 0.00 -2.02 0.00 0.00 63.50 61.46 1wtc n PRO 174 Cb 0.00 -1.48 -0.11 0.00 -0.02 0.00 0.00 33.50 31.89 1wtc n PRO 174 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1wtc s LEU 175 N 2.51 2.22 0.10 2.45 1.43 -1.26 -4.95 118.68 121.18 1wtc s LEU 175 Ca 0.58 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 53.22 1wtc s LEU 175 Cb -0.34 0.12 -0.24 0.00 0.03 0.00 0.00 46.19 45.76 1wtc s LEU 175 CO 0.65 -0.30 1.22 0.44 0.23 0.00 0.00 176.35 178.60 1wtc h ASP 176 N 4.64 0.14 -4.99 2.29 3.32 -1.54 -3.31 116.42 116.97 1wtc h ASP 176 Ca -0.32 -0.15 -0.12 0.00 0.02 0.00 0.00 57.03 56.45 1wtc h ASP 176 Cb 1.21 -0.05 -0.20 0.00 0.22 0.00 0.00 39.33 40.51 1wtc h ASP 176 CO 0.41 1.12 -0.32 0.00 -1.72 0.00 0.00 179.24 178.73 1wtc s ALA 177 N -2.69 -0.68 -0.05 3.45 0.00 -1.23 0.21 121.76 120.78 1wtc s ALA 177 Ca -0.01 0.21 -0.01 0.00 0.00 0.00 0.00 51.96 52.15 1wtc s ALA 177 Cb 0.09 0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.33 1wtc s ALA 177 CO 0.84 -0.25 0.02 -1.17 0.00 0.00 0.00 175.76 175.20 1wtc s LEU 178 N -1.35 0.63 -0.22 0.00 2.96 0.21 -1.06 118.68 119.84 1wtc s LEU 178 Ca -0.14 -0.02 -0.07 0.00 -0.22 0.00 0.00 54.13 53.68 1wtc s LEU 178 Cb -0.06 -0.29 -0.03 0.00 0.50 0.00 0.00 46.19 46.31 1wtc s LEU 178 CO 0.04 -0.18 0.06 -0.36 -1.32 0.00 0.00 176.35 174.58 1wtc s PHE 179 N 1.74 3.14 0.00 5.38 0.08 -0.28 -0.04 117.98 128.00 1wtc s PHE 179 Ca 0.00 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 56.87 1wtc s PHE 179 Cb -0.13 -2.15 -0.01 0.00 -0.57 0.00 0.00 43.02 40.16 1wtc s PHE 179 CO -0.03 -0.14 -0.11 0.08 -0.10 0.00 0.00 175.22 174.92 1wtc s VAL 180 N 1.04 0.88 0.39 -0.44 1.01 0.40 -2.66 120.40 121.02 1wtc s VAL 180 Ca 0.04 -0.58 -0.26 0.00 0.00 0.00 0.00 61.98 61.18 1wtc s VAL 180 Cb -0.14 -0.76 -0.09 0.00 0.00 0.00 0.00 36.38 35.39 1wtc s VAL 180 CO 0.03 0.17 1.30 0.00 0.00 0.00 0.00 175.10 176.60 1wtc s LEU 182 N -2.33 1.60 0.00 0.00 2.96 0.29 -4.30 118.68 116.90 1wtc s LEU 182 Ca 0.56 -0.52 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 1wtc s LEU 182 Cb -0.38 -1.04 0.00 0.00 0.50 0.00 0.00 46.19 45.27 1wtc s LEU 182 CO 0.49 -0.11 0.00 0.61 -1.32 0.00 0.00 176.35 176.02 1wtc n GLY 183 N 4.83 0.40 0.05 7.98 0.00 -1.26 -4.53 105.19 112.66 1wtc n GLY 183 Ca -0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1wtc n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wtc n GLY 184 N 4.13 -1.23 0.00 -0.02 0.00 -1.26 -4.70 105.19 102.11 1wtc n GLY 184 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1wtc n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wtc n GLY 185 N 1.27 0.65 0.14 -0.02 0.00 -1.26 -2.61 105.19 103.36 1wtc n GLY 185 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1wtc n GLY 185 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wtc h GLY 186 N 0.00 -0.29 1.07 -0.02 0.00 -1.91 0.39 103.07 102.31 1wtc h GLY 186 Ca 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.36 1wtc h GLY 186 CO 0.00 -0.10 0.11 -2.00 0.00 0.00 0.00 176.54 174.55 1wtc h LEU 187 N -0.39 1.06 -0.08 3.11 5.85 -1.89 -2.51 115.31 120.45 1wtc h LEU 187 Ca -0.03 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 1wtc h LEU 187 Cb 0.30 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 1wtc h LEU 187 CO 0.05 1.05 0.04 0.25 -0.34 0.00 0.00 178.44 179.49 1wtc h LEU 188 N 1.03 0.11 -0.05 2.25 5.85 -1.72 -1.53 115.31 121.25 1wtc h LEU 188 Ca 0.20 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1wtc h LEU 188 Cb 0.44 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 1wtc h LEU 188 CO 0.01 0.21 0.01 0.77 -0.34 0.00 0.00 178.44 179.10 1wtc h SER 189 N 0.01 0.08 -0.89 1.25 4.64 -0.90 -2.13 113.55 115.60 1wtc h SER 189 Ca 0.03 -0.22 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 1wtc h SER 189 Cb 0.12 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.15 1wtc h SER 189 CO -0.00 0.28 0.52 1.23 -0.87 0.00 0.00 176.83 177.99 1wtc h GLY 190 N -0.13 1.31 1.84 -0.77 0.00 -1.48 -1.76 103.07 102.09 1wtc h GLY 190 Ca 0.02 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 46.73 1wtc h GLY 190 CO 0.00 0.55 -0.15 1.76 0.00 0.00 0.00 176.54 178.70 1wtc h SER 191 N 1.23 0.19 -0.27 0.19 0.02 -1.22 -2.36 113.55 111.33 1wtc h SER 191 Ca 0.32 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1wtc h SER 191 Cb -0.02 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1wtc h SER 191 CO -0.06 0.36 -0.14 0.00 -1.14 0.00 0.00 176.83 175.85 1wtc h ALA 192 N 1.67 1.04 -0.66 3.77 0.00 -0.62 -1.79 119.26 122.65 1wtc h ALA 192 Ca 0.04 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1wtc h ALA 192 Cb 0.38 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1wtc h ALA 192 CO 0.02 0.58 0.08 -0.07 0.00 0.00 0.00 179.25 179.87 1wtc h LEU 193 N 0.63 1.08 0.01 0.00 3.38 -1.12 -1.69 115.31 117.59 1wtc h LEU 193 Ca 0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1wtc h LEU 193 Cb 0.60 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1wtc h LEU 193 CO 0.04 1.08 -0.00 0.00 0.09 0.00 0.00 178.44 179.65 1wtc h ALA 194 N 1.04 -0.01 -0.12 1.53 0.00 -1.36 -3.12 119.26 117.22 1wtc h ALA 194 Ca 0.20 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1wtc h ALA 194 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1wtc h ALA 194 CO 0.02 -0.30 -0.36 0.00 0.00 0.00 0.00 179.25 178.61 1wtc h ALA 195 N 0.56 -0.47 -0.04 0.00 0.00 -1.24 -0.65 119.26 117.42 1wtc h ALA 195 Ca -0.00 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1wtc h ALA 195 Cb 0.42 0.68 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1wtc h ALA 195 CO 0.00 -0.85 0.16 0.00 0.00 0.00 0.00 179.25 178.56 1wtc h ARG 196 N -0.44 0.00 0.00 0.00 2.47 -1.38 0.13 114.38 115.15 1wtc h ARG 196 Ca 0.09 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.81 1wtc h ARG 196 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.90 1wtc h ARG 196 CO -0.36 0.00 -0.28 1.25 0.56 0.00 0.00 179.97 181.14 1wtc h HIS 197 N 0.00 0.00 0.00 3.04 2.76 -1.11 -3.27 115.15 116.57 1wtc h HIS 197 Ca 0.02 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 1wtc h HIS 197 Cb 0.34 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 1wtc h HIS 197 CO 0.00 0.00 -0.32 0.74 -1.30 0.00 0.00 177.93 177.05 1wtc h PHE 198 N -0.80 0.00 -1.45 5.26 -1.00 -1.10 -3.38 116.94 114.47 1wtc h PHE 198 Ca 0.00 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.45 1wtc h PHE 198 Cb 0.28 0.00 -0.25 0.00 3.61 0.00 0.00 35.95 39.59 1wtc h PHE 198 CO -0.12 0.32 -0.70 0.00 -1.61 0.00 0.00 178.31 176.20 1wtc n ALA 199 N -2.35 0.04 0.17 2.45 0.00 0.43 -4.33 120.51 116.93 1wtc n ALA 199 Ca -0.01 -1.91 0.19 0.00 0.00 0.00 0.00 53.44 51.71 1wtc n ALA 199 Cb 0.41 -1.19 0.77 0.00 0.00 0.00 0.00 19.45 19.44 1wtc n ALA 199 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1wtc h PRO 200 N 5.09 0.00 -1.96 0.00 0.13 -1.61 -2.03 132.00 131.62 1wtc h PRO 200 Ca 0.12 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.53 1wtc h PRO 200 Cb 1.02 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.90 1wtc h PRO 200 CO 0.19 0.00 0.95 0.09 -0.23 0.00 0.00 178.00 179.00 1wtc n ASN 201 N -3.46 7.37 -4.25 1.44 3.02 -1.26 -4.91 115.26 113.21 1wtc n ASN 201 Ca 0.04 -3.73 -0.32 0.00 -0.03 0.00 0.00 54.58 50.54 1wtc n ASN 201 Cb 0.54 -1.09 -0.17 0.00 -0.61 0.00 0.00 39.78 38.45 1wtc n ASN 201 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wtc s GLU 203 N 0.19 4.30 -0.27 0.00 0.41 0.56 -4.87 118.70 119.02 1wtc s GLU 203 Ca -0.14 1.42 -0.07 0.00 -0.41 0.00 0.00 54.97 55.78 1wtc s GLU 203 Cb -0.17 -3.63 -0.01 0.00 -1.78 0.00 0.00 34.13 28.54 1wtc s GLU 203 CO 0.07 -0.56 0.06 0.08 -0.49 0.00 0.00 175.26 174.42 1wtc s VAL 204 N 2.93 4.03 -0.07 2.63 1.01 -1.26 0.65 120.40 130.32 1wtc s VAL 204 Ca 0.47 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 62.04 1wtc s VAL 204 Cb -0.17 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.22 1wtc s VAL 204 CO 0.11 0.23 -0.18 -0.31 0.00 0.00 0.00 175.10 174.95 1wtc s TYR 205 N 1.55 2.62 0.25 5.22 1.51 0.94 -1.54 117.35 127.90 1wtc s TYR 205 Ca 0.05 -0.49 0.03 0.00 -1.01 0.00 0.00 57.07 55.64 1wtc s TYR 205 Cb -0.16 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1wtc s TYR 205 CO 0.02 -0.07 0.40 0.20 -1.11 0.00 0.00 175.55 175.00 1wtc s GLY 206 N -0.25 1.37 -0.02 0.71 0.00 -0.97 -0.46 107.32 107.71 1wtc s GLY 206 Ca 0.00 -1.07 -0.00 0.00 0.00 0.00 0.00 44.72 43.65 1wtc s GLY 206 CO 0.03 -1.06 0.03 0.14 0.00 0.00 0.00 173.10 172.24 1wtc s VAL 207 N -2.03 -0.06 0.20 1.40 1.01 -0.04 -0.85 120.40 120.04 1wtc s VAL 207 Ca 0.36 0.21 0.09 0.00 0.00 0.00 0.00 61.98 62.64 1wtc s VAL 207 Cb -0.10 -0.08 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 1wtc s VAL 207 CO 0.31 0.09 -0.17 -1.61 0.00 0.00 0.00 175.10 173.72 1wtc s GLU 208 N 1.05 1.36 0.19 2.72 2.02 0.07 -0.55 118.70 125.57 1wtc s GLU 208 Ca -0.09 -1.55 -0.30 0.00 0.02 0.00 0.00 54.97 53.05 1wtc s GLU 208 Cb -0.13 -1.28 -0.09 0.00 0.10 0.00 0.00 34.13 32.73 1wtc s GLU 208 CO -0.03 0.24 1.28 -1.25 0.02 0.00 0.00 175.26 175.52 1wtc s PRO 209 N -3.32 4.41 0.47 0.39 0.04 -1.26 -2.35 135.00 133.38 1wtc s PRO 209 Ca 0.21 2.01 0.26 0.00 0.04 0.00 0.00 61.00 63.52 1wtc s PRO 209 Cb -0.03 -3.21 1.30 0.00 0.04 0.00 0.00 34.50 32.60 1wtc s PRO 209 CO 0.08 -0.21 1.82 1.05 0.04 0.00 0.00 177.00 179.78 1wtc h GLU 210 N 5.34 0.20 0.00 4.56 4.11 -1.44 0.12 114.58 127.47 1wtc h GLU 210 Ca -0.45 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1wtc h GLU 210 Cb 1.21 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1wtc h GLU 210 CO 0.76 0.13 0.00 0.00 0.07 0.00 0.00 179.01 179.98 1wtc n ALA 211 N -2.61 1.73 -3.10 1.06 0.00 -1.26 -3.74 120.51 112.59 1wtc n ALA 211 Ca 0.22 -0.06 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 1wtc n ALA 211 Cb 0.95 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.12 1wtc n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wtc n GLY 212 N 0.01 2.44 2.02 0.00 0.00 0.41 -4.61 105.19 105.47 1wtc n GLY 212 Ca 0.05 -1.25 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 1wtc n GLY 212 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wtc n ASN 213 N 1.21 6.58 0.23 1.61 2.04 -1.24 -4.47 115.26 121.22 1wtc n ASN 213 Ca 0.19 -3.29 0.07 0.00 -0.44 0.00 0.00 54.58 51.12 1wtc n ASN 213 Cb 0.58 -1.00 0.60 0.00 -2.53 0.00 0.00 39.78 37.43 1wtc n ASN 213 CO 0.00 0.00 0.00 -2.24 -0.44 0.00 0.00 177.26 174.58 1wtc h ASP 214 N 1.56 0.06 -0.46 0.53 2.03 -1.92 -0.75 116.42 117.46 1wtc h ASP 214 Ca 0.40 -0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.57 1wtc h ASP 214 Cb 1.00 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 39.48 1wtc h ASP 214 CO 1.02 0.06 -0.20 1.23 -1.03 0.00 0.00 179.24 180.31 1wtc h GLY 215 N 0.11 1.03 0.93 7.15 0.00 -1.86 -1.35 103.07 109.08 1wtc h GLY 215 Ca 0.02 -0.91 -0.02 0.00 0.00 0.00 0.00 47.33 46.41 1wtc h GLY 215 CO -0.00 0.83 0.14 -1.61 0.00 0.00 0.00 176.54 175.90 1wtc h GLN 216 N 0.80 0.50 -0.77 4.80 4.15 -1.53 -0.08 115.11 122.98 1wtc h GLN 216 Ca 0.11 -0.09 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 1wtc h GLN 216 Cb 0.77 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1wtc h GLN 216 CO 0.06 0.49 0.32 1.96 -1.93 0.00 0.00 178.83 179.74 1wtc h GLN 217 N 0.40 1.14 -0.37 1.69 4.20 -1.20 -1.76 115.11 119.20 1wtc h GLN 217 Ca 0.11 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1wtc h GLN 217 Cb 0.17 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1wtc h GLN 217 CO -0.01 0.91 0.19 0.77 -0.67 0.00 0.00 178.83 180.02 1wtc h SER 218 N 1.12 0.48 -0.79 1.46 0.02 -0.83 0.39 113.55 115.39 1wtc h SER 218 Ca 0.26 -0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1wtc h SER 218 Cb 0.18 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.56 1wtc h SER 218 CO -0.02 0.46 0.52 0.15 -1.14 0.00 0.00 176.83 176.79 1wtc h PHE 219 N 0.46 0.91 0.15 3.45 3.57 -0.60 0.12 116.94 125.00 1wtc h PHE 219 Ca 0.13 0.02 -0.26 0.00 3.53 0.00 0.00 57.97 61.39 1wtc h PHE 219 Cb 0.10 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 38.55 1wtc h PHE 219 CO -0.02 0.50 -1.27 0.00 -2.23 0.00 0.00 178.31 175.30 1wtc h ARG 220 N 0.92 0.32 -0.25 1.11 3.08 -0.95 -3.34 114.38 115.27 1wtc h ARG 220 Ca 0.33 -0.55 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1wtc h ARG 220 Cb 0.13 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1wtc h ARG 220 CO -0.11 1.27 -0.12 -0.22 -1.07 0.00 0.00 179.97 179.72 1wtc h LYS 221 N -0.21 0.41 0.00 0.04 1.63 -0.08 -3.46 116.57 114.89 1wtc h LYS 221 Ca -0.25 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 1wtc h LYS 221 Cb 1.82 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 33.40 1wtc h LYS 221 CO 0.14 0.54 0.00 0.41 -3.45 0.00 0.00 179.45 177.08 1wtc n GLY 222 N -0.72 0.73 2.93 5.01 0.00 0.39 -5.03 105.19 108.50 1wtc n GLY 222 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1wtc n GLY 222 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wtc s SER 223 N -2.64 0.06 -0.20 1.61 1.04 -1.17 -5.01 113.70 107.39 1wtc s SER 223 Ca 0.00 -0.13 -0.38 0.00 0.48 0.00 0.00 55.95 55.92 1wtc s SER 223 Cb 0.00 0.07 -0.14 0.00 0.10 0.00 0.00 66.02 66.05 1wtc s SER 223 CO 0.00 -0.12 1.79 -0.38 0.98 0.00 0.00 173.24 175.52 1wtc n ILE 224 N 2.54 0.41 -4.34 -1.02 5.41 -1.26 -4.41 119.36 116.68 1wtc n ILE 224 Ca -0.16 -0.07 -0.35 0.00 1.00 0.00 0.00 62.75 63.16 1wtc n ILE 224 Cb 0.58 -1.48 -0.09 0.00 -0.71 0.00 0.00 39.64 37.94 1wtc n ILE 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1wtc s VAL 225 N 3.71 4.36 0.10 1.39 0.11 -1.26 -5.00 120.40 123.80 1wtc s VAL 225 Ca 0.96 -0.23 0.03 0.00 -2.93 0.00 0.00 61.98 59.82 1wtc s VAL 225 Cb -0.92 -2.84 -0.04 0.00 -1.53 0.00 0.00 36.38 31.05 1wtc s VAL 225 CO 0.60 0.60 0.11 -1.00 -3.33 0.00 0.00 175.10 172.07 1wtc s HIS 226 N -0.78 3.22 0.15 1.54 0.09 -1.26 -4.60 115.29 113.65 1wtc s HIS 226 Ca 0.12 0.08 -0.05 0.00 -0.00 0.00 0.00 55.06 55.21 1wtc s HIS 226 Cb -0.12 -1.61 -0.03 0.00 -0.00 0.00 0.00 32.58 30.83 1wtc s HIS 226 CO 0.02 0.53 0.17 0.96 -0.00 0.00 0.00 174.74 176.42 1wtc s ILE 227 N -1.49 0.08 0.52 0.60 -4.36 -0.74 -5.04 121.20 110.77 1wtc s ILE 227 Ca 0.30 -1.67 -0.20 0.00 -0.26 0.00 0.00 60.65 58.82 1wtc s ILE 227 Cb -0.12 -1.97 -0.07 0.00 1.25 0.00 0.00 42.46 41.56 1wtc s ILE 227 CO 0.23 -0.37 1.10 -1.81 0.24 0.00 0.00 174.94 174.33 1wtc s ASP 228 N -3.01 5.92 0.00 4.36 1.01 -1.26 -4.70 116.67 118.98 1wtc s ASP 228 Ca 0.21 2.11 -0.35 0.00 0.71 0.00 0.00 52.55 55.24 1wtc s ASP 228 Cb 0.05 -2.58 -0.13 0.00 1.01 0.00 0.00 42.92 41.28 1wtc s ASP 228 CO 0.01 -1.08 1.73 0.41 0.21 0.00 0.00 175.17 176.45 1wtc n THR 229 N -1.17 0.31 -2.65 -1.27 -1.04 -1.26 -4.93 114.28 102.27 1wtc n THR 229 Ca 0.11 -0.06 -0.35 0.00 -2.04 0.00 0.00 64.05 61.72 1wtc n THR 229 Cb 0.51 -1.64 -0.05 0.00 -1.82 0.00 0.00 70.33 67.33 1wtc n THR 229 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1wtc s PRO 230 N 2.65 4.11 -0.45 -2.82 0.04 -1.26 -5.02 135.00 132.24 1wtc s PRO 230 Ca 0.87 1.32 -0.21 0.00 0.04 0.00 0.00 61.00 63.02 1wtc s PRO 230 Cb -0.73 -2.31 0.03 0.00 0.04 0.00 0.00 34.50 31.53 1wtc s PRO 230 CO 0.47 -0.16 0.68 0.15 0.04 0.00 0.00 177.00 178.18 1wtc s LYS 231 N -2.91 3.28 0.09 4.56 1.02 -1.26 -4.96 119.74 119.56 1wtc s LYS 231 Ca 0.61 -0.38 -0.25 0.00 0.02 0.00 0.00 55.97 55.97 1wtc s LYS 231 Cb -0.16 -3.97 0.07 0.00 -0.52 0.00 0.00 37.83 33.26 1wtc s LYS 231 CO 0.20 -1.08 0.65 -0.08 -0.92 0.00 0.00 175.35 174.12 1wtc s THR 232 N 2.94 0.00 -0.94 2.17 -1.32 -1.26 -4.84 115.64 112.39 1wtc s THR 232 Ca 0.23 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.99 1wtc s THR 232 Cb -0.14 -1.00 0.23 0.00 -1.51 0.00 0.00 72.50 70.08 1wtc s THR 232 CO 0.19 0.00 1.86 2.30 -2.21 0.00 0.00 174.62 176.76 1wtc n ILE 233 N -0.06 0.12 -1.71 5.08 -5.35 -1.26 -4.27 119.36 111.91 1wtc n ILE 233 Ca -0.17 -0.06 -0.42 0.00 -0.27 0.00 0.00 62.75 61.83 1wtc n ILE 233 Cb 0.63 -0.46 -0.00 0.00 -1.74 0.00 0.00 39.64 38.06 1wtc n ILE 233 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wtc n ALA 234 N -1.56 5.56 0.18 -1.28 0.00 -1.26 -4.55 120.51 117.59 1wtc n ALA 234 Ca 0.07 -3.87 0.18 0.00 0.00 0.00 0.00 53.44 49.82 1wtc n ALA 234 Cb 0.36 -3.54 0.77 0.00 0.00 0.00 0.00 19.45 17.05 1wtc n ALA 234 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1wtc h ASP 235 N 6.01 0.00 -0.11 0.00 2.03 -1.95 0.13 116.42 122.52 1wtc h ASP 235 Ca 0.57 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.87 1wtc h ASP 235 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 1wtc h ASP 235 CO 1.89 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 180.71 1wtc n GLY 236 N -1.39 0.12 1.31 7.15 0.00 -1.26 -3.94 105.19 107.18 1wtc n GLY 236 Ca 0.04 -0.41 0.02 0.00 0.00 0.00 0.00 46.02 45.66 1wtc n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wtc n ALA 237 N 0.21 3.14 -0.38 4.61 0.00 0.44 -4.75 120.51 123.77 1wtc n ALA 237 Ca 0.17 -2.90 0.06 0.00 0.00 0.00 0.00 53.44 50.77 1wtc n ALA 237 Cb 0.33 -0.56 0.31 0.00 0.00 0.00 0.00 19.45 19.52 1wtc n ALA 237 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1wtc n GLN 238 N -0.36 3.83 -1.32 0.00 6.02 -1.22 -4.77 117.38 119.57 1wtc n GLN 238 Ca 0.15 -2.38 -0.35 0.00 -0.01 0.00 0.00 57.00 54.41 1wtc n GLN 238 Cb 0.92 -2.03 0.11 0.00 1.02 0.00 0.00 30.24 30.26 1wtc n GLN 238 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1wtc n THR 239 N 0.55 3.02 1.07 5.09 -2.24 -1.26 -4.56 114.28 115.94 1wtc n THR 239 Ca 0.21 -0.31 0.11 0.00 -2.27 0.00 0.00 64.05 61.80 1wtc n THR 239 Cb 0.93 -1.29 0.10 0.00 -2.10 0.00 0.00 70.33 67.97 1wtc n THR 239 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wtc n GLN 240 N -2.77 0.84 -3.62 -0.78 6.02 -1.26 -4.86 117.38 110.95 1wtc n GLN 240 Ca 0.14 -0.64 -0.05 0.00 -0.01 0.00 0.00 57.00 56.44 1wtc n GLN 240 Cb 0.50 -1.49 -0.04 0.00 1.02 0.00 0.00 30.24 30.23 1wtc n GLN 240 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.06 172.67 1wtc s HIS 241 N -2.60 -0.15 0.89 1.08 -3.43 -1.26 -1.80 115.29 108.02 1wtc s HIS 241 Ca 0.18 0.25 -0.12 0.00 -0.80 0.00 0.00 55.06 54.57 1wtc s HIS 241 Cb 0.18 0.48 0.12 0.00 -1.43 0.00 0.00 32.58 31.94 1wtc s HIS 241 CO 0.61 -0.15 1.10 -0.51 -2.00 0.00 0.00 174.74 173.80 1wtc s LEU 242 N -1.12 2.18 0.34 5.38 1.43 -1.26 -4.78 118.68 120.85 1wtc s LEU 242 Ca 0.05 1.26 0.02 0.00 -1.03 0.00 0.00 54.13 54.43 1wtc s LEU 242 Cb -0.01 -3.67 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 1wtc s LEU 242 CO -0.05 -2.51 0.53 -0.83 0.23 0.00 0.00 176.35 173.72 1wtc s GLY 243 N -3.71 1.37 0.08 -3.19 0.00 -1.07 -4.95 107.32 95.85 1wtc s GLY 243 Ca 0.63 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 44.01 1wtc s GLY 243 CO 0.55 -0.97 1.66 3.43 0.00 0.00 0.00 173.10 177.77 1wtc h ASN 244 N 0.78 -0.57 -0.57 1.64 2.35 -1.93 -0.54 115.58 116.74 1wtc h ASN 244 Ca -0.49 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.20 1wtc h ASN 244 Cb 1.23 0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.72 1wtc h ASN 244 CO 0.60 -0.41 0.08 1.88 -1.65 0.00 0.00 177.43 177.93 1wtc h TYR 245 N -0.67 1.05 0.14 1.19 -1.99 -1.93 -2.60 116.97 112.16 1wtc h TYR 245 Ca -0.07 -0.14 -0.01 0.00 2.00 0.00 0.00 58.73 60.52 1wtc h TYR 245 Cb 0.52 -0.29 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1wtc h TYR 245 CO -0.04 0.90 -0.07 1.79 -0.00 0.00 0.00 178.16 180.74 1wtc h THR 246 N 0.93 1.00 -0.99 -2.88 1.35 -1.84 -3.09 112.91 107.39 1wtc h THR 246 Ca 0.19 -0.61 0.03 0.00 -0.55 0.00 0.00 66.41 65.46 1wtc h THR 246 Cb 0.43 1.38 -0.05 0.00 -1.73 0.00 0.00 68.15 68.17 1wtc h THR 246 CO 0.01 0.14 0.65 0.15 -0.25 0.00 0.00 175.52 176.22 1wtc h PHE 247 N -0.47 1.22 -0.34 4.73 3.57 -1.11 -0.91 116.94 123.62 1wtc h PHE 247 Ca -0.02 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1wtc h PHE 247 Cb 0.38 -0.41 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 1wtc h PHE 247 CO 0.02 0.73 0.08 0.77 -2.23 0.00 0.00 178.31 177.68 1wtc h SER 248 N 1.28 0.04 -0.07 0.41 0.02 -1.48 0.12 113.55 113.87 1wtc h SER 248 Ca 0.38 0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 61.24 1wtc h SER 248 Cb -0.06 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1wtc h SER 248 CO -0.11 0.06 -0.45 0.40 -1.14 0.00 0.00 176.83 175.59 1wtc h ILE 249 N 0.20 1.30 -0.29 3.27 2.04 -1.40 -3.17 117.51 119.46 1wtc h ILE 249 Ca 0.16 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 1wtc h ILE 249 Cb 0.17 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 1wtc h ILE 249 CO -0.20 0.52 0.15 0.40 0.00 0.00 0.00 178.15 179.01 1wtc h ILE 250 N 0.50 1.14 0.00 -0.67 2.04 -0.35 0.13 117.51 120.30 1wtc h ILE 250 Ca 0.03 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1wtc h ILE 250 Cb 0.98 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1wtc h ILE 250 CO 0.09 0.14 -0.04 0.07 0.00 0.00 0.00 178.15 178.41 1wtc h LYS 251 N 0.34 0.00 0.00 2.37 2.10 -0.84 0.10 116.57 120.64 1wtc h LYS 251 Ca 0.10 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.67 1wtc h LYS 251 Cb 0.09 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.41 1wtc h LYS 251 CO -0.01 0.04 -1.98 0.39 -2.00 0.00 0.00 179.45 175.89 1wtc n GLU 252 N -3.25 0.70 0.00 0.07 1.02 -0.98 -4.68 120.64 113.52 1wtc n GLU 252 Ca -0.01 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 1wtc n GLU 252 Cb 0.23 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1wtc n GLU 252 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1wtc n LYS 253 N -2.30 2.37 -3.54 3.49 0.00 0.43 -5.02 118.16 113.59 1wtc n LYS 253 Ca -0.10 -0.19 -0.37 0.00 -0.00 0.00 0.00 58.31 57.65 1wtc n LYS 253 Cb 0.65 -0.63 -0.08 0.00 -0.00 0.00 0.00 35.03 34.96 1wtc n LYS 253 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1wtc s VAL 254 N -0.39 5.29 0.18 0.58 1.01 0.35 -4.77 120.40 122.65 1wtc s VAL 254 Ca 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 61.98 62.33 1wtc s VAL 254 Cb 0.00 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1wtc s VAL 254 CO 0.00 0.31 1.53 0.44 0.00 0.00 0.00 175.10 177.38 1wtc h ASP 255 N 7.36 0.83 -3.34 3.32 3.32 -1.57 -3.45 116.42 122.89 1wtc h ASP 255 Ca -0.38 -0.38 0.20 0.00 0.02 0.00 0.00 57.03 56.50 1wtc h ASP 255 Cb 1.17 -0.23 -0.26 0.00 0.22 0.00 0.00 39.33 40.22 1wtc h ASP 255 CO 0.69 1.12 0.86 -0.62 -1.72 0.00 0.00 179.24 179.58 1wtc s ASP 256 N -6.85 -0.11 -0.24 6.45 2.15 -1.19 -5.03 116.67 111.85 1wtc s ASP 256 Ca -0.09 0.13 -0.09 0.00 0.43 0.00 0.00 52.55 52.92 1wtc s ASP 256 Cb 0.12 0.09 -0.04 0.00 -0.30 0.00 0.00 42.92 42.79 1wtc s ASP 256 CO 0.86 -0.10 0.13 -0.63 -0.17 0.00 0.00 175.17 175.25 1wtc s ILE 257 N -1.02 4.99 0.32 4.11 -1.09 -1.26 -2.29 121.20 124.96 1wtc s ILE 257 Ca 0.06 0.05 0.07 0.00 -2.23 0.00 0.00 60.65 58.61 1wtc s ILE 257 Cb -0.01 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 1wtc s ILE 257 CO -0.06 0.34 0.30 -0.76 -1.23 0.00 0.00 174.94 173.53 1wtc s LEU 258 N 1.27 3.69 0.06 2.97 1.43 -0.03 -4.91 118.68 123.15 1wtc s LEU 258 Ca 0.06 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1wtc s LEU 258 Cb -0.14 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 1wtc s LEU 258 CO 0.05 -0.31 -0.09 0.42 0.23 0.00 0.00 176.35 176.65 1wtc s THR 259 N -2.26 0.72 0.09 5.49 -4.23 -1.26 -0.75 115.64 113.44 1wtc s THR 259 Ca 0.40 -1.25 0.01 0.00 -1.18 0.00 0.00 61.69 59.67 1wtc s THR 259 Cb -0.07 -0.86 -0.04 0.00 1.34 0.00 0.00 72.50 72.87 1wtc s THR 259 CO 0.27 -0.40 -0.06 0.68 -0.54 0.00 0.00 174.62 174.57 1wtc s VAL 260 N -1.62 0.57 0.53 2.29 -7.23 -0.99 -4.83 120.40 109.12 1wtc s VAL 260 Ca -0.05 -1.91 -0.03 0.00 -1.81 0.00 0.00 61.98 58.18 1wtc s VAL 260 Cb -0.08 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1wtc s VAL 260 CO 0.00 -0.90 0.80 -0.94 -0.31 0.00 0.00 175.10 173.76 1wtc s SER 261 N -3.02 5.68 0.34 4.85 1.04 -1.26 -1.11 113.70 120.22 1wtc s SER 261 Ca 0.11 0.51 0.05 0.00 0.48 0.00 0.00 55.95 57.10 1wtc s SER 261 Cb 0.06 -1.60 0.60 0.00 0.10 0.00 0.00 66.02 65.18 1wtc s SER 261 CO -0.06 -0.91 1.84 0.44 0.98 0.00 0.00 173.24 175.53 1wtc h ASP 262 N 0.08 0.41 -0.80 7.02 3.32 -1.99 -2.17 116.42 122.29 1wtc h ASP 262 Ca -0.46 -0.10 0.03 0.00 0.02 0.00 0.00 57.03 56.53 1wtc h ASP 262 Cb 1.26 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 1wtc h ASP 262 CO 0.59 0.56 0.51 -0.33 -1.72 0.00 0.00 179.24 178.84 1wtc h GLU 263 N 0.40 0.97 -0.56 3.56 3.07 -1.99 0.19 114.58 120.21 1wtc h GLU 263 Ca 0.08 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.36 58.76 1wtc h GLU 263 Cb 0.44 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 1wtc h GLU 263 CO 0.02 0.64 -0.10 0.93 -1.40 0.00 0.00 179.01 179.10 1wtc h GLU 264 N 0.99 1.05 -0.43 2.33 5.08 -1.84 -1.52 114.58 120.25 1wtc h GLU 264 Ca 0.32 -0.39 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1wtc h GLU 264 Cb 0.00 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1wtc h GLU 264 CO -0.11 1.08 0.28 -0.07 -1.00 0.00 0.00 179.01 179.19 1wtc h LEU 265 N 0.93 0.48 -0.69 1.33 3.38 -0.71 -0.60 115.31 119.44 1wtc h LEU 265 Ca 0.15 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1wtc h LEU 265 Cb 0.67 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1wtc h LEU 265 CO 0.05 0.35 0.45 0.40 0.09 0.00 0.00 178.44 179.78 1wtc h ILE 266 N 0.57 1.18 -0.90 1.22 2.04 -0.80 0.10 117.51 120.92 1wtc h ILE 266 Ca 0.16 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1wtc h ILE 266 Cb -0.06 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 1wtc h ILE 266 CO -0.04 0.17 0.49 0.44 0.00 0.00 0.00 178.15 179.21 1wtc h ASP 267 N 0.93 1.12 -0.47 1.72 3.32 -0.69 -1.68 116.42 120.68 1wtc h ASP 267 Ca 0.25 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 57.07 1wtc h ASP 267 Cb -0.11 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.14 1wtc h ASP 267 CO -0.05 0.90 -0.22 0.00 -1.72 0.00 0.00 179.24 178.15 1wtc h LEU 269 N 0.85 0.48 -0.72 0.00 6.46 -0.40 -0.68 115.31 121.30 1wtc h LEU 269 Ca 0.11 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.77 1wtc h LEU 269 Cb 0.80 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.61 1wtc h LEU 269 CO 0.07 0.34 -0.09 0.11 -0.62 0.00 0.00 178.44 178.25 1wtc h LYS 270 N 0.59 0.89 0.03 1.25 1.57 -1.16 -2.56 116.57 117.18 1wtc h LYS 270 Ca 0.20 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1wtc h LYS 270 Cb 0.02 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1wtc h LYS 270 CO -0.09 0.94 -0.01 0.35 -0.57 0.00 0.00 179.45 180.07 1wtc h PHE 271 N 0.80 -0.03 -0.74 -1.35 3.57 -0.82 0.72 116.94 119.09 1wtc h PHE 271 Ca 0.13 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.73 1wtc h PHE 271 Cb 0.61 0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 1wtc h PHE 271 CO 0.04 0.02 0.38 1.88 -2.23 0.00 0.00 178.31 178.40 1wtc h TYR 272 N -0.08 0.69 0.42 0.41 0.05 -1.05 0.31 116.97 117.73 1wtc h TYR 272 Ca -0.00 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 1wtc h TYR 272 Cb 0.07 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 37.62 1wtc h TYR 272 CO -0.06 0.25 -0.20 0.00 -1.05 0.00 0.00 178.16 177.10 1wtc h ALA 273 N 1.44 -0.57 -0.09 3.88 0.00 -1.12 0.18 119.26 122.97 1wtc h ALA 273 Ca 0.36 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 1wtc h ALA 273 Cb 0.37 0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1wtc h ALA 273 CO -0.26 -0.59 -0.85 0.00 0.00 0.00 0.00 179.25 177.54 1wtc h ALA 274 N -0.80 0.23 0.00 0.00 0.00 -0.80 -2.17 119.26 115.72 1wtc h ALA 274 Ca -0.06 -0.63 -0.27 0.00 0.00 0.00 0.00 54.91 53.96 1wtc h ALA 274 Cb 0.54 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1wtc h ALA 274 CO 0.10 0.66 -1.67 0.54 0.00 0.00 0.00 179.25 178.87 1wtc n ARG 275 N -3.93 0.63 0.00 0.00 5.12 0.11 -4.42 116.66 114.16 1wtc n ARG 275 Ca -0.09 0.27 0.02 0.00 -1.93 0.00 0.00 57.85 56.12 1wtc n ARG 275 Cb 0.79 -1.79 0.00 0.00 -1.16 0.00 0.00 32.46 30.30 1wtc n ARG 275 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1wtc n MET 276 N -3.00 2.19 -2.61 5.56 2.81 -0.85 -5.02 117.12 116.21 1wtc n MET 276 Ca -0.16 -0.43 -0.21 0.00 -1.81 0.00 0.00 57.70 55.09 1wtc n MET 276 Cb 1.01 -0.91 0.01 0.00 -0.71 0.00 0.00 33.22 32.62 1wtc n MET 276 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1wtc n LYS 277 N -0.32 -2.78 -4.55 0.03 4.76 0.50 -4.94 118.16 110.86 1wtc n LYS 277 Ca 0.02 0.98 -0.24 0.00 -2.87 0.00 0.00 58.31 56.20 1wtc n LYS 277 Cb 0.08 -5.72 -0.14 0.00 -1.84 0.00 0.00 35.03 27.42 1wtc n LYS 277 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1wtc s ILE 278 N -3.09 1.53 -0.22 -0.18 -4.36 -0.48 -4.95 121.20 109.44 1wtc s ILE 278 Ca 0.10 -1.16 -0.21 0.00 -0.26 0.00 0.00 60.65 59.12 1wtc s ILE 278 Cb -0.05 -1.34 -0.02 0.00 1.25 0.00 0.00 42.46 42.30 1wtc s ILE 278 CO 0.13 0.14 0.64 -0.69 0.24 0.00 0.00 174.94 175.40 1wtc s VAL 279 N -0.83 5.00 -0.02 8.37 1.01 -1.26 -3.15 120.40 129.52 1wtc s VAL 279 Ca 0.06 1.19 0.03 0.00 0.00 0.00 0.00 61.98 63.26 1wtc s VAL 279 Cb -0.09 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.34 1wtc s VAL 279 CO 0.02 0.08 -0.11 -0.69 0.00 0.00 0.00 175.10 174.40 1wtc s VAL 280 N 2.12 0.91 0.49 2.92 1.01 -1.26 -4.49 120.40 122.11 1wtc s VAL 280 Ca 0.28 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 1wtc s VAL 280 Cb -0.16 -0.79 -0.08 0.00 0.00 0.00 0.00 36.38 35.35 1wtc s VAL 280 CO 0.10 0.27 1.00 -1.83 0.00 0.00 0.00 175.10 174.64 1wtc s GLU 281 N 0.07 3.90 0.26 2.72 -1.05 -0.71 -4.93 118.70 118.96 1wtc s GLU 281 Ca -0.02 1.15 -0.11 0.00 -0.15 0.00 0.00 54.97 55.84 1wtc s GLU 281 Cb -0.08 -2.12 0.37 0.00 -0.44 0.00 0.00 34.13 31.86 1wtc s GLU 281 CO 0.01 -0.32 1.52 -2.30 0.95 0.00 0.00 175.26 175.11 1wtc n PRO 282 N -1.21 -0.14 0.15 -4.83 -0.02 -1.26 0.37 135.00 128.06 1wtc n PRO 282 Ca 0.08 1.51 0.06 0.00 -2.02 0.00 0.00 63.50 63.13 1wtc n PRO 282 Cb 0.53 -2.25 0.53 0.00 -0.02 0.00 0.00 33.50 32.29 1wtc n PRO 282 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1wtc h THR 283 N 0.00 1.06 0.00 3.45 2.02 -1.88 -1.09 112.91 116.48 1wtc h THR 283 Ca 0.42 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.42 1wtc h THR 283 Cb 0.67 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1wtc h THR 283 CO -0.99 0.07 0.00 0.61 0.37 0.00 0.00 175.52 175.58 1wtc n GLY 284 N -1.42 -0.69 0.22 2.16 0.00 0.16 -2.78 105.19 102.84 1wtc n GLY 284 Ca -0.01 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 1wtc n GLY 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wtc h LEU 286 N 1.07 -1.29 -0.78 0.00 3.38 -1.64 -1.35 115.31 114.70 1wtc h LEU 286 Ca 0.00 0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.20 1wtc h LEU 286 Cb 0.61 0.47 -0.08 0.00 0.09 0.00 0.00 40.66 41.75 1wtc h LEU 286 CO 0.00 -0.53 0.42 0.77 0.09 0.00 0.00 178.44 179.19 1wtc h SER 287 N -0.74 0.57 -0.46 -0.43 4.64 -1.84 -0.90 113.55 114.38 1wtc h SER 287 Ca -0.00 0.06 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1wtc h SER 287 Cb 0.73 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1wtc h SER 287 CO -0.20 0.31 -0.19 0.15 -0.87 0.00 0.00 176.83 176.03 1wtc h PHE 288 N 0.69 1.08 -0.28 4.77 3.57 -1.81 -2.22 116.94 122.74 1wtc h PHE 288 Ca 0.39 -0.26 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1wtc h PHE 288 Cb 0.41 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1wtc h PHE 288 CO -0.08 1.06 0.16 0.00 -2.23 0.00 0.00 178.31 177.22 1wtc h ALA 289 N 0.86 0.36 -0.59 2.41 0.00 -0.48 -0.78 119.26 121.04 1wtc h ALA 289 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1wtc h ALA 289 Cb 0.76 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1wtc h ALA 289 CO 0.06 -0.11 0.38 0.00 0.00 0.00 0.00 179.25 179.58 1wtc h ALA 290 N 1.03 0.75 -0.33 0.00 0.00 -1.17 -2.03 119.26 117.52 1wtc h ALA 290 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wtc h ALA 290 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1wtc h ALA 290 CO -0.02 0.20 0.21 0.00 0.00 0.00 0.00 179.25 179.64 1wtc h ALA 291 N 1.20 0.41 -0.69 0.00 0.00 -1.10 -2.47 119.26 116.62 1wtc h ALA 291 Ca 0.21 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1wtc h ALA 291 Cb -0.07 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1wtc h ALA 291 CO -0.04 -0.11 0.42 0.00 0.00 0.00 0.00 179.25 179.52 1wtc h ARG 292 N 0.43 0.94 0.00 0.00 3.08 -0.87 -1.79 114.38 116.17 1wtc h ARG 292 Ca 0.12 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1wtc h ARG 292 Cb -0.03 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.82 1wtc h ARG 292 CO -0.02 0.65 -0.09 0.00 -1.07 0.00 0.00 179.97 179.44 1wtc h ALA 293 N 1.51 1.53 0.00 0.04 0.00 -0.90 -2.68 119.26 118.75 1wtc h ALA 293 Ca 0.25 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1wtc h ALA 293 Cb -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1wtc h ALA 293 CO -0.05 0.11 -0.44 0.00 0.00 0.00 0.00 179.25 178.87 1wtc n MET 294 N -3.96 1.50 0.07 0.00 0.00 -0.80 -4.76 117.12 109.17 1wtc n MET 294 Ca -0.02 -3.16 0.09 0.00 0.00 0.00 0.00 57.70 54.61 1wtc n MET 294 Cb 0.18 -1.56 0.55 0.00 0.00 0.00 0.00 33.22 32.39 1wtc n MET 294 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 175.97 177.54 1wtc h LYS 295 N 0.85 0.25 -0.04 3.17 2.10 -0.99 -0.01 116.57 121.90 1wtc h LYS 295 Ca -0.01 -0.02 0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1wtc h LYS 295 Cb 1.02 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 32.29 1wtc h LYS 295 CO 0.00 0.17 0.04 0.93 -2.00 0.00 0.00 179.45 178.58 1wtc h GLU 296 N 0.26 0.00 -0.56 0.07 4.39 -1.85 0.09 114.58 116.98 1wtc h GLU 296 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1wtc h GLU 296 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1wtc h GLU 296 CO -0.03 0.00 0.00 0.36 -1.16 0.00 0.00 179.01 178.18 1wtc n LYS 297 N -4.02 2.30 -0.07 2.33 -0.00 -0.02 -4.18 118.16 114.51 1wtc n LYS 297 Ca -0.02 -2.01 0.09 0.00 -0.00 0.00 0.00 58.31 56.37 1wtc n LYS 297 Cb 0.13 -1.44 0.12 0.00 -0.00 0.00 0.00 35.03 33.85 1wtc n LYS 297 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1wtc n LEU 298 N 1.13 2.29 -4.73 -5.58 4.32 0.02 -5.06 117.00 109.39 1wtc n LEU 298 Ca 0.19 -2.94 -0.42 0.00 -0.02 0.00 0.00 56.01 52.81 1wtc n LEU 298 Cb 0.47 -0.38 -0.01 0.00 -1.62 0.00 0.00 43.42 41.89 1wtc n LEU 298 CO 0.13 0.68 1.05 0.29 -1.22 0.00 0.00 177.39 178.31 1wtc n LYS 299 N -1.32 2.38 -3.59 3.23 5.02 -1.24 -2.79 118.16 119.85 1wtc n LYS 299 Ca 0.14 0.84 -0.26 0.00 -2.02 0.00 0.00 58.31 57.00 1wtc n LYS 299 Cb 0.60 -2.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.09 1wtc n LYS 299 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1wtc n ASN 300 N 1.12 -3.62 -4.68 4.39 4.13 0.21 -4.96 115.26 111.85 1wtc n ASN 300 Ca 0.05 -0.54 -0.30 0.00 1.68 0.00 0.00 54.58 55.47 1wtc n ASN 300 Cb 0.36 -2.98 -0.10 0.00 -1.54 0.00 0.00 39.78 35.53 1wtc n ASN 300 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1wtc s LYS 301 N -6.25 2.06 -0.28 3.52 1.02 -1.12 -4.99 119.74 113.70 1wtc s LYS 301 Ca 0.49 -2.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.23 1wtc s LYS 301 Cb -0.26 -1.61 0.02 0.00 -0.52 0.00 0.00 37.83 35.46 1wtc s LYS 301 CO 0.60 -0.17 0.03 1.03 -0.92 0.00 0.00 175.35 175.92 1wtc s ARG 302 N -3.78 2.90 0.02 1.68 0.52 -1.26 -2.02 118.95 117.01 1wtc s ARG 302 Ca 0.24 -0.96 0.03 0.00 -0.52 0.00 0.00 55.73 54.52 1wtc s ARG 302 Cb 0.07 -3.23 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 1wtc s ARG 302 CO 0.13 -0.46 -0.03 0.42 0.02 0.00 0.00 175.30 175.38 1wtc s ILE 303 N 1.41 3.93 -0.10 1.52 1.09 -0.24 -1.65 121.20 127.15 1wtc s ILE 303 Ca 0.01 -0.75 0.02 0.00 -1.10 0.00 0.00 60.65 58.82 1wtc s ILE 303 Cb -0.17 -2.76 -0.02 0.00 -1.06 0.00 0.00 42.46 38.45 1wtc s ILE 303 CO -0.00 0.33 -0.16 -0.83 -0.10 0.00 0.00 174.94 174.18 1wtc s GLY 304 N -1.66 1.49 -0.12 6.18 0.00 -0.23 -0.50 107.32 112.49 1wtc s GLY 304 Ca 0.20 -0.93 -0.00 0.00 0.00 0.00 0.00 44.72 43.98 1wtc s GLY 304 CO 0.11 -0.39 -0.09 -0.42 0.00 0.00 0.00 173.10 172.31 1wtc s ILE 305 N 0.03 1.12 -0.13 0.90 1.01 0.13 -1.13 121.20 123.14 1wtc s ILE 305 Ca -0.06 -0.35 -0.20 0.00 0.00 0.00 0.00 60.65 60.04 1wtc s ILE 305 Cb -0.15 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 1wtc s ILE 305 CO 0.05 0.38 0.57 -0.63 0.00 0.00 0.00 174.94 175.31 1wtc s ILE 306 N 1.65 5.11 -0.49 2.92 -1.09 -1.09 -1.35 121.20 126.86 1wtc s ILE 306 Ca 0.04 1.13 -0.12 0.00 -2.23 0.00 0.00 60.65 59.47 1wtc s ILE 306 Cb -0.13 -3.90 0.11 0.00 -1.58 0.00 0.00 42.46 36.97 1wtc s ILE 306 CO -0.08 0.26 0.39 -0.63 -1.23 0.00 0.00 174.94 173.64 1wtc s ILE 307 N 0.99 4.62 0.50 2.92 1.01 -0.09 -4.70 121.20 126.44 1wtc s ILE 307 Ca 0.29 -1.59 0.15 0.00 0.00 0.00 0.00 60.65 59.50 1wtc s ILE 307 Cb -0.16 -3.97 0.26 0.00 0.01 0.00 0.00 42.46 38.61 1wtc s ILE 307 CO 0.12 -0.76 2.12 0.77 0.00 0.00 0.00 174.94 177.20 1wtc h SER 308 N 8.61 0.05 -5.42 3.58 4.64 -1.84 -0.90 113.55 122.27 1wtc h SER 308 Ca -0.25 -0.00 0.36 0.00 -0.47 0.00 0.00 61.79 61.43 1wtc h SER 308 Cb 1.09 -0.01 -0.15 0.00 -0.31 0.00 0.00 62.40 63.01 1wtc h SER 308 CO 0.91 0.06 0.93 -0.83 -0.87 0.00 0.00 176.83 177.03 1wtc s GLY 309 N -4.04 -0.41 -0.09 -0.77 0.00 -1.26 -1.46 107.32 99.29 1wtc s GLY 309 Ca -0.05 1.13 0.16 0.00 0.00 0.00 0.00 44.72 45.95 1wtc s GLY 309 CO 0.68 0.28 1.16 0.61 0.00 0.00 0.00 173.10 175.82 1wtc n GLY 310 N -0.37 2.97 3.40 0.20 0.00 -0.20 -1.74 105.19 109.45 1wtc n GLY 310 Ca -0.06 -0.92 -0.45 0.00 0.00 0.00 0.00 46.02 44.60 1wtc n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wtc s ASN 311 N -2.40 6.92 -0.11 1.61 0.01 -1.26 -4.49 114.94 115.22 1wtc s ASN 311 Ca 0.30 -2.76 0.03 0.00 -0.71 0.00 0.00 52.86 49.71 1wtc s ASN 311 Cb 0.30 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.65 1wtc s ASN 311 CO -0.08 -0.71 -0.21 0.54 -1.51 0.00 0.00 177.10 175.13 1wtc s VAL 312 N 1.01 1.89 0.03 1.60 0.11 -1.26 -4.86 120.40 118.92 1wtc s VAL 312 Ca 0.32 -0.91 -0.37 0.00 -2.93 0.00 0.00 61.98 58.09 1wtc s VAL 312 Cb -0.06 -1.66 -0.16 0.00 -1.53 0.00 0.00 36.38 32.96 1wtc s VAL 312 CO -0.07 0.52 1.41 -0.67 -3.33 0.00 0.00 175.10 172.97 1wtc n ASP 313 N 3.75 1.79 0.03 3.54 2.03 -1.26 -4.73 116.55 121.69 1wtc n ASP 313 Ca -0.20 1.11 0.21 0.00 0.52 0.00 0.00 54.79 56.43 1wtc n ASP 313 Cb 0.52 -1.19 0.72 0.00 -0.72 0.00 0.00 41.12 40.46 1wtc n ASP 313 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1wtc h ILE 314 N 3.64 0.61 -0.20 5.18 2.10 -1.98 0.19 117.51 127.05 1wtc h ILE 314 Ca -0.47 0.00 -0.12 0.00 1.08 0.00 0.00 64.86 65.35 1wtc h ILE 314 Cb 1.33 0.71 -0.00 0.00 -1.09 0.00 0.00 36.82 37.77 1wtc h ILE 314 CO 0.81 0.00 -0.33 -0.33 -1.08 0.00 0.00 178.15 177.22 1wtc h GLU 315 N 0.00 0.58 -0.43 2.19 4.39 -1.99 -0.18 114.58 119.14 1wtc h GLU 315 Ca 0.24 -0.35 -0.14 0.00 0.34 0.00 0.00 59.36 59.44 1wtc h GLU 315 Cb 1.03 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1wtc h GLU 315 CO -0.00 0.96 -0.28 0.00 -1.16 0.00 0.00 179.01 178.53 1wtc h ARG 316 N 0.25 0.93 -0.13 2.33 3.08 -1.62 -1.25 114.38 117.97 1wtc h ARG 316 Ca 0.02 -0.42 0.02 0.00 0.07 0.00 0.00 59.98 59.66 1wtc h ARG 316 Cb 0.92 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.93 1wtc h ARG 316 CO 0.08 1.08 0.02 -0.92 -1.07 0.00 0.00 179.97 179.16 1wtc h TYR 317 N 0.79 0.03 -0.91 3.04 3.20 -0.91 0.22 116.97 122.42 1wtc h TYR 317 Ca 0.09 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.98 1wtc h TYR 317 Cb 0.85 0.01 -0.05 0.00 1.54 0.00 0.00 36.73 39.08 1wtc h TYR 317 CO 0.05 0.00 0.60 0.00 -1.64 0.00 0.00 178.16 177.18 1wtc h ALA 318 N 1.10 1.16 -0.03 1.82 0.00 -0.93 -0.52 119.26 121.86 1wtc h ALA 318 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wtc h ALA 318 Cb 0.06 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1wtc h ALA 318 CO -0.09 0.54 0.02 1.25 0.00 0.00 0.00 179.25 180.97 1wtc h HIS 319 N 1.22 0.05 -0.64 0.00 -0.00 -0.53 -2.52 115.15 112.73 1wtc h HIS 319 Ca 0.34 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.64 1wtc h HIS 319 Cb -0.13 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.24 1wtc h HIS 319 CO -0.01 0.14 0.14 0.74 -0.00 0.00 0.00 177.93 178.94 1wtc h PHE 320 N -0.05 1.10 -0.04 5.26 0.04 -0.27 -2.74 116.94 120.24 1wtc h PHE 320 Ca 0.01 -0.14 0.01 0.00 2.80 0.00 0.00 57.97 60.65 1wtc h PHE 320 Cb 0.10 -0.31 -0.00 0.00 2.20 0.00 0.00 35.95 37.95 1wtc h PHE 320 CO -0.04 0.92 0.03 -0.07 -0.60 0.00 0.00 178.31 178.55 1wtc h LEU 321 N 0.96 0.00 -2.03 1.54 3.38 -0.97 -1.44 115.31 116.75 1wtc h LEU 321 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1wtc h LEU 321 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1wtc h LEU 321 CO 0.01 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 1wtc n SER 322 N -4.20 3.03 -0.01 -0.43 3.41 -0.96 -5.03 113.62 109.43 1wtc n SER 322 Ca -0.02 -1.93 0.16 0.00 -0.26 0.00 0.00 58.87 56.81 1wtc n SER 322 Cb 0.12 -0.23 0.94 0.00 -0.26 0.00 0.00 64.21 64.78 1wtc n SER 322 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88