#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wke s PRO 12 N 0.00 1.10 0.15 -0.14 0.04 -1.26 -4.60 135.00 130.29 1wke s PRO 12 Ca 0.00 0.44 -0.09 0.00 0.04 0.00 0.00 61.00 61.39 1wke s PRO 12 Cb 0.00 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 1wke s PRO 12 CO 0.00 -2.25 1.49 -0.09 0.04 0.00 0.00 177.00 176.18 1wke h ARG 13 N -1.54 0.87 -1.60 4.56 2.43 -1.86 -1.96 114.38 115.28 1wke h ARG 13 Ca -0.51 -0.47 0.10 0.00 -0.81 0.00 0.00 59.98 58.29 1wke h ARG 13 Cb 1.32 0.02 -0.25 0.00 -0.42 0.00 0.00 29.97 30.64 1wke h ARG 13 CO 0.60 1.11 0.23 0.12 -1.51 0.00 0.00 179.97 180.52 1wke s PHE 14 N -4.33 -0.77 -0.20 2.20 5.36 -1.24 -4.24 117.98 114.75 1wke s PHE 14 Ca -0.10 1.49 -0.05 0.00 -0.96 0.00 0.00 56.93 57.30 1wke s PHE 14 Cb 0.11 0.46 0.10 0.00 -0.34 0.00 0.00 43.02 43.35 1wke s PHE 14 CO 0.87 -0.38 0.37 0.45 -1.46 0.00 0.00 175.22 175.07 1wke s SER 15 N 1.71 0.06 -0.21 6.13 0.15 -0.68 -4.97 113.70 115.89 1wke s SER 15 Ca -0.08 0.66 -0.05 0.00 0.70 0.00 0.00 55.95 57.17 1wke s SER 15 Cb -0.05 1.12 -0.02 0.00 -1.71 0.00 0.00 66.02 65.36 1wke s SER 15 CO -0.17 -0.26 0.01 0.12 1.20 0.00 0.00 173.24 174.14 1wke s PHE 16 N 2.55 3.04 -0.09 3.44 5.36 -1.26 -0.63 117.98 130.39 1wke s PHE 16 Ca 0.03 -0.50 0.03 0.00 -0.96 0.00 0.00 56.93 55.54 1wke s PHE 16 Cb -0.13 -2.11 0.00 0.00 -0.34 0.00 0.00 43.02 40.44 1wke s PHE 16 CO -0.13 -0.28 -0.20 -1.12 -1.46 0.00 0.00 175.22 172.02 1wke s SER 17 N 1.13 2.71 -0.34 6.13 0.01 -0.10 -4.99 113.70 118.25 1wke s SER 17 Ca 0.03 -0.49 -0.16 0.00 1.31 0.00 0.00 55.95 56.64 1wke s SER 17 Cb -0.14 -1.24 -0.01 0.00 0.21 0.00 0.00 66.02 64.84 1wke s SER 17 CO 0.01 0.12 0.42 -0.63 0.41 0.00 0.00 173.24 173.57 1wke s ILE 18 N 0.46 5.11 -0.01 1.44 1.01 -1.26 -0.80 121.20 127.15 1wke s ILE 18 Ca -0.17 0.16 0.11 0.00 0.00 0.00 0.00 60.65 60.76 1wke s ILE 18 Cb -0.17 -3.88 -0.21 0.00 0.01 0.00 0.00 42.46 38.21 1wke s ILE 18 CO 0.07 -0.14 0.86 0.00 0.00 0.00 0.00 174.94 175.73 1wke h ALA 19 N 8.46 0.65 -2.70 9.38 0.00 -1.09 -3.48 119.26 130.48 1wke h ALA 19 Ca -0.29 -1.26 -0.06 0.00 0.00 0.00 0.00 54.91 53.30 1wke h ALA 19 Cb 1.14 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 19.08 1wke h ALA 19 CO 0.72 1.44 -0.13 0.00 0.00 0.00 0.00 179.25 181.28 1wke s ALA 20 N -2.66 -0.80 0.03 0.00 0.00 -0.92 -5.01 121.76 112.40 1wke s ALA 20 Ca -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 1wke s ALA 20 Cb 0.09 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1wke s ALA 20 CO 0.82 -0.61 0.02 1.03 0.00 0.00 0.00 175.76 177.02 1wke s ARG 21 N -3.74 0.47 -0.26 0.00 0.52 -1.26 -1.33 118.95 113.35 1wke s ARG 21 Ca 0.03 -0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 54.45 1wke s ARG 21 Cb 0.02 0.18 0.14 0.00 0.52 0.00 0.00 34.95 35.81 1wke s ARG 21 CO -0.11 -0.10 0.38 -2.00 0.02 0.00 0.00 175.30 173.49 1wke s GLU 22 N -2.37 0.37 7.44 3.54 2.12 -0.43 -4.91 118.70 124.45 1wke s GLU 22 Ca -0.07 0.33 0.00 0.00 0.36 0.00 0.00 54.97 55.59 1wke s GLU 22 Cb -0.03 -0.44 0.00 0.00 0.26 0.00 0.00 34.13 33.92 1wke s GLU 22 CO -0.04 -0.81 0.00 0.41 -0.54 0.00 0.00 175.26 174.28 1wke n GLY 23 N 5.36 2.69 0.04 -1.50 0.00 -1.26 -1.65 105.19 108.87 1wke n GLY 23 Ca -0.02 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1wke n GLY 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wke n LYS 24 N 13.36 0.17 -2.51 1.61 5.02 -1.26 -4.92 118.16 129.64 1wke n LYS 24 Ca 0.00 0.06 -0.37 0.00 -2.02 0.00 0.00 58.31 55.99 1wke n LYS 24 Cb 0.00 -1.62 -0.04 0.00 -0.02 0.00 0.00 35.03 33.35 1wke n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wke s ALA 25 N -3.09 3.07 0.02 7.82 0.00 -0.66 -3.48 121.76 125.44 1wke s ALA 25 Ca 0.09 0.73 -0.15 0.00 0.00 0.00 0.00 51.96 52.63 1wke s ALA 25 Cb 0.15 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 20.01 1wke s ALA 25 CO 0.69 -0.27 0.33 -0.98 0.00 0.00 0.00 175.76 175.53 1wke s ARG 26 N -2.53 0.77 0.04 0.00 3.03 -1.26 -1.31 118.95 117.69 1wke s ARG 26 Ca 0.58 -0.33 0.05 0.00 2.03 0.00 0.00 55.73 58.07 1wke s ARG 26 Cb -0.23 0.34 -0.02 0.00 -1.03 0.00 0.00 34.95 34.01 1wke s ARG 26 CO 0.28 -0.24 -0.15 -0.08 -1.13 0.00 0.00 175.30 173.98 1wke s THR 27 N -1.99 1.21 0.00 4.99 -1.32 -0.44 -4.11 115.64 113.97 1wke s THR 27 Ca -0.09 -1.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.35 1wke s THR 27 Cb -0.03 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 1wke s THR 27 CO 0.00 0.03 0.00 0.61 -2.21 0.00 0.00 174.62 173.06 1wke n GLY 28 N 1.87 1.71 3.18 6.08 0.00 -0.79 -0.43 105.19 116.81 1wke n GLY 28 Ca -0.18 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.43 1wke n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wke s THR 29 N -0.99 0.12 -0.16 2.61 -4.23 0.02 -0.98 115.64 112.04 1wke s THR 29 Ca 0.00 -1.03 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 1wke s THR 29 Cb 0.00 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.79 1wke s THR 29 CO 0.00 -0.57 -0.20 -0.63 -0.54 0.00 0.00 174.62 172.69 1wke s ILE 30 N -3.03 1.97 -0.19 2.99 1.01 0.68 -0.93 121.20 123.71 1wke s ILE 30 Ca -0.01 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 59.63 1wke s ILE 30 Cb 0.01 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 1wke s ILE 30 CO -0.06 0.53 0.15 -1.61 0.00 0.00 0.00 174.94 173.95 1wke s GLU 31 N 1.12 4.12 0.20 2.79 2.02 0.20 -0.24 118.70 128.91 1wke s GLU 31 Ca -0.00 -0.17 0.01 0.00 0.02 0.00 0.00 54.97 54.83 1wke s GLU 31 Cb -0.14 -3.40 -0.05 0.00 0.10 0.00 0.00 34.13 30.65 1wke s GLU 31 CO -0.08 0.34 0.05 -1.64 0.02 0.00 0.00 175.26 173.96 1wke s MET 32 N 0.23 1.19 0.40 1.61 -1.94 -0.27 -1.69 119.30 118.82 1wke s MET 32 Ca 0.10 -1.60 0.09 0.00 -1.71 0.00 0.00 55.69 52.57 1wke s MET 32 Cb -0.11 -0.12 0.88 0.00 2.01 0.00 0.00 34.83 37.49 1wke s MET 32 CO -0.01 -0.23 1.98 0.87 -0.01 0.00 0.00 175.02 177.62 1wke h LYS 33 N 2.62 0.56 -0.00 2.03 1.57 -1.53 -2.26 116.57 119.55 1wke h LYS 33 Ca -0.37 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1wke h LYS 33 Cb 1.22 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1wke h LYS 33 CO 0.60 0.37 -0.30 0.54 -0.57 0.00 0.00 179.45 180.10 1wke n ARG 34 N -4.48 0.47 0.00 3.15 1.74 -1.26 -4.74 116.66 111.54 1wke n ARG 34 Ca 0.09 -0.24 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1wke n ARG 34 Cb 0.26 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 1wke n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wke n GLY 35 N 1.40 -0.08 3.79 -0.13 0.00 -0.85 -4.18 105.19 105.14 1wke n GLY 35 Ca 0.10 -1.33 -0.36 0.00 0.00 0.00 0.00 46.02 44.43 1wke n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wke s VAL 36 N -1.93 5.06 -0.18 1.61 1.01 -1.26 -1.11 120.40 123.59 1wke s VAL 36 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 1wke s VAL 36 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1wke s VAL 36 CO 0.00 0.60 -0.12 -0.63 0.00 0.00 0.00 175.10 174.94 1wke s ILE 37 N -0.85 2.77 0.05 2.22 1.01 0.67 -4.88 121.20 122.20 1wke s ILE 37 Ca 0.13 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.85 1wke s ILE 37 Cb -0.12 -2.21 -0.06 0.00 0.01 0.00 0.00 42.46 40.08 1wke s ILE 37 CO 0.03 0.49 0.67 -0.13 0.00 0.00 0.00 174.94 176.00 1wke s ARG 38 N 1.17 4.38 0.07 2.79 0.52 -1.26 -0.23 118.95 126.39 1wke s ARG 38 Ca 0.01 0.90 0.08 0.00 -0.52 0.00 0.00 55.73 56.21 1wke s ARG 38 Cb -0.14 -3.31 -0.03 0.00 0.52 0.00 0.00 34.95 31.98 1wke s ARG 38 CO -0.05 0.44 -0.23 0.95 0.02 0.00 0.00 175.30 176.44 1wke s THR 39 N -0.52 1.85 0.38 0.02 -4.23 -0.16 -3.68 115.64 109.32 1wke s THR 39 Ca 0.33 -1.42 -0.28 0.00 -1.18 0.00 0.00 61.69 59.14 1wke s THR 39 Cb -0.20 -1.63 -0.11 0.00 1.34 0.00 0.00 72.50 71.90 1wke s THR 39 CO 0.21 0.14 1.47 -2.84 -0.54 0.00 0.00 174.62 173.06 1wke s PRO 40 N -1.54 4.07 0.08 3.99 0.02 -1.26 -1.89 135.00 138.46 1wke s PRO 40 Ca 0.09 2.54 0.10 0.00 0.02 0.00 0.00 61.00 63.75 1wke s PRO 40 Cb -0.10 -2.94 -0.03 0.00 0.02 0.00 0.00 34.50 31.46 1wke s PRO 40 CO 0.03 -0.55 -0.26 0.00 -0.33 0.00 0.00 177.00 175.89 1wke s ALA 41 N -1.13 2.20 -0.09 -1.55 0.00 0.42 -4.85 121.76 116.76 1wke s ALA 41 Ca 0.54 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 51.21 1wke s ALA 41 Cb -0.46 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.23 1wke s ALA 41 CO 0.62 0.51 -0.16 0.12 0.00 0.00 0.00 175.76 176.85 1wke s PHE 42 N -0.91 2.71 -0.25 0.00 5.36 -1.26 -1.50 117.98 122.12 1wke s PHE 42 Ca 0.12 -0.49 -0.03 0.00 -0.96 0.00 0.00 56.93 55.56 1wke s PHE 42 Cb -0.10 -1.72 0.01 0.00 -0.34 0.00 0.00 43.02 40.87 1wke s PHE 42 CO 0.03 -0.07 -0.02 -1.64 -1.46 0.00 0.00 175.22 172.06 1wke s MET 43 N -0.13 3.06 0.44 10.12 -1.94 0.08 -4.74 119.30 126.19 1wke s MET 43 Ca -0.02 -0.84 -0.25 0.00 -1.71 0.00 0.00 55.69 52.87 1wke s MET 43 Cb -0.14 -3.08 -0.08 0.00 2.01 0.00 0.00 34.83 33.54 1wke s MET 43 CO 0.04 -0.35 1.28 -2.14 -0.01 0.00 0.00 175.02 173.84 1wke s PRO 44 N 1.41 3.81 -0.19 2.03 0.02 -1.25 -4.01 135.00 136.82 1wke s PRO 44 Ca 0.02 2.09 -0.19 0.00 0.02 0.00 0.00 61.00 62.94 1wke s PRO 44 Cb -0.16 -2.62 -0.03 0.00 0.02 0.00 0.00 34.50 31.71 1wke s PRO 44 CO -0.03 -0.60 0.53 0.08 -0.33 0.00 0.00 177.00 176.66 1wke s VAL 45 N -1.32 5.10 -0.43 3.83 1.01 -1.26 -0.86 120.40 126.47 1wke s VAL 45 Ca 0.60 1.00 -0.07 0.00 0.00 0.00 0.00 61.98 63.51 1wke s VAL 45 Cb -0.36 -3.86 0.10 0.00 0.00 0.00 0.00 36.38 32.26 1wke s VAL 45 CO 0.46 0.18 0.26 -0.83 0.00 0.00 0.00 175.10 175.17 1wke s GLY 46 N 1.10 1.99 -0.00 4.51 0.00 0.11 -4.40 107.32 110.63 1wke s GLY 46 Ca 0.25 -2.38 -0.05 0.00 0.00 0.00 0.00 44.72 42.54 1wke s GLY 46 CO 0.10 1.02 0.62 -0.84 0.00 0.00 0.00 173.10 174.00 1wke h THR 47 N 6.20 0.00 -2.16 0.90 2.02 -1.75 -2.54 112.91 115.58 1wke h THR 47 Ca -0.19 -0.12 -0.74 0.00 0.77 0.00 0.00 66.41 66.13 1wke h THR 47 Cb 1.07 0.00 -0.31 0.00 -1.74 0.00 0.00 68.15 67.16 1wke h THR 47 CO 0.77 0.00 0.55 0.00 0.37 0.00 0.00 175.52 177.20 1wke n ALA 48 N -2.19 5.78 -2.88 6.16 0.00 -1.26 -3.76 120.51 122.36 1wke n ALA 48 Ca -0.02 -4.53 -0.20 0.00 0.00 0.00 0.00 53.44 48.69 1wke n ALA 48 Cb 0.08 -1.71 0.03 0.00 0.00 0.00 0.00 19.45 17.84 1wke n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wke n ALA 49 N -0.22 -0.84 -3.62 0.00 0.00 -1.26 -4.98 120.51 109.59 1wke n ALA 49 Ca 0.44 0.25 -0.12 0.00 0.00 0.00 0.00 53.44 54.01 1wke n ALA 49 Cb 0.31 -3.40 -0.07 0.00 0.00 0.00 0.00 19.45 16.29 1wke n ALA 49 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1wke s THR 50 N -3.10 0.00 -0.42 0.00 -1.32 -1.26 -4.73 115.64 104.81 1wke s THR 50 Ca 0.24 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.50 1wke s THR 50 Cb -0.11 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.90 1wke s THR 50 CO 0.30 0.00 0.72 -0.69 -2.21 0.00 0.00 174.62 172.74 1wke s VAL 51 N 0.09 4.75 -0.33 5.08 1.01 -1.26 -2.72 120.40 127.02 1wke s VAL 51 Ca 0.01 0.45 -0.31 0.00 0.00 0.00 0.00 61.98 62.13 1wke s VAL 51 Cb -0.04 -4.23 -0.13 0.00 0.00 0.00 0.00 36.38 31.97 1wke s VAL 51 CO -0.02 -0.57 1.09 0.29 0.00 0.00 0.00 175.10 175.89 1wke n LYS 52 N 6.44 0.00 -1.33 2.72 4.01 -1.26 -1.65 118.16 127.08 1wke n LYS 52 Ca 0.01 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.69 1wke n LYS 52 Cb 0.48 -0.99 -0.05 0.00 -0.51 0.00 0.00 35.03 33.97 1wke n LYS 52 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1wke n ALA 53 N 2.86 -0.17 -2.97 7.82 0.00 -1.26 -4.97 120.51 121.82 1wke n ALA 53 Ca 0.22 0.19 -0.20 0.00 0.00 0.00 0.00 53.44 53.64 1wke n ALA 53 Cb -0.04 -1.57 -0.15 0.00 0.00 0.00 0.00 19.45 17.69 1wke n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wke s LEU 54 N -2.61 1.83 0.53 0.00 1.43 -0.66 -4.55 118.68 114.65 1wke s LEU 54 Ca 0.00 -0.18 -0.19 0.00 -1.03 0.00 0.00 54.13 52.73 1wke s LEU 54 Cb 0.00 -0.54 -0.06 0.00 0.03 0.00 0.00 46.19 45.62 1wke s LEU 54 CO 0.00 0.07 1.06 -0.54 0.23 0.00 0.00 176.35 177.17 1wke s LYS 55 N 0.12 3.55 0.30 1.70 1.02 -1.26 -4.46 119.74 120.72 1wke s LYS 55 Ca -0.02 1.35 0.04 0.00 0.02 0.00 0.00 55.97 57.36 1wke s LYS 55 Cb -0.08 -2.06 0.66 0.00 -0.52 0.00 0.00 37.83 35.83 1wke s LYS 55 CO 0.00 -0.64 1.83 -1.35 -0.92 0.00 0.00 175.35 174.27 1wke h PRO 56 N 1.11 0.85 -0.24 -1.68 0.11 -1.85 0.32 132.00 130.61 1wke h PRO 56 Ca -0.49 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 1wke h PRO 56 Cb 1.23 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1wke h PRO 56 CO 0.58 0.56 0.09 1.05 -0.21 0.00 0.00 178.00 180.07 1wke h GLU 57 N 0.88 0.33 -0.04 1.05 4.11 -1.92 -0.53 114.58 118.46 1wke h GLU 57 Ca 0.51 -0.03 -0.20 0.00 0.07 0.00 0.00 59.36 59.71 1wke h GLU 57 Cb 0.65 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1wke h GLU 57 CO -0.28 0.28 -0.82 1.15 0.07 0.00 0.00 179.01 179.42 1wke h THR 58 N 0.33 1.40 -0.52 -1.06 2.02 -1.32 -0.42 112.91 113.35 1wke h THR 58 Ca 0.09 -2.29 -0.06 0.00 0.77 0.00 0.00 66.41 64.91 1wke h THR 58 Cb 0.08 2.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.72 1wke h THR 58 CO -0.01 0.69 0.10 0.58 0.37 0.00 0.00 175.52 177.25 1wke h VAL 59 N 0.24 1.25 -0.38 3.16 2.07 -0.81 -2.40 116.25 119.38 1wke h VAL 59 Ca -0.05 -0.90 -0.11 0.00 0.82 0.00 0.00 66.70 66.46 1wke h VAL 59 Cb 1.42 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1wke h VAL 59 CO 0.14 0.32 -0.21 -0.09 0.02 0.00 0.00 177.57 177.75 1wke h ARG 60 N 0.72 0.74 -0.02 1.57 9.65 -1.01 -2.88 114.38 123.15 1wke h ARG 60 Ca 0.16 -0.29 -0.01 0.00 -1.10 0.00 0.00 59.98 58.74 1wke h ARG 60 Cb 0.37 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1wke h ARG 60 CO 0.01 0.89 -0.03 0.00 2.80 0.00 0.00 179.97 183.64 1wke h ALA 61 N 1.12 1.92 0.00 2.80 0.00 -0.80 -0.61 119.26 123.68 1wke h ALA 61 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1wke h ALA 61 Cb 0.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1wke h ALA 61 CO 0.05 0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.62 1wke n THR 62 N -4.49 0.22 0.00 0.00 -2.24 -0.93 -4.88 114.28 101.96 1wke n THR 62 Ca -0.03 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1wke n THR 62 Cb 0.12 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 1wke n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wke n GLY 63 N 1.04 0.82 3.74 3.38 0.00 -0.24 -4.66 105.19 109.28 1wke n GLY 63 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1wke n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wke s ALA 64 N -2.00 3.70 -0.27 4.61 0.00 -1.18 -4.92 121.76 121.70 1wke s ALA 64 Ca 0.00 1.42 0.20 0.00 0.00 0.00 0.00 51.96 53.57 1wke s ALA 64 Cb 0.00 -3.60 -0.28 0.00 0.00 0.00 0.00 23.12 19.24 1wke s ALA 64 CO 0.00 -0.83 0.54 -0.25 0.00 0.00 0.00 175.76 175.22 1wke n ASP 65 N 2.59 0.59 -3.59 0.00 8.00 -1.26 -4.63 116.55 118.24 1wke n ASP 65 Ca 0.09 -0.26 -0.16 0.00 0.71 0.00 0.00 54.79 55.17 1wke n ASP 65 Cb 0.39 1.66 -0.06 0.00 -0.02 0.00 0.00 41.12 43.09 1wke n ASP 65 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1wke s ILE 66 N -3.22 0.02 0.28 0.53 2.07 -1.26 -4.17 121.20 115.44 1wke s ILE 66 Ca -0.03 -0.18 0.07 0.00 -1.41 0.00 0.00 60.65 59.09 1wke s ILE 66 Cb 0.13 -0.90 -0.06 0.00 0.13 0.00 0.00 42.46 41.77 1wke s ILE 66 CO 0.81 -0.10 -0.07 0.27 -1.91 0.00 0.00 174.94 173.95 1wke s ILE 67 N -1.57 1.68 -0.15 2.00 -4.36 -1.19 -3.97 121.20 113.63 1wke s ILE 67 Ca -0.10 -2.14 -0.06 0.00 -0.26 0.00 0.00 60.65 58.10 1wke s ILE 67 Cb -0.01 -2.43 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 1wke s ILE 67 CO 0.05 -0.31 0.05 -0.22 0.24 0.00 0.00 174.94 174.75 1wke s LEU 68 N -3.44 3.77 -0.00 0.37 0.20 -0.04 -1.55 118.68 117.99 1wke s LEU 68 Ca 0.29 0.12 -0.00 0.00 0.69 0.00 0.00 54.13 55.24 1wke s LEU 68 Cb 0.03 -1.92 -0.04 0.00 -0.43 0.00 0.00 46.19 43.83 1wke s LEU 68 CO 0.12 0.25 0.07 -0.83 -0.29 0.00 0.00 176.35 175.67 1wke s GLY 69 N -0.11 1.99 -0.27 7.98 0.00 0.18 0.10 107.32 117.18 1wke s GLY 69 Ca 0.06 -0.89 -0.15 0.00 0.00 0.00 0.00 44.72 43.75 1wke s GLY 69 CO 0.01 -0.76 0.38 -1.31 0.00 0.00 0.00 173.10 171.43 1wke s ASN 70 N -1.72 6.26 0.15 1.64 0.02 -0.96 -2.28 114.94 118.06 1wke s ASN 70 Ca 0.22 0.30 0.15 0.00 -1.02 0.00 0.00 52.86 52.51 1wke s ASN 70 Cb -0.12 -2.22 -0.07 0.00 0.02 0.00 0.00 41.25 38.86 1wke s ASN 70 CO 0.13 -0.20 1.11 0.74 0.02 0.00 0.00 177.10 178.91 1wke h THR 71 N 5.39 0.79 0.02 1.60 2.02 -1.87 -2.76 112.91 118.10 1wke h THR 71 Ca -0.31 -2.27 -0.05 0.00 0.77 0.00 0.00 66.41 64.54 1wke h THR 71 Cb 1.16 2.29 0.00 0.00 -1.74 0.00 0.00 68.15 69.87 1wke h THR 71 CO 0.65 0.45 -0.20 0.22 0.37 0.00 0.00 175.52 177.01 1wke h TYR 72 N 0.00 0.17 -0.21 3.16 3.20 -1.88 -2.86 116.97 118.55 1wke h TYR 72 Ca -0.09 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.67 1wke h TYR 72 Cb 1.55 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 1wke h TYR 72 CO 0.00 0.97 0.10 0.45 -1.64 0.00 0.00 178.16 178.04 1wke h HIS 73 N -0.69 0.30 0.00 -3.82 3.86 -1.85 -2.81 115.15 110.13 1wke h HIS 73 Ca -0.03 -0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.09 1wke h HIS 73 Cb 1.04 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 1wke h HIS 73 CO 0.22 0.31 -0.36 -0.07 0.86 0.00 0.00 177.93 178.88 1wke h LEU 74 N 0.20 0.00 -1.05 2.43 3.38 -1.60 -0.11 115.31 118.56 1wke h LEU 74 Ca 0.07 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1wke h LEU 74 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1wke h LEU 74 CO -0.01 0.36 -0.35 0.00 0.09 0.00 0.00 178.44 178.53 1wke h MET 75 N 0.00 0.00 0.00 1.13 -0.00 -1.26 0.10 114.93 114.91 1wke h MET 75 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 59.70 59.59 1wke h MET 75 Cb 0.65 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.24 1wke h MET 75 CO 0.05 0.35 -0.60 -0.07 -0.00 0.00 0.00 176.91 176.64 1wke h LEU 76 N 0.00 0.01 -7.41 -0.10 3.38 -1.22 -3.36 115.31 106.61 1wke h LEU 76 Ca -0.00 -0.78 -0.34 0.00 0.09 0.00 0.00 57.88 56.85 1wke h LEU 76 Cb 0.83 -0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.21 1wke h LEU 76 CO 0.05 1.24 -0.74 -0.13 0.09 0.00 0.00 178.44 178.95 1wke s ARG 77 N -2.29 -0.05 0.00 1.13 0.52 -0.11 -4.06 118.95 114.10 1wke s ARG 77 Ca -0.23 0.29 0.28 0.00 -0.52 0.00 0.00 55.73 55.55 1wke s ARG 77 Cb 0.01 -0.39 1.24 0.00 0.52 0.00 0.00 34.95 36.33 1wke s ARG 77 CO 0.65 -0.25 1.85 -0.35 0.02 0.00 0.00 175.30 177.21 1wke n PRO 78 N 4.78 1.49 0.00 3.54 -0.04 -1.23 -3.87 135.00 139.66 1wke n PRO 78 Ca -0.15 -0.72 0.00 0.00 -0.04 0.00 0.00 63.50 62.60 1wke n PRO 78 Cb 0.50 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1wke n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wke n GLY 79 N 1.12 2.97 0.19 0.55 0.00 0.36 -4.63 105.19 105.74 1wke n GLY 79 Ca 0.20 -1.54 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 1wke n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wke h ALA 80 N 0.00 0.49 -0.57 4.61 0.00 -1.72 -2.38 119.26 119.69 1wke h ALA 80 Ca 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1wke h ALA 80 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1wke h ALA 80 CO 0.00 0.12 0.34 0.93 0.00 0.00 0.00 179.25 180.64 1wke h GLU 81 N 0.46 0.77 -0.57 0.00 3.07 -1.92 -1.69 114.58 114.70 1wke h GLU 81 Ca 0.12 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 1wke h GLU 81 Cb 0.23 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.95 1wke h GLU 81 CO -0.01 0.55 0.30 -0.09 -1.40 0.00 0.00 179.01 178.37 1wke h ARG 82 N 0.77 0.79 -0.28 2.33 2.43 -1.80 -1.21 114.38 117.41 1wke h ARG 82 Ca 0.20 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1wke h ARG 82 Cb -0.02 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1wke h ARG 82 CO -0.04 0.62 0.17 0.82 -1.51 0.00 0.00 179.97 180.03 1wke h ILE 83 N 0.76 1.10 -0.38 1.20 2.04 -1.23 -0.84 117.51 120.16 1wke h ILE 83 Ca 0.20 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.87 1wke h ILE 83 Cb 0.06 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 1wke h ILE 83 CO -0.03 0.10 0.13 0.00 0.00 0.00 0.00 178.15 178.35 1wke h ALA 84 N 1.06 0.45 -0.84 1.87 0.00 -1.08 0.92 119.26 121.63 1wke h ALA 84 Ca 0.10 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1wke h ALA 84 Cb 0.01 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1wke h ALA 84 CO -0.02 -0.26 0.55 -0.22 0.00 0.00 0.00 179.25 179.30 1wke h LYS 85 N 0.28 0.91 0.00 0.00 3.64 -0.81 0.49 116.57 121.08 1wke h LYS 85 Ca 0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1wke h LYS 85 Cb 0.16 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1wke h LYS 85 CO -0.19 0.60 0.00 1.28 -2.27 0.00 0.00 179.45 178.88 1wke n LEU 86 N -4.48 0.00 0.00 5.20 4.32 -0.36 -4.87 117.00 116.81 1wke n LEU 86 Ca 0.12 0.39 0.00 0.00 -0.02 0.00 0.00 56.01 56.51 1wke n LEU 86 Cb 0.20 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 1wke n LEU 86 CO 0.33 -0.07 0.00 0.61 -1.22 0.00 0.00 177.39 177.04 1wke n GLY 87 N 0.88 0.98 0.00 -0.72 0.00 0.16 -4.74 105.19 101.75 1wke n GLY 87 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1wke n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wke n GLY 88 N -0.31 1.99 0.31 -0.02 0.00 0.20 -4.55 105.19 102.82 1wke n GLY 88 Ca 0.00 -1.94 -0.06 0.00 0.00 0.00 0.00 46.02 44.01 1wke n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wke h LEU 89 N 0.00 0.99 -0.16 0.99 5.85 -1.25 -1.25 115.31 120.47 1wke h LEU 89 Ca 0.00 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.58 1wke h LEU 89 Cb 0.00 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1wke h LEU 89 CO 0.00 0.89 -0.01 0.45 -0.34 0.00 0.00 178.44 179.43 1wke h HIS 90 N 1.02 -0.03 -0.41 1.25 3.86 -1.78 -0.12 115.15 118.94 1wke h HIS 90 Ca 0.24 0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.31 1wke h HIS 90 Cb 0.21 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 1wke h HIS 90 CO 0.02 -0.04 -0.33 1.03 0.86 0.00 0.00 177.93 179.47 1wke h SER 91 N 0.04 0.99 0.08 2.45 0.87 -1.79 -0.56 113.55 115.64 1wke h SER 91 Ca 0.08 -0.43 -0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1wke h SER 91 Cb 0.10 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1wke h SER 91 CO -0.14 1.22 -0.04 0.15 -0.53 0.00 0.00 176.83 177.49 1wke h PHE 92 N 0.78 -0.10 -0.00 2.24 3.57 -0.75 -3.26 116.94 119.41 1wke h PHE 92 Ca 0.08 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1wke h PHE 92 Cb 0.92 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.69 1wke h PHE 92 CO 0.06 -0.02 -0.65 0.00 -2.23 0.00 0.00 178.31 175.46 1wke n MET 93 N -5.12 0.04 -1.45 1.11 0.00 -0.10 -4.99 117.12 106.61 1wke n MET 93 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.60 1wke n MET 93 Cb 0.09 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.81 1wke n MET 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1wke n GLY 94 N 1.49 0.62 3.18 3.17 0.00 -0.32 -4.74 105.19 108.58 1wke n GLY 94 Ca 0.05 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.96 1wke n GLY 94 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1wke s TRP 95 N -2.00 3.08 -2.54 1.61 -0.11 -0.57 -4.75 118.94 113.66 1wke s TRP 95 Ca 0.00 -1.67 0.23 0.00 1.22 0.00 0.00 56.10 55.88 1wke s TRP 95 Cb 0.00 -2.04 0.43 0.00 -1.50 0.00 0.00 33.47 30.36 1wke s TRP 95 CO 0.00 -0.76 1.40 -0.40 -4.62 0.00 0.00 176.95 172.57 1wke n ASP 96 N 4.64 3.26 -4.92 5.86 5.68 -1.26 -4.37 116.55 125.42 1wke n ASP 96 Ca -0.16 -1.97 -0.20 0.00 -0.50 0.00 0.00 54.79 51.95 1wke n ASP 96 Cb 0.46 -0.20 0.06 0.00 -1.14 0.00 0.00 41.12 40.30 1wke n ASP 96 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1wke s ARG 97 N -1.59 2.23 0.67 0.11 0.52 -1.26 -4.87 118.95 114.75 1wke s ARG 97 Ca 0.37 -1.36 -0.17 0.00 -0.52 0.00 0.00 55.73 54.05 1wke s ARG 97 Cb 0.22 -2.56 -0.01 0.00 0.52 0.00 0.00 34.95 33.12 1wke s ARG 97 CO 0.31 -0.92 1.11 -0.35 0.02 0.00 0.00 175.30 175.47 1wke n PRO 98 N -2.36 0.83 -4.13 3.54 -0.04 -1.26 -4.95 135.00 126.63 1wke n PRO 98 Ca 0.14 0.34 -0.19 0.00 -0.04 0.00 0.00 63.50 63.74 1wke n PRO 98 Cb 0.61 -2.34 -0.16 0.00 -0.04 0.00 0.00 33.50 31.56 1wke n PRO 98 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1wke s ILE 99 N -1.58 0.47 -0.19 0.52 1.01 -1.26 -3.16 121.20 117.00 1wke s ILE 99 Ca 0.78 -0.09 -0.08 0.00 0.00 0.00 0.00 60.65 61.26 1wke s ILE 99 Cb -0.37 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.55 1wke s ILE 99 CO 0.45 0.21 0.08 -0.22 0.00 0.00 0.00 174.94 175.46 1wke s LEU 100 N 0.88 3.91 -0.12 2.97 0.20 -0.59 -1.18 118.68 124.75 1wke s LEU 100 Ca -0.11 0.11 -0.03 0.00 0.69 0.00 0.00 54.13 54.78 1wke s LEU 100 Cb -0.14 -2.00 -0.03 0.00 -0.43 0.00 0.00 46.19 43.59 1wke s LEU 100 CO -0.00 0.16 -0.02 0.42 -0.29 0.00 0.00 176.35 176.62 1wke s THR 101 N 0.46 4.13 0.78 3.68 -4.23 -0.80 0.47 115.64 120.13 1wke s THR 101 Ca 0.05 -0.29 -0.11 0.00 -1.18 0.00 0.00 61.69 60.15 1wke s THR 101 Cb -0.12 -2.78 0.06 0.00 1.34 0.00 0.00 72.50 71.00 1wke s THR 101 CO 0.00 0.54 1.08 -0.62 -0.54 0.00 0.00 174.62 175.09 1wke s ASP 102 N -0.21 4.56 0.37 3.99 2.15 -0.97 -3.24 116.67 123.33 1wke s ASP 102 Ca 0.05 1.62 0.26 0.00 0.43 0.00 0.00 52.55 54.91 1wke s ASP 102 Cb -0.13 -2.37 0.75 0.00 -0.30 0.00 0.00 42.92 40.87 1wke s ASP 102 CO 0.02 -1.97 1.74 0.77 -0.17 0.00 0.00 175.17 175.56 1wke h SER 103 N -1.08 0.00 0.00 -0.34 4.64 -1.85 -3.38 113.55 111.54 1wke h SER 103 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1wke h SER 103 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1wke h SER 103 CO 0.55 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.12 1wke n GLY 104 N 0.82 2.76 0.32 -0.77 0.00 -1.26 -4.84 105.19 102.22 1wke n GLY 104 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 1wke n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wke h GLY 105 N 0.00 1.28 0.74 -0.02 0.00 -1.91 -1.97 103.07 101.18 1wke h GLY 105 Ca 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1wke h GLY 105 CO 0.00 0.31 0.00 -1.82 0.00 0.00 0.00 176.54 175.03 1wke h TYR 106 N 1.02 0.08 0.00 5.60 3.20 -1.92 -2.99 116.97 121.96 1wke h TYR 106 Ca 0.36 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.16 1wke h TYR 106 Cb 0.09 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1wke h TYR 106 CO -0.03 0.33 -0.29 1.96 -1.64 0.00 0.00 178.16 178.49 1wke h GLN 107 N -0.20 0.00 0.19 1.82 4.20 -1.96 -2.47 115.11 116.69 1wke h GLN 107 Ca 0.01 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1wke h GLN 107 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 1wke h GLN 107 CO 0.00 0.29 -0.09 0.28 -0.67 0.00 0.00 178.83 178.64 1wke h VAL 108 N 0.00 0.85 0.00 -0.54 2.07 -1.33 0.37 116.25 117.68 1wke h VAL 108 Ca -0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1wke h VAL 108 Cb 0.74 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1wke h VAL 108 CO 0.04 0.05 0.00 0.80 0.02 0.00 0.00 177.57 178.48 1wke n MET 109 N -5.16 0.04 -0.04 1.57 0.00 -1.08 -1.19 117.12 111.26 1wke n MET 109 Ca -0.09 0.32 -0.03 0.00 -0.00 0.00 0.00 57.70 57.90 1wke n MET 109 Cb 0.16 -1.58 -0.08 0.00 0.00 0.00 0.00 33.22 31.71 1wke n MET 109 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1wke n SER 110 N -1.66 2.42 0.00 6.12 7.64 -0.87 -4.75 113.62 122.53 1wke n SER 110 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1wke n SER 110 Cb 0.16 0.90 0.00 0.00 -1.01 0.00 0.00 64.21 64.25 1wke n SER 110 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1wke n LEU 111 N -2.30 0.55 -4.90 -3.43 4.77 0.13 -5.06 117.00 106.76 1wke n LEU 111 Ca -0.14 -0.75 -0.31 0.00 -0.03 0.00 0.00 56.01 54.78 1wke n LEU 111 Cb 0.74 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.79 1wke n LEU 111 CO 0.22 0.14 0.08 -0.44 -1.33 0.00 0.00 177.39 176.06 1wke s SER 112 N -0.41 6.50 0.15 -1.43 0.01 -0.33 -4.20 113.70 113.99 1wke s SER 112 Ca 0.00 0.64 -0.11 0.00 1.31 0.00 0.00 55.95 57.79 1wke s SER 112 Cb 0.00 -2.11 -0.07 0.00 0.21 0.00 0.00 66.02 64.05 1wke s SER 112 CO 0.00 -0.01 0.50 -0.55 0.41 0.00 0.00 173.24 173.59 1wke s SER 113 N -2.58 6.69 -0.94 2.44 0.15 -0.39 -4.56 113.70 114.51 1wke s SER 113 Ca 0.42 0.92 -0.10 0.00 0.70 0.00 0.00 55.95 57.89 1wke s SER 113 Cb -0.12 -2.23 0.01 0.00 -1.71 0.00 0.00 66.02 61.98 1wke s SER 113 CO 0.25 0.06 0.63 0.18 1.20 0.00 0.00 173.24 175.56 1wke n LEU 114 N 0.49 -1.38 -4.77 3.45 4.77 -1.26 -0.70 117.00 117.60 1wke n LEU 114 Ca -0.04 -1.07 -0.39 0.00 -0.03 0.00 0.00 56.01 54.48 1wke n LEU 114 Cb 0.52 -1.62 -0.03 0.00 -2.33 0.00 0.00 43.42 39.96 1wke n LEU 114 CO 0.44 0.52 0.80 0.28 -1.33 0.00 0.00 177.39 178.09 1wke s THR 115 N -3.15 3.42 -0.29 -5.08 -1.32 -1.26 -4.32 115.64 103.65 1wke s THR 115 Ca 0.14 1.26 0.00 0.00 -1.21 0.00 0.00 61.69 61.89 1wke s THR 115 Cb -0.08 -3.74 0.09 0.00 -1.51 0.00 0.00 72.50 67.26 1wke s THR 115 CO 0.92 0.17 0.04 -0.75 -2.21 0.00 0.00 174.62 172.80 1wke s LYS 116 N -2.00 1.12 0.16 7.08 2.20 0.21 -4.96 119.74 123.55 1wke s LYS 116 Ca 0.52 -1.17 -0.25 0.00 -0.36 0.00 0.00 55.97 54.70 1wke s LYS 116 Cb -0.29 -2.43 -0.08 0.00 -1.51 0.00 0.00 37.83 33.52 1wke s LYS 116 CO 0.37 -0.84 0.77 -0.65 -0.36 0.00 0.00 175.35 174.64 1wke s GLN 117 N 1.42 4.56 0.30 4.03 -1.52 -1.26 -1.25 119.66 125.95 1wke s GLN 117 Ca 0.05 1.15 -0.17 0.00 -1.95 0.00 0.00 55.36 54.44 1wke s GLN 117 Cb -0.18 -3.26 0.02 0.00 -0.22 0.00 0.00 33.01 29.37 1wke s GLN 117 CO -0.15 0.57 0.67 -1.54 -0.25 0.00 0.00 175.29 174.59 1wke s SER 118 N -1.12 -0.08 0.43 5.90 1.04 -0.37 -5.01 113.70 114.50 1wke s SER 118 Ca 0.36 -0.87 0.21 0.00 0.48 0.00 0.00 55.95 56.12 1wke s SER 118 Cb -0.23 0.72 0.99 0.00 0.10 0.00 0.00 66.02 67.61 1wke s SER 118 CO 0.26 -1.39 1.89 -0.08 0.98 0.00 0.00 173.24 174.90 1wke h GLU 119 N 2.06 0.00 0.00 4.02 4.57 -2.03 -2.87 114.58 120.33 1wke h GLU 119 Ca -0.24 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.79 1wke h GLU 119 Cb 1.25 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.82 1wke h GLU 119 CO 0.31 0.26 -0.72 1.49 -1.18 0.00 0.00 179.01 179.18 1wke h GLU 120 N 0.00 0.00 0.00 1.92 4.81 -1.99 -3.50 114.58 115.83 1wke h GLU 120 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1wke h GLU 120 Cb 0.62 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1wke h GLU 120 CO 0.03 0.72 0.00 0.41 -0.73 0.00 0.00 179.01 179.44 1wke n GLY 121 N 0.84 -0.28 3.04 1.92 0.00 -1.09 -4.43 105.19 105.19 1wke n GLY 121 Ca -0.00 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 1wke n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wke s VAL 122 N -4.00 0.79 -0.03 1.61 0.11 -0.36 -1.23 120.40 117.29 1wke s VAL 122 Ca 0.00 -0.47 0.02 0.00 -2.93 0.00 0.00 61.98 58.60 1wke s VAL 122 Cb 0.00 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 1wke s VAL 122 CO 0.00 0.19 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.99 1wke s THR 123 N -0.30 3.55 0.29 5.04 2.01 -0.38 -0.89 115.64 124.97 1wke s THR 123 Ca 0.03 -0.65 -0.17 0.00 0.31 0.00 0.00 61.69 61.21 1wke s THR 123 Cb -0.04 -2.48 0.02 0.00 0.01 0.00 0.00 72.50 70.01 1wke s THR 123 CO -0.00 0.51 0.65 0.72 -0.69 0.00 0.00 174.62 175.81 1wke s PHE 124 N -0.87 0.10 -0.16 4.92 -0.71 0.03 0.65 117.98 121.94 1wke s PHE 124 Ca 0.14 -0.55 -0.02 0.00 -1.04 0.00 0.00 56.93 55.46 1wke s PHE 124 Cb -0.11 0.54 -0.02 0.00 -1.21 0.00 0.00 43.02 42.22 1wke s PHE 124 CO 0.04 -1.22 -0.08 0.15 -1.34 0.00 0.00 175.22 172.76 1wke s LYS 125 N -3.62 3.47 0.30 1.99 1.02 0.12 -3.91 119.74 119.11 1wke s LYS 125 Ca 0.16 -0.62 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 1wke s LYS 125 Cb -0.04 -2.80 -0.12 0.00 -0.52 0.00 0.00 37.83 34.34 1wke s LYS 125 CO 0.09 0.13 1.45 0.45 -0.92 0.00 0.00 175.35 176.55 1wke n SER 126 N 3.82 3.25 -0.77 2.83 2.88 -1.22 -1.26 113.62 123.15 1wke n SER 126 Ca -0.18 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 1wke n SER 126 Cb 0.52 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.46 1wke n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wke n HIS 127 N 1.40 0.00 -0.50 0.66 1.44 -1.26 -3.96 115.22 113.00 1wke n HIS 127 Ca 0.08 -0.24 0.00 0.00 -2.01 0.00 0.00 57.72 55.55 1wke n HIS 127 Cb 0.35 -0.17 0.00 0.00 0.12 0.00 0.00 29.99 30.30 1wke n HIS 127 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1wke n LEU 128 N 0.34 0.00 -2.69 2.39 -0.00 -1.26 -5.07 117.00 110.71 1wke n LEU 128 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 56.01 55.96 1wke n LEU 128 Cb 0.34 0.00 0.06 0.00 -0.00 0.00 0.00 43.42 43.82 1wke n LEU 128 CO 0.00 0.00 0.47 -0.67 -0.00 0.00 0.00 177.39 177.19 1wke n ASP 129 N 0.00 -1.78 0.00 1.45 2.03 -1.25 -5.10 116.55 111.90 1wke n ASP 129 Ca 0.00 -2.01 0.00 0.00 0.52 0.00 0.00 54.79 53.30 1wke n ASP 129 Cb 0.00 1.01 0.00 0.00 -0.72 0.00 0.00 41.12 41.41 1wke n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wke n GLY 130 N 1.82 1.51 2.69 0.27 0.00 -1.26 -4.74 105.19 105.48 1wke n GLY 130 Ca 0.06 -0.79 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 1wke n GLY 130 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wke n SER 131 N 4.42 -1.83 -4.55 1.61 2.88 -1.26 -3.43 113.62 111.45 1wke n SER 131 Ca 0.00 -2.36 -0.30 0.00 -1.33 0.00 0.00 58.87 54.87 1wke n SER 131 Cb 0.00 1.17 -0.05 0.00 -0.75 0.00 0.00 64.21 64.57 1wke n SER 131 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1wke n ARG 132 N 1.38 0.82 -0.10 -1.46 3.00 -1.26 -4.48 116.66 114.56 1wke n ARG 132 Ca 0.03 -0.22 -0.13 0.00 -0.01 0.00 0.00 57.85 57.53 1wke n ARG 132 Cb 0.69 -3.32 -0.04 0.00 0.00 0.00 0.00 32.46 29.79 1wke n ARG 132 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.63 178.75 1wke h HIS 133 N 17.23 0.80 -3.84 -1.55 2.07 -1.97 -3.40 115.15 124.49 1wke h HIS 133 Ca -0.16 -0.22 -0.68 0.00 -2.85 0.00 0.00 60.37 56.46 1wke h HIS 133 Cb 1.20 -0.18 -0.26 0.00 2.57 0.00 0.00 27.41 30.74 1wke h HIS 133 CO 1.03 0.94 -0.80 1.41 -3.07 0.00 0.00 177.93 177.44 1wke s MET 134 N -4.48 2.76 -0.18 5.12 1.75 -1.26 -0.79 119.30 122.22 1wke s MET 134 Ca -0.13 -0.75 -0.05 0.00 -1.25 0.00 0.00 55.69 53.52 1wke s MET 134 Cb 0.09 -2.39 0.07 0.00 2.84 0.00 0.00 34.83 35.44 1wke s MET 134 CO 0.82 0.45 0.14 -1.17 -0.65 0.00 0.00 175.02 174.61 1wke s LEU 135 N -0.29 0.17 0.47 4.11 2.96 -0.07 -4.97 118.68 121.06 1wke s LEU 135 Ca 0.01 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.49 1wke s LEU 135 Cb -0.13 -0.00 -0.04 0.00 0.50 0.00 0.00 46.19 46.53 1wke s LEU 135 CO 0.03 -0.34 0.05 -0.94 -1.32 0.00 0.00 176.35 173.82 1wke s SER 136 N 2.21 4.11 0.19 3.68 1.04 -1.26 -1.22 113.70 122.44 1wke s SER 136 Ca 0.04 -1.48 -0.12 0.00 0.48 0.00 0.00 55.95 54.87 1wke s SER 136 Cb -0.16 0.12 0.16 0.00 0.10 0.00 0.00 66.02 66.24 1wke s SER 136 CO -0.11 -0.71 1.82 -0.65 0.98 0.00 0.00 173.24 174.57 1wke h PRO 137 N 1.46 0.65 -0.09 4.02 0.11 -1.91 -0.62 132.00 135.62 1wke h PRO 137 Ca -0.43 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 1wke h PRO 137 Cb 1.28 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1wke h PRO 137 CO 0.75 0.43 -0.57 1.05 -0.21 0.00 0.00 178.00 179.45 1wke h GLU 138 N 0.67 0.26 -0.31 1.05 9.09 -1.93 -1.55 114.58 121.87 1wke h GLU 138 Ca 0.25 -0.17 -0.18 0.00 0.05 0.00 0.00 59.36 59.31 1wke h GLU 138 Cb 0.08 0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1wke h GLU 138 CO -0.13 0.76 -0.51 -0.09 0.05 0.00 0.00 179.01 179.09 1wke h ARG 139 N 0.20 0.87 -0.16 1.06 9.65 -1.92 -1.10 114.38 122.99 1wke h ARG 139 Ca -0.00 -0.53 -0.00 0.00 -1.10 0.00 0.00 59.98 58.35 1wke h ARG 139 Cb 1.05 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.68 1wke h ARG 139 CO 0.09 1.17 0.08 1.03 2.80 0.00 0.00 179.97 185.14 1wke h SER 140 N 0.68 0.20 -0.69 -3.80 0.87 -0.94 0.05 113.55 109.92 1wke h SER 140 Ca 0.03 -0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.47 1wke h SER 140 Cb 1.11 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.98 1wke h SER 140 CO 0.11 0.24 0.37 0.40 -0.53 0.00 0.00 176.83 177.43 1wke h ILE 141 N 0.14 1.22 -0.32 2.23 1.08 -1.26 -1.51 117.51 119.09 1wke h ILE 141 Ca 0.05 -0.56 -0.01 0.00 -0.39 0.00 0.00 64.86 63.95 1wke h ILE 141 Cb 0.09 0.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.10 1wke h ILE 141 CO -0.01 0.25 0.15 -0.08 -0.69 0.00 0.00 178.15 177.77 1wke h GLU 142 N 0.99 0.46 -0.46 2.37 4.81 -0.45 -0.31 114.58 122.00 1wke h GLU 142 Ca 0.25 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1wke h GLU 142 Cb 0.05 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1wke h GLU 142 CO -0.04 0.44 0.23 0.82 -0.73 0.00 0.00 179.01 179.72 1wke h ILE 143 N 0.38 1.18 -0.23 2.32 2.04 -0.81 0.49 117.51 122.88 1wke h ILE 143 Ca 0.11 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 1wke h ILE 143 Cb 0.13 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1wke h ILE 143 CO -0.01 0.20 0.05 1.56 0.00 0.00 0.00 178.15 179.95 1wke h GLN 144 N 0.60 0.33 -0.08 2.37 4.20 -1.01 0.28 115.11 121.80 1wke h GLN 144 Ca 0.16 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 1wke h GLN 144 Cb 0.11 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1wke h GLN 144 CO -0.02 0.31 -0.08 1.25 -0.67 0.00 0.00 178.83 179.62 1wke h HIS 145 N 0.33 0.24 -0.88 2.96 2.76 -0.41 -2.25 115.15 117.90 1wke h HIS 145 Ca 0.08 -0.07 0.10 0.00 -2.20 0.00 0.00 60.37 58.27 1wke h HIS 145 Cb 0.14 -0.05 -0.07 0.00 1.55 0.00 0.00 27.41 28.97 1wke h HIS 145 CO 0.00 0.64 0.53 -0.07 -1.30 0.00 0.00 177.93 177.73 1wke h LEU 146 N -0.23 0.77 -1.51 0.26 3.38 0.00 0.18 115.31 118.17 1wke h LEU 146 Ca 0.01 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1wke h LEU 146 Cb 0.60 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1wke h LEU 146 CO 0.02 0.44 -0.23 -0.07 0.09 0.00 0.00 178.44 178.69 1wke h LEU 147 N 0.88 0.00 -0.35 1.67 3.38 -0.92 -3.34 115.31 116.63 1wke h LEU 147 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1wke h LEU 147 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1wke h LEU 147 CO -0.24 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1wke n GLY 148 N -0.44 0.78 3.80 0.83 0.00 0.63 -0.85 105.19 109.93 1wke n GLY 148 Ca -0.01 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 1wke n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wke s SER 149 N -2.83 5.61 -0.08 1.61 1.04 -0.99 -4.86 113.70 113.21 1wke s SER 149 Ca 0.00 1.85 -0.06 0.00 0.48 0.00 0.00 55.95 58.22 1wke s SER 149 Cb 0.00 -2.54 -0.27 0.00 0.10 0.00 0.00 66.02 63.31 1wke s SER 149 CO 0.00 -1.28 0.55 0.44 0.98 0.00 0.00 173.24 173.93 1wke h ASP 150 N 0.29 0.43 -3.74 7.02 3.32 -1.51 -3.44 116.42 118.79 1wke h ASP 150 Ca -0.47 -0.80 -0.67 0.00 0.02 0.00 0.00 57.03 55.11 1wke h ASP 150 Cb 1.23 -0.14 -0.35 0.00 0.22 0.00 0.00 39.33 40.29 1wke h ASP 150 CO 0.57 1.70 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.39 1wke s ILE 151 N -2.58 2.53 -0.08 0.35 1.01 -1.01 -0.39 121.20 121.03 1wke s ILE 151 Ca -0.17 -1.43 -0.14 0.00 0.00 0.00 0.00 60.65 58.90 1wke s ILE 151 Cb 0.06 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 1wke s ILE 151 CO 0.81 0.01 0.36 -0.69 0.00 0.00 0.00 174.94 175.43 1wke s VAL 152 N 1.19 5.19 -0.12 2.92 1.01 0.57 -1.90 120.40 129.26 1wke s VAL 152 Ca -0.06 0.72 -0.07 0.00 0.00 0.00 0.00 61.98 62.57 1wke s VAL 152 Cb -0.19 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1wke s VAL 152 CO -0.04 0.47 0.14 -0.04 0.00 0.00 0.00 175.10 175.63 1wke s MET 153 N -0.24 3.45 0.42 2.72 -1.94 -1.20 -1.18 119.30 121.33 1wke s MET 153 Ca 0.21 -0.13 -0.24 0.00 -1.71 0.00 0.00 55.69 53.83 1wke s MET 153 Cb -0.15 -3.19 -0.08 0.00 2.01 0.00 0.00 34.83 33.42 1wke s MET 153 CO 0.09 0.78 1.12 0.00 -0.01 0.00 0.00 175.02 176.99 1wke s ALA 154 N -1.04 3.06 0.15 3.03 0.00 -0.72 -4.50 121.76 121.75 1wke s ALA 154 Ca 0.15 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 1wke s ALA 154 Cb -0.12 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1wke s ALA 154 CO 0.04 -0.44 1.05 0.12 0.00 0.00 0.00 175.76 176.53 1wke s PHE 155 N -1.57 3.69 0.15 0.00 5.36 -1.26 -4.73 117.98 119.62 1wke s PHE 155 Ca 0.60 1.68 0.03 0.00 -0.96 0.00 0.00 56.93 58.28 1wke s PHE 155 Cb -0.26 -3.19 -0.01 0.00 -0.34 0.00 0.00 43.02 39.22 1wke s PHE 155 CO 0.32 -0.28 0.11 0.00 -1.46 0.00 0.00 175.22 173.91 1wke n ALA 156 N 2.51 0.29 -3.91 11.12 0.00 -1.26 -4.34 120.51 124.92 1wke n ALA 156 Ca 0.02 -0.83 -0.30 0.00 0.00 0.00 0.00 53.44 52.33 1wke n ALA 156 Cb 0.47 0.65 -0.15 0.00 0.00 0.00 0.00 19.45 20.42 1wke n ALA 156 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1wke s GLU 157 N -2.59 1.35 0.27 0.00 2.12 -1.26 -4.80 118.70 113.79 1wke s GLU 157 Ca 0.15 -1.23 -0.29 0.00 0.36 0.00 0.00 54.97 53.96 1wke s GLU 157 Cb 0.01 -2.59 -0.09 0.00 0.26 0.00 0.00 34.13 31.71 1wke s GLU 157 CO 0.11 -0.78 1.06 0.00 -0.54 0.00 0.00 175.26 175.10 1wke s THR 159 N -1.18 5.36 0.73 0.00 2.01 -1.26 -5.07 115.64 116.24 1wke s THR 159 Ca 0.44 0.30 -0.13 0.00 0.31 0.00 0.00 61.69 62.61 1wke s THR 159 Cb -0.30 -3.53 0.04 0.00 0.01 0.00 0.00 72.50 68.72 1wke s THR 159 CO 0.38 0.40 1.11 -2.16 -0.69 0.00 0.00 174.62 173.67 1wke s PRO 160 N 0.59 2.37 -0.15 4.92 0.04 -1.26 -4.88 135.00 136.63 1wke s PRO 160 Ca 0.10 1.34 -0.01 0.00 0.04 0.00 0.00 61.00 62.48 1wke s PRO 160 Cb -0.12 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.51 1wke s PRO 160 CO 0.01 -1.57 -0.13 -0.47 0.04 0.00 0.00 177.00 174.88 1wke s TYR 161 N -2.56 2.82 0.89 0.56 5.04 -1.26 -3.26 117.35 119.57 1wke s TYR 161 Ca 0.65 -0.79 -0.12 0.00 -2.44 0.00 0.00 57.07 54.37 1wke s TYR 161 Cb -0.20 -1.89 0.12 0.00 0.35 0.00 0.00 41.96 40.34 1wke s TYR 161 CO 0.49 -0.33 1.13 -2.14 -1.34 0.00 0.00 175.55 173.36 1wke s PRO 162 N 0.62 1.35 -0.05 4.97 0.02 -1.26 -4.93 135.00 135.73 1wke s PRO 162 Ca -0.07 0.39 -0.03 0.00 0.02 0.00 0.00 61.00 61.31 1wke s PRO 162 Cb -0.15 -1.86 0.03 0.00 0.02 0.00 0.00 34.50 32.54 1wke s PRO 162 CO 0.03 -2.07 0.11 0.00 -0.33 0.00 0.00 177.00 174.74 1wke s ALA 163 N -3.24 -0.22 0.61 -1.55 0.00 -1.20 -5.10 121.76 111.06 1wke s ALA 163 Ca 0.63 0.48 -0.13 0.00 0.00 0.00 0.00 51.96 52.94 1wke s ALA 163 Cb -0.15 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 1wke s ALA 163 CO 0.54 -0.11 1.03 0.95 0.00 0.00 0.00 175.76 178.17 1wke s THR 164 N 0.71 4.33 0.22 0.00 -4.23 -1.26 -4.78 115.64 110.63 1wke s THR 164 Ca -0.05 0.89 -0.09 0.00 -1.18 0.00 0.00 61.69 61.26 1wke s THR 164 Cb -0.07 -3.63 0.17 0.00 1.34 0.00 0.00 72.50 70.32 1wke s THR 164 CO -0.03 -0.86 1.71 -0.65 -0.54 0.00 0.00 174.62 174.25 1wke h PRO 165 N -0.02 0.27 -0.64 3.99 0.11 -2.00 0.14 132.00 133.84 1wke h PRO 165 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 1wke h PRO 165 Cb 1.20 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1wke h PRO 165 CO 0.60 0.18 0.13 0.66 -0.21 0.00 0.00 178.00 179.36 1wke h SER 166 N 0.28 1.00 -0.24 -2.05 4.64 -1.99 0.26 113.55 115.45 1wke h SER 166 Ca 0.33 -0.25 -0.03 0.00 -0.47 0.00 0.00 61.79 61.38 1wke h SER 166 Cb 0.50 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1wke h SER 166 CO -0.41 0.99 0.05 -0.09 -0.87 0.00 0.00 176.83 176.50 1wke h ARG 167 N 0.97 0.39 -0.19 4.77 2.43 -1.77 -0.98 114.38 120.01 1wke h ARG 167 Ca 0.20 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 1wke h ARG 167 Cb 0.40 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1wke h ARG 167 CO 0.01 0.50 -0.22 0.00 -1.51 0.00 0.00 179.97 178.75 1wke h ALA 168 N 0.87 1.29 0.19 2.80 0.00 -0.63 -2.19 119.26 121.58 1wke h ALA 168 Ca 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1wke h ALA 168 Cb 0.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1wke h ALA 168 CO 0.00 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.64 1wke h ALA 169 N 1.48 -0.25 -0.55 0.00 0.00 -0.69 -1.76 119.26 117.49 1wke h ALA 169 Ca 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1wke h ALA 169 Cb 0.56 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1wke h ALA 169 CO 0.04 -0.46 0.24 0.77 0.00 0.00 0.00 179.25 179.84 1wke h SER 170 N -0.61 0.71 -0.25 0.00 0.02 -1.12 0.18 113.55 112.48 1wke h SER 170 Ca -0.03 -0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 60.75 1wke h SER 170 Cb 0.45 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 1wke h SER 170 CO 0.04 0.63 -0.23 -1.28 -1.14 0.00 0.00 176.83 174.84 1wke h SER 171 N 0.78 0.64 -0.40 3.07 0.87 -1.42 -1.84 113.55 115.24 1wke h SER 171 Ca 0.19 -0.47 -0.02 0.00 -1.23 0.00 0.00 61.79 60.27 1wke h SER 171 Cb 0.12 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1wke h SER 171 CO -0.02 0.97 0.19 -0.03 -0.53 0.00 0.00 176.83 177.41 1wke h MET 172 N 0.31 0.58 -0.80 2.24 -1.53 -0.92 -0.87 114.93 113.94 1wke h MET 172 Ca 0.04 -0.09 0.01 0.00 -3.44 0.00 0.00 59.70 56.22 1wke h MET 172 Cb 0.79 -0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 31.70 1wke h MET 172 CO 0.06 0.52 0.53 0.93 0.14 0.00 0.00 176.91 179.09 1wke h GLU 173 N 0.51 1.03 -0.20 0.39 5.08 -0.60 0.16 114.58 120.95 1wke h GLU 173 Ca 0.14 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1wke h GLU 173 Cb 0.14 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1wke h GLU 173 CO -0.02 0.68 0.03 -0.09 -1.00 0.00 0.00 179.01 178.61 1wke h ARG 174 N 1.06 0.34 -0.55 2.33 9.65 -1.15 -2.50 114.38 123.56 1wke h ARG 174 Ca 0.30 -0.10 0.02 0.00 -1.10 0.00 0.00 59.98 59.11 1wke h ARG 174 Cb -0.09 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.42 1wke h ARG 174 CO -0.08 0.51 0.37 0.77 2.80 0.00 0.00 179.97 184.34 1wke h SER 175 N 0.13 0.58 0.47 -3.80 0.02 -0.68 0.26 113.55 110.53 1wke h SER 175 Ca 0.06 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.88 1wke h SER 175 Cb 0.33 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1wke h SER 175 CO 0.01 0.41 -0.56 0.24 -1.14 0.00 0.00 176.83 175.78 1wke h MET 176 N 0.68 0.10 -0.30 3.45 2.86 -0.80 0.16 114.93 121.08 1wke h MET 176 Ca 0.21 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 57.63 1wke h MET 176 Cb 0.03 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1wke h MET 176 CO -0.05 0.63 -0.46 0.00 1.06 0.00 0.00 176.91 178.09 1wke h ARG 177 N 0.08 0.84 0.00 1.72 3.08 -0.57 -2.75 114.38 116.77 1wke h ARG 177 Ca -0.00 -0.51 -0.07 0.00 0.07 0.00 0.00 59.98 59.47 1wke h ARG 177 Cb 1.01 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 1wke h ARG 177 CO 0.08 1.14 -0.33 -1.49 -1.07 0.00 0.00 179.97 178.30 1wke h TRP 178 N 0.62 0.00 -0.44 3.04 4.06 -0.30 -2.30 115.95 120.63 1wke h TRP 178 Ca 0.03 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.86 1wke h TRP 178 Cb 1.07 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.21 1wke h TRP 178 CO 0.07 0.33 -0.21 0.00 -3.56 0.00 0.00 178.44 175.08 1wke h ALA 179 N 1.67 0.81 -0.21 1.49 0.00 -0.48 0.12 119.26 122.66 1wke h ALA 179 Ca -0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1wke h ALA 179 Cb 0.73 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1wke h ALA 179 CO 0.04 0.65 -0.01 -0.22 0.00 0.00 0.00 179.25 179.72 1wke h LYS 180 N 0.76 0.38 -0.62 0.00 1.63 -1.19 -0.84 116.57 116.69 1wke h LYS 180 Ca 0.10 -0.13 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 1wke h LYS 180 Cb 0.75 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.31 1wke h LYS 180 CO 0.06 0.58 0.33 0.00 -3.45 0.00 0.00 179.45 176.97 1wke h ARG 181 N 0.14 0.87 -0.66 1.90 3.08 -1.32 -1.01 114.38 117.39 1wke h ARG 181 Ca 0.06 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.02 1wke h ARG 181 Cb 0.41 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1wke h ARG 181 CO 0.01 0.68 0.42 0.77 -1.07 0.00 0.00 179.97 180.78 1wke h SER 182 N 0.84 0.70 -0.38 7.04 0.02 -0.59 0.28 113.55 121.48 1wke h SER 182 Ca 0.22 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1wke h SER 182 Cb 0.07 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1wke h SER 182 CO -0.03 0.50 0.25 -0.09 -1.14 0.00 0.00 176.83 176.31 1wke h ARG 183 N 0.84 0.50 -0.35 3.45 9.65 -0.67 -0.84 114.38 126.96 1wke h ARG 183 Ca 0.26 -0.03 -0.06 0.00 -1.10 0.00 0.00 59.98 59.05 1wke h ARG 183 Cb -0.03 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.43 1wke h ARG 183 CO -0.08 0.34 -0.01 -0.44 2.80 0.00 0.00 179.97 182.57 1wke h ASP 184 N 0.51 0.61 -0.48 -3.80 3.32 -0.87 -0.37 116.42 115.34 1wke h ASP 184 Ca 0.14 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.89 1wke h ASP 184 Cb -0.05 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 1wke h ASP 184 CO -0.03 0.78 0.31 0.00 -1.72 0.00 0.00 179.24 178.57 1wke h ALA 185 N 0.86 0.62 -0.30 3.45 0.00 -0.81 -0.78 119.26 122.28 1wke h ALA 185 Ca 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1wke h ALA 185 Cb 0.47 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wke h ALA 185 CO 0.02 0.03 0.17 0.35 0.00 0.00 0.00 179.25 179.82 1wke h PHE 186 N 0.62 0.41 0.00 0.00 3.04 -0.97 -3.06 116.94 116.98 1wke h PHE 186 Ca 0.18 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 62.07 1wke h PHE 186 Cb -0.04 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.33 1wke h PHE 186 CO -0.05 0.32 -0.27 -0.44 -2.02 0.00 0.00 178.31 175.84 1wke h ASP 187 N 0.38 0.00 0.79 0.41 3.32 -0.70 -2.83 116.42 117.78 1wke h ASP 187 Ca 0.11 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 1wke h ASP 187 Cb 0.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1wke h ASP 187 CO -0.02 0.27 -0.28 0.28 -1.72 0.00 0.00 179.24 177.77 1wke h SER 188 N 0.00 0.00 -2.76 6.45 0.02 -1.05 -3.38 113.55 112.84 1wke h SER 188 Ca -0.00 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.27 1wke h SER 188 Cb 0.56 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.93 1wke h SER 188 CO 0.04 0.28 0.40 -0.60 -1.14 0.00 0.00 176.83 175.81 1wke s ARG 189 N -3.73 3.18 0.18 3.45 3.52 -1.07 -4.93 118.95 119.55 1wke s ARG 189 Ca -0.00 -1.25 -0.12 0.00 -0.13 0.00 0.00 55.73 54.23 1wke s ARG 189 Cb 0.11 -4.36 0.15 0.00 -1.56 0.00 0.00 34.95 29.29 1wke s ARG 189 CO 0.65 -1.68 1.79 1.57 -0.81 0.00 0.00 175.30 176.82 1wke h LYS 190 N 9.23 0.52 -0.95 5.12 2.10 -1.82 0.21 116.57 130.98 1wke h LYS 190 Ca -0.20 -0.03 0.07 0.00 -2.00 0.00 0.00 60.65 58.48 1wke h LYS 190 Cb 1.07 -0.12 -0.06 0.00 -0.90 0.00 0.00 32.23 32.22 1wke h LYS 190 CO 1.12 0.34 0.61 1.49 -2.00 0.00 0.00 179.45 181.02 1wke h GLU 191 N 0.53 1.05 0.01 0.07 4.81 -1.94 0.10 114.58 119.22 1wke h GLU 191 Ca 0.24 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 1wke h GLU 191 Cb 0.14 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.29 1wke h GLU 191 CO -0.16 0.70 -0.48 0.37 -0.73 0.00 0.00 179.01 178.71 1wke h GLN 192 N 1.08 0.31 0.00 1.92 4.15 -1.75 -2.95 115.11 117.87 1wke h GLN 192 Ca 0.41 -0.35 -0.03 0.00 0.77 0.00 0.00 58.65 59.46 1wke h GLN 192 Cb 0.20 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.99 1wke h GLN 192 CO -0.16 1.05 -0.12 0.00 -1.93 0.00 0.00 178.83 177.66 1wke h ALA 193 N 0.28 1.26 0.00 3.38 0.00 -0.22 -0.06 119.26 123.90 1wke h ALA 193 Ca -0.06 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1wke h ALA 193 Cb 1.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1wke h ALA 193 CO 0.09 0.16 -1.11 0.93 0.00 0.00 0.00 179.25 179.32 1wke h GLU 194 N 0.00 0.00 0.00 0.00 5.08 -0.86 -3.40 114.58 115.39 1wke h GLU 194 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wke h GLU 194 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1wke h GLU 194 CO 0.02 0.17 -1.13 0.09 -1.00 0.00 0.00 179.01 177.15 1wke n ASN 195 N -2.83 3.92 -4.88 1.42 4.13 -1.11 -4.76 115.26 111.15 1wke n ASN 195 Ca -0.04 -0.03 -0.22 0.00 1.68 0.00 0.00 54.58 55.97 1wke n ASN 195 Cb 0.69 1.17 -0.03 0.00 -1.54 0.00 0.00 39.78 40.08 1wke n ASN 195 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wke s ALA 196 N -2.23 4.12 0.20 5.41 0.00 -0.05 -4.77 121.76 124.44 1wke s ALA 196 Ca -0.01 -1.81 0.11 0.00 0.00 0.00 0.00 51.96 50.24 1wke s ALA 196 Cb 0.03 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 1wke s ALA 196 CO 0.16 -0.29 -0.19 0.00 0.00 0.00 0.00 175.76 175.44 1wke s ALA 197 N -2.54 2.68 -0.10 0.00 0.00 0.48 -4.77 121.76 117.50 1wke s ALA 197 Ca 0.46 -1.64 0.01 0.00 0.00 0.00 0.00 51.96 50.79 1wke s ALA 197 Cb -0.02 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.69 1wke s ALA 197 CO 0.27 0.41 -0.12 -1.17 0.00 0.00 0.00 175.76 175.15 1wke s LEU 198 N -2.85 1.54 -0.05 0.00 2.96 -1.26 -0.32 118.68 118.70 1wke s LEU 198 Ca 0.23 -0.36 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 1wke s LEU 198 Cb -0.08 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.63 1wke s LEU 198 CO 0.12 -0.02 0.06 -0.36 -1.32 0.00 0.00 176.35 174.83 1wke s PHE 199 N 1.13 3.30 0.17 5.38 0.40 -0.33 -0.95 117.98 127.09 1wke s PHE 199 Ca -0.05 0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.58 1wke s PHE 199 Cb -0.14 -1.79 -0.04 0.00 0.51 0.00 0.00 43.02 41.56 1wke s PHE 199 CO -0.03 0.56 0.25 0.20 0.70 0.00 0.00 175.22 176.90 1wke s GLY 200 N -1.31 1.61 -0.21 4.36 0.00 -0.50 -1.75 107.32 109.52 1wke s GLY 200 Ca 0.18 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.78 1wke s GLY 200 CO 0.08 -1.14 -0.16 -0.42 0.00 0.00 0.00 173.10 171.46 1wke s ILE 201 N -1.81 2.06 0.34 0.90 1.01 -1.26 -0.65 121.20 121.79 1wke s ILE 201 Ca 0.33 -1.19 -0.28 0.00 0.00 0.00 0.00 60.65 59.52 1wke s ILE 201 Cb -0.10 -1.99 -0.09 0.00 0.01 0.00 0.00 42.46 40.28 1wke s ILE 201 CO 0.27 0.30 1.18 -1.58 0.00 0.00 0.00 174.94 175.11 1wke s GLN 202 N 1.23 4.33 0.00 2.79 0.74 0.24 -4.82 119.66 124.18 1wke s GLN 202 Ca -0.01 1.93 0.00 0.00 0.05 0.00 0.00 55.36 57.33 1wke s GLN 202 Cb -0.16 -2.95 0.00 0.00 1.10 0.00 0.00 33.01 31.00 1wke s GLN 202 CO -0.10 -0.10 0.00 1.04 -0.55 0.00 0.00 175.29 175.58 1wke n GLN 203 N 0.64 2.08 0.00 1.67 1.13 -1.26 -1.20 117.38 120.43 1wke n GLN 203 Ca 0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1wke n GLN 203 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.80 1wke n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1wke n GLY 204 N 3.27 1.32 7.00 1.08 0.00 -1.26 -4.07 105.19 112.54 1wke n GLY 204 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wke n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wke n SER 205 N 0.00 0.00 -1.16 1.61 2.88 -1.26 -2.15 113.62 113.53 1wke n SER 205 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1wke n SER 205 Cb 0.00 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 63.74 1wke n SER 205 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1wke n VAL 206 N 0.00 1.66 -3.47 2.46 0.24 -1.26 -4.94 118.33 113.02 1wke n VAL 206 Ca 0.00 -1.28 -0.39 0.00 -2.04 0.00 0.00 64.34 60.63 1wke n VAL 206 Cb 0.00 0.17 -0.10 0.00 -1.47 0.00 0.00 33.84 32.44 1wke n VAL 206 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1wke s PHE 207 N -1.78 3.23 0.23 6.34 0.08 -0.91 -4.97 117.98 120.20 1wke s PHE 207 Ca 0.41 0.25 0.19 0.00 0.12 0.00 0.00 56.93 57.91 1wke s PHE 207 Cb 0.27 -2.50 0.80 0.00 -0.57 0.00 0.00 43.02 41.02 1wke s PHE 207 CO 0.19 -0.22 1.80 1.05 -0.10 0.00 0.00 175.22 177.94 1wke h GLU 208 N 8.28 0.00 -0.53 0.44 4.11 -1.92 -1.07 114.58 123.88 1wke h GLU 208 Ca -0.33 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.01 1wke h GLU 208 Cb 1.17 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1wke h GLU 208 CO 0.61 0.34 -0.01 -2.95 0.07 0.00 0.00 179.01 177.06 1wke h ASN 209 N 0.00 0.93 -0.38 3.06 -1.07 -1.94 0.28 115.58 116.46 1wke h ASN 209 Ca -0.00 -0.31 -0.10 0.00 0.07 0.00 0.00 56.30 55.96 1wke h ASN 209 Cb 0.78 -0.25 -0.01 0.00 -2.07 0.00 0.00 38.32 36.77 1wke h ASN 209 CO 0.04 1.02 -0.13 -0.07 0.07 0.00 0.00 177.43 178.36 1wke h LEU 210 N 0.82 0.78 -0.82 6.14 4.07 -1.77 -0.72 115.31 123.82 1wke h LEU 210 Ca 0.15 -0.38 -0.03 0.00 0.08 0.00 0.00 57.88 57.70 1wke h LEU 210 Cb 0.55 -0.21 -0.04 0.00 1.08 0.00 0.00 40.66 42.04 1wke h LEU 210 CO 0.03 0.99 0.40 0.03 -1.08 0.00 0.00 178.44 178.81 1wke h ARG 211 N 0.57 1.17 -0.50 1.13 2.47 -1.02 0.96 114.38 119.16 1wke h ARG 211 Ca 0.09 -0.16 -0.06 0.00 -1.26 0.00 0.00 59.98 58.59 1wke h ARG 211 Cb 0.67 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.75 1wke h ARG 211 CO 0.05 0.89 0.08 0.37 0.56 0.00 0.00 179.97 181.91 1wke h GLN 212 N 1.15 0.83 -0.41 0.04 5.75 -0.12 0.11 115.11 122.46 1wke h GLN 212 Ca 0.28 -0.23 -0.03 0.00 -0.15 0.00 0.00 58.65 58.53 1wke h GLN 212 Cb 0.10 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1wke h GLN 212 CO -0.04 0.83 0.16 1.96 -2.65 0.00 0.00 178.83 179.09 1wke h GLN 213 N 0.71 0.62 -0.67 1.69 4.20 -0.64 -1.56 115.11 119.45 1wke h GLN 213 Ca 0.15 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1wke h GLN 213 Cb 0.41 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 1wke h GLN 213 CO 0.01 0.59 0.30 1.03 -0.67 0.00 0.00 178.83 180.08 1wke h SER 214 N 0.52 0.89 -0.69 1.46 0.87 -0.61 -1.49 113.55 114.51 1wke h SER 214 Ca 0.14 -0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.50 1wke h SER 214 Cb 0.20 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 1wke h SER 214 CO -0.01 0.80 0.26 0.00 -0.53 0.00 0.00 176.83 177.35 1wke h ALA 215 N 1.13 0.90 -0.35 6.23 0.00 -0.51 -1.55 119.26 125.11 1wke h ALA 215 Ca 0.23 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1wke h ALA 215 Cb 0.16 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1wke h ALA 215 CO -0.02 0.53 0.02 -0.44 0.00 0.00 0.00 179.25 179.34 1wke h ASP 216 N 0.99 0.59 -0.22 0.00 3.32 -1.06 -0.09 116.42 119.94 1wke h ASP 216 Ca 0.23 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1wke h ASP 216 Cb 0.23 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1wke h ASP 216 CO -0.02 0.73 0.14 0.00 -1.72 0.00 0.00 179.24 178.38 1wke h ALA 217 N 0.87 0.28 -0.57 3.45 0.00 -1.16 0.27 119.26 122.40 1wke h ALA 217 Ca 0.10 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1wke h ALA 217 Cb 0.42 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1wke h ALA 217 CO 0.01 -0.25 0.32 -0.07 0.00 0.00 0.00 179.25 179.26 1wke h LEU 218 N 0.29 0.49 -0.80 0.00 4.07 -1.14 -0.54 115.31 117.69 1wke h LEU 218 Ca 0.08 0.02 -0.10 0.00 0.08 0.00 0.00 57.88 57.97 1wke h LEU 218 Cb -0.03 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.61 1wke h LEU 218 CO -0.02 0.34 -0.12 0.00 -1.08 0.00 0.00 178.44 177.55 1wke h ALA 219 N 1.28 0.98 -0.45 1.53 0.00 -0.76 0.89 119.26 122.73 1wke h ALA 219 Ca 0.24 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1wke h ALA 219 Cb 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1wke h ALA 219 CO -0.14 0.60 0.17 1.49 0.00 0.00 0.00 179.25 181.38 1wke h GLU 220 N 0.70 0.68 0.11 0.00 4.81 0.09 -2.97 114.58 118.00 1wke h GLU 220 Ca 0.12 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1wke h GLU 220 Cb 0.61 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1wke h GLU 220 CO 0.04 0.63 -0.05 0.82 -0.73 0.00 0.00 179.01 179.71 1wke h ILE 221 N 0.59 1.08 -0.15 2.32 2.04 -0.97 -3.50 117.51 118.91 1wke h ILE 221 Ca 0.15 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1wke h ILE 221 Cb 0.21 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1wke h ILE 221 CO -0.01 0.19 0.00 0.61 0.00 0.00 0.00 178.15 178.94 1wke n GLY 222 N -0.12 0.48 3.22 5.37 0.00 0.29 -5.11 105.19 109.32 1wke n GLY 222 Ca -0.09 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1wke n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wke s PHE 223 N -0.04 1.14 -0.08 1.61 0.40 -1.26 -5.02 117.98 114.73 1wke s PHE 223 Ca 0.00 -1.15 0.16 0.00 -0.60 0.00 0.00 56.93 55.34 1wke s PHE 223 Cb 0.00 -0.64 0.20 0.00 0.51 0.00 0.00 43.02 43.09 1wke s PHE 223 CO 0.00 -0.37 1.51 -0.44 0.70 0.00 0.00 175.22 176.61 1wke h ASP 224 N 2.70 0.00 -5.01 1.36 3.32 -1.43 -3.47 116.42 113.89 1wke h ASP 224 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1wke h ASP 224 Cb 1.21 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.66 1wke h ASP 224 CO 0.60 0.49 0.18 -0.83 -1.72 0.00 0.00 179.24 177.96 1wke s GLY 225 N -4.44 -0.41 -0.07 2.75 0.00 -1.24 -4.27 107.32 99.63 1wke s GLY 225 Ca 0.03 0.19 0.02 0.00 0.00 0.00 0.00 44.72 44.96 1wke s GLY 225 CO 0.73 0.03 -0.13 -0.19 0.00 0.00 0.00 173.10 173.54 1wke s TYR 226 N -3.81 1.56 0.06 1.90 1.51 -0.19 -1.41 117.35 116.98 1wke s TYR 226 Ca 0.05 -0.60 0.01 0.00 -1.01 0.00 0.00 57.07 55.51 1wke s TYR 226 Cb -0.02 -1.14 -0.04 0.00 -0.11 0.00 0.00 41.96 40.65 1wke s TYR 226 CO -0.07 -0.31 0.18 0.00 -1.11 0.00 0.00 175.55 174.24 1wke s ALA 227 N 0.72 3.92 -0.41 3.71 0.00 0.18 -0.78 121.76 129.09 1wke s ALA 227 Ca -0.13 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 50.83 1wke s ALA 227 Cb -0.16 -1.75 0.05 0.00 0.00 0.00 0.00 23.12 21.26 1wke s ALA 227 CO 0.03 0.81 0.28 0.08 0.00 0.00 0.00 175.76 176.96 1wke s VAL 228 N -1.48 4.76 0.56 0.00 1.01 0.11 -0.59 120.40 124.76 1wke s VAL 228 Ca 0.34 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.39 1wke s VAL 228 Cb -0.13 -3.75 0.07 0.00 0.00 0.00 0.00 36.38 32.57 1wke s VAL 228 CO 0.27 -0.38 0.77 -0.83 0.00 0.00 0.00 175.10 174.92 1wke s GLY 229 N 1.92 1.80 0.00 4.51 0.00 -0.34 -3.67 107.32 111.54 1wke s GLY 229 Ca 0.03 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1wke s GLY 229 CO 0.06 -1.47 0.00 0.61 0.00 0.00 0.00 173.10 172.30 1wke n GLY 230 N -2.26 0.72 3.98 0.20 0.00 -1.26 -4.69 105.19 101.88 1wke n GLY 230 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 1wke n GLY 230 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wke s LEU 231 N 0.00 3.47 -1.36 0.99 1.43 -1.26 -4.48 118.68 117.48 1wke s LEU 231 Ca 0.00 -0.60 -0.06 0.00 -1.03 0.00 0.00 54.13 52.44 1wke s LEU 231 Cb 0.00 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 43.93 1wke s LEU 231 CO 0.00 -0.83 0.79 0.00 0.23 0.00 0.00 176.35 176.54 1wke n ALA 232 N -1.83 -1.02 -1.26 4.21 0.00 -1.26 -4.90 120.51 114.45 1wke n ALA 232 Ca 0.08 0.31 0.09 0.00 0.00 0.00 0.00 53.44 53.92 1wke n ALA 232 Cb 0.60 -4.28 0.16 0.00 0.00 0.00 0.00 19.45 15.94 1wke n ALA 232 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1wke n VAL 233 N -4.59 1.94 0.00 0.00 3.14 -1.26 -4.95 118.33 112.61 1wke n VAL 233 Ca -0.06 -2.52 0.00 0.00 -2.96 0.00 0.00 64.34 58.80 1wke n VAL 233 Cb 0.59 -0.22 0.00 0.00 -1.06 0.00 0.00 33.84 33.15 1wke n VAL 233 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wke n GLY 234 N -1.30 0.87 0.06 7.55 0.00 -1.26 -4.38 105.19 106.73 1wke n GLY 234 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1wke n GLY 234 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1wke n GLU 235 N -0.68 0.13 0.00 1.61 0.00 -1.26 -5.03 120.64 115.41 1wke n GLU 235 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 57.16 57.36 1wke n GLU 235 Cb 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 31.44 29.76 1wke n GLU 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1wke n GLY 236 N 0.88 -2.32 0.36 -1.84 0.00 -1.26 -4.08 105.19 96.94 1wke n GLY 236 Ca 0.05 -1.37 0.08 0.00 0.00 0.00 0.00 46.02 44.78 1wke n GLY 236 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1wke h GLN 237 N 0.00 0.89 -0.04 1.61 4.15 -1.98 -0.44 115.11 119.30 1wke h GLN 237 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1wke h GLN 237 Cb 0.00 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.49 1wke h GLN 237 CO 0.00 0.59 0.03 -0.44 -1.93 0.00 0.00 178.83 177.08 1wke h ASP 238 N 0.92 0.04 -0.34 -0.69 5.19 -1.99 0.86 116.42 120.41 1wke h ASP 238 Ca 0.49 -0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.85 1wke h ASP 238 Cb 0.56 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 1wke h ASP 238 CO -0.26 0.03 0.02 -0.33 -3.12 0.00 0.00 179.24 175.58 1wke h GLU 239 N 0.05 0.60 -0.10 3.56 4.39 -1.59 -1.03 114.58 120.46 1wke h GLU 239 Ca 0.01 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.58 1wke h GLU 239 Cb -0.01 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.53 1wke h GLU 239 CO -0.00 0.70 -0.26 1.98 -1.16 0.00 0.00 179.01 180.27 1wke h MET 240 N 0.41 -0.33 -0.94 2.33 4.05 -0.92 0.26 114.93 119.79 1wke h MET 240 Ca 0.10 0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.54 1wke h MET 240 Cb 0.42 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.25 1wke h MET 240 CO 0.01 -0.22 0.57 0.74 0.23 0.00 0.00 176.91 178.25 1wke h PHE 241 N -0.34 1.24 -0.76 1.39 0.04 -0.75 0.81 116.94 118.58 1wke h PHE 241 Ca 0.09 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.81 1wke h PHE 241 Cb 0.48 -0.41 -0.03 0.00 2.20 0.00 0.00 35.95 38.19 1wke h PHE 241 CO -0.34 0.82 0.27 -0.09 -0.60 0.00 0.00 178.31 178.36 1wke h ARG 242 N 1.30 1.15 -0.30 1.51 2.43 -0.25 -0.59 114.38 119.64 1wke h ARG 242 Ca 0.34 -0.23 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 1wke h ARG 242 Cb -0.06 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.31 1wke h ARG 242 CO -0.06 0.96 -0.38 0.28 -1.51 0.00 0.00 179.97 179.26 1wke h VAL 243 N 1.11 1.29 -0.81 0.20 2.07 -0.03 -3.02 116.25 117.06 1wke h VAL 243 Ca 0.25 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1wke h VAL 243 Cb 0.27 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1wke h VAL 243 CO -0.01 0.51 0.51 -0.07 0.02 0.00 0.00 177.57 178.52 1wke h LEU 244 N 0.56 0.95 -0.70 2.57 3.38 -0.56 -0.45 115.31 121.07 1wke h LEU 244 Ca 0.04 -0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.11 1wke h LEU 244 Cb 0.97 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.37 1wke h LEU 244 CO 0.09 0.72 0.08 0.44 0.09 0.00 0.00 178.44 179.86 1wke h ASP 245 N 1.10 -0.16 0.33 -0.43 3.32 -0.98 -1.79 116.42 117.82 1wke h ASP 245 Ca 0.29 0.16 -0.25 0.00 0.02 0.00 0.00 57.03 57.25 1wke h ASP 245 Cb -0.08 0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 1wke h ASP 245 CO -0.06 -0.10 -1.89 2.22 -1.72 0.00 0.00 179.24 177.69 1wke n PHE 246 N -5.24 0.55 -0.04 4.55 1.16 -1.17 -4.52 117.46 112.75 1wke n PHE 246 Ca 0.12 0.19 -0.13 0.00 -1.87 0.00 0.00 57.45 55.76 1wke n PHE 246 Cb 0.43 -1.02 -0.08 0.00 -1.61 0.00 0.00 39.48 37.19 1wke n PHE 246 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1wke h SER 247 N 0.00 0.24 -0.85 5.98 0.02 -0.81 -3.33 113.55 114.80 1wke h SER 247 Ca -0.32 -0.51 0.03 0.00 -0.84 0.00 0.00 61.79 60.16 1wke h SER 247 Cb 1.87 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 64.29 1wke h SER 247 CO 0.04 0.70 0.55 0.58 -1.14 0.00 0.00 176.83 177.56 1wke h VAL 248 N -0.21 1.14 0.00 2.27 2.07 -1.55 -1.25 116.25 118.73 1wke h VAL 248 Ca 0.01 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1wke h VAL 248 Cb 0.64 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1wke h VAL 248 CO 0.03 0.20 0.00 -2.65 0.02 0.00 0.00 177.57 175.16 1wke n PRO 249 N -4.55 0.13 0.17 1.57 -0.02 -1.25 -1.65 135.00 129.41 1wke n PRO 249 Ca 0.10 0.53 0.06 0.00 -2.02 0.00 0.00 63.50 62.17 1wke n PRO 249 Cb 0.08 -1.85 0.14 0.00 -0.02 0.00 0.00 33.50 31.85 1wke n PRO 249 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1wke h MET 250 N 0.00 0.00 -6.90 -0.52 2.86 -1.33 -3.46 114.93 105.58 1wke h MET 250 Ca 0.00 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.15 1wke h MET 250 Cb 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1wke h MET 250 CO 0.00 0.35 0.18 -0.51 1.06 0.00 0.00 176.91 177.99 1wke s LEU 251 N -6.48 3.84 0.12 1.22 1.43 -0.66 -4.80 118.68 113.36 1wke s LEU 251 Ca 0.04 1.28 -0.33 0.00 -1.03 0.00 0.00 54.13 54.08 1wke s LEU 251 Cb 0.08 -4.15 -0.13 0.00 0.03 0.00 0.00 46.19 42.01 1wke s LEU 251 CO 0.71 -0.40 1.68 -2.65 0.23 0.00 0.00 176.35 175.92 1wke n PRO 252 N -1.13 2.32 -0.11 1.29 -0.02 -1.26 -4.88 135.00 131.21 1wke n PRO 252 Ca 0.04 0.84 -0.01 0.00 -2.02 0.00 0.00 63.50 62.35 1wke n PRO 252 Cb 0.54 -2.65 0.24 0.00 -0.02 0.00 0.00 33.50 31.62 1wke n PRO 252 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1wke h ASP 253 N 6.90 0.70 -0.09 2.55 3.58 -1.91 -3.00 116.42 125.15 1wke h ASP 253 Ca -0.45 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 56.90 1wke h ASP 253 Cb 1.25 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.11 1wke h ASP 253 CO 0.91 0.66 0.00 -0.90 -2.88 0.00 0.00 179.24 177.03 1wke n ASP 254 N -4.32 0.85 -4.22 2.28 5.75 -1.26 -4.82 116.55 110.80 1wke n ASP 254 Ca 0.04 -2.04 -0.21 0.00 -0.01 0.00 0.00 54.79 52.57 1wke n ASP 254 Cb 0.18 -0.21 -0.12 0.00 -1.03 0.00 0.00 41.12 39.93 1wke n ASP 254 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1wke s LYS 255 N -1.66 0.97 0.58 0.11 -0.14 -1.13 -4.88 119.74 113.59 1wke s LYS 255 Ca 0.06 -1.04 -0.20 0.00 -1.36 0.00 0.00 55.97 53.43 1wke s LYS 255 Cb 0.04 -1.10 -0.04 0.00 -1.68 0.00 0.00 37.83 35.05 1wke s LYS 255 CO 0.03 0.25 1.28 -1.25 -0.76 0.00 0.00 175.35 174.91 1wke s PRO 256 N -1.78 2.99 -0.22 -1.68 0.04 -1.26 -4.81 135.00 128.28 1wke s PRO 256 Ca 0.02 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.07 1wke s PRO 256 Cb -0.10 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.39 1wke s PRO 256 CO 0.03 -1.24 -0.09 -1.01 0.04 0.00 0.00 177.00 174.73 1wke s HIS 257 N -1.43 2.95 -0.24 0.56 3.76 -1.25 -1.02 115.29 118.62 1wke s HIS 257 Ca 0.75 -1.36 -0.04 0.00 -0.15 0.00 0.00 55.06 54.26 1wke s HIS 257 Cb -0.36 -2.04 0.00 0.00 1.11 0.00 0.00 32.58 31.30 1wke s HIS 257 CO 0.40 -0.69 -0.03 -0.47 -0.85 0.00 0.00 174.74 173.11 1wke s TYR 258 N 1.37 3.01 -0.48 1.40 5.04 0.04 -0.22 117.35 127.50 1wke s TYR 258 Ca 0.03 -1.06 -0.17 0.00 -2.44 0.00 0.00 57.07 53.43 1wke s TYR 258 Cb -0.15 -2.12 0.07 0.00 0.35 0.00 0.00 41.96 40.11 1wke s TYR 258 CO -0.06 -0.59 0.46 -1.17 -1.34 0.00 0.00 175.55 172.85 1wke s LEU 259 N 1.45 5.40 0.31 6.97 2.96 -0.26 0.08 118.68 135.59 1wke s LEU 259 Ca 0.04 -1.18 -0.29 0.00 -0.22 0.00 0.00 54.13 52.48 1wke s LEU 259 Cb -0.15 -2.27 -0.10 0.00 0.50 0.00 0.00 46.19 44.17 1wke s LEU 259 CO -0.03 -0.72 1.19 -0.04 -1.32 0.00 0.00 176.35 175.44 1wke s MET 260 N 1.95 4.48 -1.61 1.98 -1.94 -1.24 -3.74 119.30 119.18 1wke s MET 260 Ca 0.08 1.98 0.00 0.00 -1.71 0.00 0.00 55.69 56.04 1wke s MET 260 Cb -0.22 -3.11 0.00 0.00 2.01 0.00 0.00 34.83 33.51 1wke s MET 260 CO 0.08 0.01 0.00 0.41 -0.01 0.00 0.00 175.02 175.52 1wke n GLY 261 N 0.99 1.45 3.60 -0.03 0.00 -1.07 -4.84 105.19 105.29 1wke n GLY 261 Ca -0.00 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1wke n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wke s VAL 262 N -2.29 4.80 0.00 1.61 1.01 -0.87 -4.80 120.40 119.85 1wke s VAL 262 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1wke s VAL 262 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1wke s VAL 262 CO 0.00 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.12 1wke n GLY 263 N 3.94 1.00 3.76 4.51 0.00 -1.26 -3.79 105.19 113.35 1wke n GLY 263 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1wke n GLY 263 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wke n LYS 264 N 0.00 2.60 -0.30 1.61 5.02 -1.26 -4.78 118.16 121.05 1wke n LYS 264 Ca 0.00 0.91 0.13 0.00 -2.02 0.00 0.00 58.31 57.34 1wke n LYS 264 Cb 0.09 -2.62 0.30 0.00 -0.02 0.00 0.00 35.03 32.78 1wke n LYS 264 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1wke h PRO 265 N 2.97 0.21 -0.15 1.97 0.11 -2.00 0.13 132.00 135.24 1wke h PRO 265 Ca -0.50 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 1wke h PRO 265 Cb 1.25 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1wke h PRO 265 CO 0.64 0.14 -0.37 0.38 -0.21 0.00 0.00 178.00 178.58 1wke h ASP 266 N 0.22 0.33 -0.36 -2.05 2.03 -2.00 -2.35 116.42 112.24 1wke h ASP 266 Ca 0.56 -0.13 -0.04 0.00 -0.73 0.00 0.00 57.03 56.69 1wke h ASP 266 Cb 1.13 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 39.53 1wke h ASP 266 CO -0.65 0.68 0.06 0.44 -1.03 0.00 0.00 179.24 178.73 1wke h ASP 267 N 0.27 0.57 -0.37 4.15 3.32 -1.13 -2.33 116.42 120.90 1wke h ASP 267 Ca 0.03 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 1wke h ASP 267 Cb 0.78 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1wke h ASP 267 CO 0.06 0.69 0.18 0.40 -1.72 0.00 0.00 179.24 178.85 1wke h ILE 268 N 0.43 1.16 -0.58 0.35 2.04 -1.19 0.11 117.51 119.82 1wke h ILE 268 Ca 0.11 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 1wke h ILE 268 Cb 0.36 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1wke h ILE 268 CO 0.01 0.17 0.29 0.58 0.00 0.00 0.00 178.15 179.19 1wke h VAL 269 N 0.46 1.21 -0.05 1.67 2.07 -1.37 -0.15 116.25 120.08 1wke h VAL 269 Ca 0.13 -0.57 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 1wke h VAL 269 Cb 0.10 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1wke h VAL 269 CO -0.02 0.23 -0.55 1.23 0.02 0.00 0.00 177.57 178.49 1wke h GLY 270 N 0.79 0.16 1.24 2.17 0.00 -1.26 -2.64 103.07 103.54 1wke h GLY 270 Ca 0.20 -0.19 -0.17 0.00 0.00 0.00 0.00 47.33 47.18 1wke h GLY 270 CO -0.03 0.17 -0.48 0.00 0.00 0.00 0.00 176.54 176.20 1wke h ALA 271 N 1.32 0.58 -0.69 3.60 0.00 -0.35 -2.90 119.26 120.82 1wke h ALA 271 Ca -0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1wke h ALA 271 Cb 1.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1wke h ALA 271 CO 0.08 0.68 0.24 0.28 0.00 0.00 0.00 179.25 180.53 1wke h VAL 272 N 0.64 1.24 0.00 0.00 2.07 -0.95 -0.51 116.25 118.74 1wke h VAL 272 Ca 0.03 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 1wke h VAL 272 Cb 1.07 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1wke h VAL 272 CO 0.11 0.32 -0.01 -0.33 0.02 0.00 0.00 177.57 177.68 1wke h GLU 273 N 1.01 0.00 -0.72 1.57 5.08 -1.38 -1.49 114.58 118.66 1wke h GLU 273 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1wke h GLU 273 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1wke h GLU 273 CO -0.01 0.01 0.00 0.54 -1.00 0.00 0.00 179.01 178.54 1wke n ARG 274 N -3.17 2.80 0.00 2.33 1.74 -0.26 -4.22 116.66 115.89 1wke n ARG 274 Ca -0.02 -2.66 0.00 0.00 -0.77 0.00 0.00 57.85 54.40 1wke n ARG 274 Cb 0.13 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.99 1wke n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wke n GLY 275 N 1.57 0.76 3.75 -0.13 0.00 -0.56 -4.77 105.19 105.81 1wke n GLY 275 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1wke n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wke s ILE 276 N -2.00 4.27 -0.04 -0.61 -1.09 -0.87 -4.66 121.20 116.21 1wke s ILE 276 Ca 0.00 2.00 0.11 0.00 -2.23 0.00 0.00 60.65 60.53 1wke s ILE 276 Cb 0.00 -4.29 -0.17 0.00 -1.58 0.00 0.00 42.46 36.42 1wke s ILE 276 CO 0.00 0.45 0.21 0.47 -1.23 0.00 0.00 174.94 174.83 1wke n ASP 277 N 1.94 2.33 -3.97 3.58 8.00 0.69 -4.40 116.55 124.72 1wke n ASP 277 Ca -0.01 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 1wke n ASP 277 Cb 0.48 1.36 -0.13 0.00 -0.02 0.00 0.00 41.12 42.82 1wke n ASP 277 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1wke s MET 278 N -2.69 0.32 0.05 -1.24 -1.94 -0.89 -0.44 119.30 112.47 1wke s MET 278 Ca -0.05 -0.41 -0.04 0.00 -1.71 0.00 0.00 55.69 53.49 1wke s MET 278 Cb 0.07 -0.14 -0.02 0.00 2.01 0.00 0.00 34.83 36.74 1wke s MET 278 CO 0.48 0.02 0.05 -0.06 -0.01 0.00 0.00 175.02 175.50 1wke s PHE 279 N -0.78 0.33 -0.12 -0.03 0.40 -0.57 -1.10 117.98 116.11 1wke s PHE 279 Ca -0.06 -0.75 -0.20 0.00 -0.60 0.00 0.00 56.93 55.32 1wke s PHE 279 Cb -0.06 -0.23 0.05 0.00 0.51 0.00 0.00 43.02 43.29 1wke s PHE 279 CO -0.00 -0.38 0.50 0.16 0.70 0.00 0.00 175.22 176.19 1wke s ASP 280 N -2.50 -0.48 -0.20 1.36 -4.77 -1.25 -0.75 116.67 108.08 1wke s ASP 280 Ca 0.00 0.74 -0.29 0.00 -3.30 0.00 0.00 52.55 49.71 1wke s ASP 280 Cb 0.03 0.77 0.13 0.00 -1.09 0.00 0.00 42.92 42.76 1wke s ASP 280 CO -0.07 -0.33 1.05 0.00 0.70 0.00 0.00 175.17 176.51 1wke n VAL 282 N 1.13 0.00 -0.17 0.00 0.24 -1.26 -4.40 118.33 113.86 1wke n VAL 282 Ca -0.10 -0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.12 1wke n VAL 282 Cb 0.57 -0.29 -0.01 0.00 -1.47 0.00 0.00 33.84 32.64 1wke n VAL 282 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1wke h LEU 283 N 0.03 -1.25 -0.53 1.34 5.85 -1.96 0.14 115.31 118.94 1wke h LEU 283 Ca 0.00 0.22 0.06 0.00 0.84 0.00 0.00 57.88 59.00 1wke h LEU 283 Cb 0.48 0.59 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 1wke h LEU 283 CO 0.00 -0.32 0.23 1.55 -0.34 0.00 0.00 178.44 179.56 1wke h PRO 284 N -0.22 0.44 0.06 5.25 0.13 -1.92 0.86 132.00 136.60 1wke h PRO 284 Ca 0.19 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wke h PRO 284 Cb 0.56 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.59 1wke h PRO 284 CO -0.63 0.29 -0.03 1.79 -0.23 0.00 0.00 178.00 179.19 1wke h THR 285 N 0.45 1.23 0.26 1.56 1.35 -1.80 -2.53 112.91 113.43 1wke h THR 285 Ca 0.24 -1.07 0.01 0.00 -0.55 0.00 0.00 66.41 65.04 1wke h THR 285 Cb 0.21 1.92 -0.03 0.00 -1.73 0.00 0.00 68.15 68.52 1wke h THR 285 CO -0.21 0.26 -0.34 -0.09 -0.25 0.00 0.00 175.52 174.90 1wke h ARG 286 N -0.57 -0.63 0.00 4.72 2.43 -0.64 -1.94 114.38 117.76 1wke h ARG 286 Ca -0.01 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1wke h ARG 286 Cb 0.49 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1wke h ARG 286 CO 0.01 -0.42 -0.08 0.66 -1.51 0.00 0.00 179.97 178.64 1wke h SER 287 N -0.66 0.00 -0.11 -3.80 4.64 -0.94 -2.11 113.55 110.58 1wke h SER 287 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1wke h SER 287 Cb 0.62 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1wke h SER 287 CO -0.11 0.08 0.05 1.23 -0.87 0.00 0.00 176.83 177.21 1wke h GLY 288 N 0.32 0.16 1.89 -0.77 0.00 -0.90 0.17 103.07 103.95 1wke h GLY 288 Ca -0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1wke h GLY 288 CO 0.01 0.08 -0.11 -0.09 0.00 0.00 0.00 176.54 176.43 1wke h ARG 289 N 0.05 0.14 0.00 4.80 2.43 -0.92 -2.46 114.38 118.42 1wke h ARG 289 Ca 0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1wke h ARG 289 Cb 0.11 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1wke h ARG 289 CO -0.00 0.26 -0.05 0.09 -1.51 0.00 0.00 179.97 178.75 1wke n ASN 290 N -4.34 0.70 0.00 -3.80 5.03 -0.88 -4.91 115.26 107.05 1wke n ASN 290 Ca -0.01 0.52 0.00 0.00 0.87 0.00 0.00 54.58 55.96 1wke n ASN 290 Cb 0.23 -0.68 0.00 0.00 -1.02 0.00 0.00 39.78 38.31 1wke n ASN 290 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1wke n GLY 291 N 1.34 1.01 3.58 7.41 0.00 -0.35 -4.96 105.19 113.22 1wke n GLY 291 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1wke n GLY 291 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wke s GLN 292 N -0.87 3.91 -0.10 1.61 0.74 0.47 -0.88 119.66 124.55 1wke s GLN 292 Ca 0.00 -0.35 0.01 0.00 0.05 0.00 0.00 55.36 55.06 1wke s GLN 292 Cb 0.00 -3.43 -0.02 0.00 1.10 0.00 0.00 33.01 30.66 1wke s GLN 292 CO 0.00 -0.00 -0.11 0.00 -0.55 0.00 0.00 175.29 174.63 1wke s ALA 293 N 1.19 2.77 0.14 1.58 0.00 -0.36 -3.81 121.76 123.26 1wke s ALA 293 Ca 0.06 -0.90 -0.23 0.00 0.00 0.00 0.00 51.96 50.89 1wke s ALA 293 Cb -0.14 -1.20 -0.08 0.00 0.00 0.00 0.00 23.12 21.70 1wke s ALA 293 CO 0.05 0.40 0.70 -0.06 0.00 0.00 0.00 175.76 176.85 1wke s PHE 294 N -0.21 3.86 0.11 0.00 0.08 -1.26 -0.60 117.98 119.95 1wke s PHE 294 Ca 0.02 1.50 -0.02 0.00 0.12 0.00 0.00 56.93 58.54 1wke s PHE 294 Cb -0.13 -2.67 -0.04 0.00 -0.57 0.00 0.00 43.02 39.62 1wke s PHE 294 CO 0.03 0.53 0.06 0.95 -0.10 0.00 0.00 175.22 176.68 1wke s THR 295 N -1.17 0.13 -0.23 0.64 -4.23 -0.99 -4.85 115.64 104.96 1wke s THR 295 Ca 0.34 -1.80 0.24 0.00 -1.18 0.00 0.00 61.69 59.29 1wke s THR 295 Cb -0.21 -1.85 0.25 0.00 1.34 0.00 0.00 72.50 72.02 1wke s THR 295 CO 0.23 -0.61 1.73 -0.50 -0.54 0.00 0.00 174.62 174.94 1wke h TRP 296 N 2.91 0.00 -0.60 3.99 4.06 -1.96 -0.76 115.95 123.59 1wke h TRP 296 Ca -0.34 0.00 -0.26 0.00 2.06 0.00 0.00 58.89 60.35 1wke h TRP 296 Cb 1.19 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 29.19 1wke h TRP 296 CO 0.46 0.00 0.21 -0.25 -3.56 0.00 0.00 178.44 175.29 1wke n ASP 297 N -2.33 3.49 0.00 -3.49 8.00 -1.26 -3.20 116.55 117.75 1wke n ASP 297 Ca -0.00 -3.52 0.00 0.00 0.71 0.00 0.00 54.79 51.97 1wke n ASP 297 Cb 0.11 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 1wke n ASP 297 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wke n GLY 298 N -0.86 0.38 3.80 0.44 0.00 -0.29 -4.79 105.19 103.86 1wke n GLY 298 Ca 0.41 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.19 1wke n GLY 298 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1wke s PRO 299 N -1.69 3.20 0.10 1.61 0.02 -1.26 -2.34 135.00 134.63 1wke s PRO 299 Ca 0.00 1.22 0.04 0.00 0.02 0.00 0.00 61.00 62.28 1wke s PRO 299 Cb 0.00 -2.01 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1wke s PRO 299 CO 0.00 -0.91 -0.11 0.96 -0.33 0.00 0.00 177.00 176.61 1wke s ILE 300 N -2.47 0.99 -0.38 2.83 -4.36 0.23 -4.92 121.20 113.12 1wke s ILE 300 Ca 0.64 -1.61 -0.08 0.00 -0.26 0.00 0.00 60.65 59.33 1wke s ILE 300 Cb -0.17 -1.34 0.06 0.00 1.25 0.00 0.00 42.46 42.26 1wke s ILE 300 CO 0.39 -0.52 0.18 0.21 0.24 0.00 0.00 174.94 175.45 1wke s ASN 301 N -2.38 5.50 0.59 4.36 3.84 -1.26 -1.23 114.94 124.37 1wke s ASN 301 Ca 0.05 -1.29 0.29 0.00 0.21 0.00 0.00 52.86 52.11 1wke s ASN 301 Cb -0.04 -1.94 1.54 0.00 -0.55 0.00 0.00 41.25 40.27 1wke s ASN 301 CO 0.01 -0.43 1.96 -0.29 -2.79 0.00 0.00 177.10 175.56 1wke h ILE 302 N 6.10 0.37 0.00 -5.21 6.09 -1.39 -1.85 117.51 121.62 1wke h ILE 302 Ca -0.23 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 1wke h ILE 302 Cb 1.08 0.69 0.00 0.00 0.47 0.00 0.00 36.82 39.06 1wke h ILE 302 CO 0.68 0.00 0.00 0.03 -3.07 0.00 0.00 178.15 175.79 1wke h ARG 303 N 0.00 0.00 -6.74 2.19 3.08 -1.88 -3.42 114.38 107.62 1wke h ARG 303 Ca 0.16 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.68 1wke h ARG 303 Cb 0.94 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.07 1wke h ARG 303 CO -0.00 0.00 0.89 -1.71 -1.07 0.00 0.00 179.97 178.08 1wke n ASN 304 N -2.94 3.79 -0.06 7.04 2.85 -0.70 -4.88 115.26 120.36 1wke n ASN 304 Ca 0.00 1.13 0.25 0.00 -0.11 0.00 0.00 54.58 55.85 1wke n ASN 304 Cb 0.25 -1.57 0.71 0.00 1.24 0.00 0.00 39.78 40.41 1wke n ASN 304 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wke h ALA 305 N 5.23 2.51 0.00 5.20 0.00 -1.91 -0.61 119.26 129.69 1wke h ALA 305 Ca -0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1wke h ALA 305 Cb 1.22 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1wke h ALA 305 CO 0.83 -0.99 0.00 2.89 0.00 0.00 0.00 179.25 181.98 1wke n ARG 306 N -3.84 0.17 -0.07 0.00 1.85 -1.26 -1.92 116.66 111.60 1wke n ARG 306 Ca 0.14 0.17 0.10 0.00 -1.00 0.00 0.00 57.85 57.26 1wke n ARG 306 Cb 0.89 -1.50 0.12 0.00 -1.05 0.00 0.00 32.46 30.92 1wke n ARG 306 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1wke n PHE 307 N -1.31 0.18 0.11 2.89 3.72 -0.24 -4.56 117.46 118.24 1wke n PHE 307 Ca 0.06 -0.11 0.14 0.00 -0.05 0.00 0.00 57.45 57.50 1wke n PHE 307 Cb 0.12 -0.00 0.66 0.00 -0.94 0.00 0.00 39.48 39.32 1wke n PHE 307 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1wke h SER 308 N 3.76 0.01 0.00 4.37 4.64 -1.54 -2.89 113.55 121.90 1wke h SER 308 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1wke h SER 308 Cb 0.83 -0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.85 1wke h SER 308 CO 0.00 0.01 -0.45 -0.62 -0.87 0.00 0.00 176.83 174.90 1wke n GLU 309 N -4.45 0.55 -2.70 4.77 1.02 -1.26 -4.71 120.64 113.85 1wke n GLU 309 Ca 0.04 -1.89 -0.43 0.00 -0.02 0.00 0.00 57.16 54.86 1wke n GLU 309 Cb 0.37 -0.83 -0.03 0.00 -0.02 0.00 0.00 31.44 30.93 1wke n GLU 309 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wke s ASP 310 N -1.96 6.74 0.06 1.62 -1.08 -1.10 -4.91 116.67 116.03 1wke s ASP 310 Ca 0.19 0.67 0.27 0.00 -0.52 0.00 0.00 52.55 53.17 1wke s ASP 310 Cb 0.19 -2.51 0.99 0.00 -1.46 0.00 0.00 42.92 40.13 1wke s ASP 310 CO -0.03 -0.98 1.79 0.18 0.52 0.00 0.00 175.17 176.65 1wke n LEU 311 N 7.10 0.30 -4.78 -1.34 7.99 -1.26 -0.93 117.00 124.09 1wke n LEU 311 Ca 0.10 0.44 -0.33 0.00 -0.01 0.00 0.00 56.01 56.20 1wke n LEU 311 Cb 0.48 -0.40 0.03 0.00 -0.11 0.00 0.00 43.42 43.41 1wke n LEU 311 CO 0.62 -0.03 0.74 -0.54 -1.51 0.00 0.00 177.39 176.68 1wke s LYS 312 N -3.03 3.05 0.96 3.23 1.02 -1.26 -4.53 119.74 119.17 1wke s LYS 312 Ca 0.12 1.40 -0.12 0.00 0.02 0.00 0.00 55.97 57.39 1wke s LYS 312 Cb 0.17 -1.98 0.17 0.00 -0.52 0.00 0.00 37.83 35.66 1wke s LYS 312 CO 0.58 -1.06 1.10 -1.25 -0.92 0.00 0.00 175.35 173.81 1wke s PRO 313 N -3.89 0.75 0.28 -1.68 0.04 -1.26 -1.11 135.00 128.12 1wke s PRO 313 Ca 0.68 0.51 0.01 0.00 0.04 0.00 0.00 61.00 62.24 1wke s PRO 313 Cb -0.20 -1.78 0.65 0.00 0.04 0.00 0.00 34.50 33.21 1wke s PRO 313 CO 0.37 -2.51 1.70 -0.07 0.04 0.00 0.00 177.00 176.53 1wke h LEU 314 N -1.73 0.29 -7.55 -3.56 4.07 -1.89 -3.40 115.31 101.54 1wke h LEU 314 Ca -0.53 0.15 -0.24 0.00 0.08 0.00 0.00 57.88 57.33 1wke h LEU 314 Cb 1.32 0.13 -0.30 0.00 1.08 0.00 0.00 40.66 42.89 1wke h LEU 314 CO 0.58 0.02 -0.65 -0.62 -1.08 0.00 0.00 178.44 176.69 1wke s ASP 315 N -5.22 -0.05 0.34 -0.43 -1.08 -1.26 -4.89 116.67 104.07 1wke s ASP 315 Ca -0.12 0.17 0.26 0.00 -0.52 0.00 0.00 52.55 52.34 1wke s ASP 315 Cb 0.24 0.11 1.11 0.00 -1.46 0.00 0.00 42.92 42.92 1wke s ASP 315 CO 0.77 -0.09 1.79 0.77 0.52 0.00 0.00 175.17 178.93 1wke h SER 316 N 6.73 0.00 0.00 -0.34 4.64 -1.98 -3.15 113.55 119.45 1wke h SER 316 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1wke h SER 316 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1wke h SER 316 CO 0.46 0.00 -0.62 -0.62 -0.87 0.00 0.00 176.83 175.18 1wke n GLU 317 N -2.45 3.38 -2.07 4.77 1.02 -1.26 -5.01 120.64 119.01 1wke n GLU 317 Ca 0.01 -0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.72 1wke n GLU 317 Cb 0.23 -0.95 -0.03 0.00 -0.02 0.00 0.00 31.44 30.67 1wke n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wke n HIS 319 N 2.44 1.64 -2.05 0.00 1.44 -1.26 -4.76 115.22 112.67 1wke n HIS 319 Ca 0.07 -0.61 -0.33 0.00 -2.01 0.00 0.00 57.72 54.83 1wke n HIS 319 Cb 0.41 -0.33 0.01 0.00 0.12 0.00 0.00 29.99 30.20 1wke n HIS 319 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1wke h ALA 321 N 0.52 1.76 -0.21 0.00 0.00 -1.94 -2.10 119.26 117.28 1wke h ALA 321 Ca -0.47 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1wke h ALA 321 Cb 1.23 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1wke h ALA 321 CO 0.57 -0.02 0.08 0.28 0.00 0.00 0.00 179.25 180.16 1wke h VAL 322 N 0.76 0.96 0.00 0.00 2.07 -1.91 -1.09 116.25 117.04 1wke h VAL 322 Ca 0.48 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.93 1wke h VAL 322 Cb 0.70 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1wke h VAL 322 CO -0.24 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.39 1wke h GLN 324 N 0.00 0.00 0.00 0.00 1.08 -0.75 -3.41 115.11 112.02 1wke h GLN 324 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1wke h GLN 324 Cb 0.57 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1wke h GLN 324 CO 0.00 0.36 -1.15 1.17 -0.95 0.00 0.00 178.83 178.26 1wke n LYS 325 N -3.06 0.72 -4.29 1.46 4.81 -0.48 -5.07 118.16 112.25 1wke n LYS 325 Ca -0.02 -0.02 -0.23 0.00 -0.87 0.00 0.00 58.31 57.17 1wke n LYS 325 Cb 0.74 -1.07 -0.12 0.00 0.02 0.00 0.00 35.03 34.60 1wke n LYS 325 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1wke s TRP 326 N -2.19 1.74 0.40 5.64 0.51 0.65 -5.09 118.94 120.60 1wke s TRP 326 Ca -0.01 -0.45 0.00 0.00 -2.12 0.00 0.00 56.10 53.53 1wke s TRP 326 Cb 0.02 -0.92 -0.02 0.00 -0.81 0.00 0.00 33.47 31.74 1wke s TRP 326 CO 0.13 0.23 0.61 -1.54 -0.51 0.00 0.00 176.95 175.87 1wke s SER 327 N -2.17 6.08 0.26 2.95 1.04 -1.26 -4.51 113.70 116.08 1wke s SER 327 Ca 0.09 0.37 -0.03 0.00 0.48 0.00 0.00 55.95 56.86 1wke s SER 327 Cb -0.08 -1.79 0.41 0.00 0.10 0.00 0.00 66.02 64.66 1wke s SER 327 CO 0.05 -0.49 1.86 0.03 0.98 0.00 0.00 173.24 175.66 1wke h ARG 328 N 0.58 1.02 -0.70 4.02 3.08 -1.09 -2.23 114.38 119.05 1wke h ARG 328 Ca -0.48 -0.06 0.09 0.00 0.07 0.00 0.00 59.98 59.60 1wke h ARG 328 Cb 1.23 -0.23 -0.07 0.00 0.08 0.00 0.00 29.97 30.99 1wke h ARG 328 CO 0.59 0.67 0.35 0.00 -1.07 0.00 0.00 179.97 180.51 1wke h ALA 329 N 1.46 0.96 -0.12 0.04 0.00 -0.97 0.35 119.26 120.98 1wke h ALA 329 Ca 0.42 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.33 1wke h ALA 329 Cb 0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1wke h ALA 329 CO -0.20 -0.05 -0.13 -0.92 0.00 0.00 0.00 179.25 177.96 1wke h TYR 330 N 0.60 0.37 -0.53 0.00 3.20 -1.72 -2.31 116.97 116.57 1wke h TYR 330 Ca 0.34 -0.11 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 1wke h TYR 330 Cb 0.35 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1wke h TYR 330 CO -0.11 0.72 0.13 0.82 -1.64 0.00 0.00 178.16 178.08 1wke h ILE 331 N -0.09 1.22 -0.56 1.81 2.04 -1.12 -0.06 117.51 120.75 1wke h ILE 331 Ca 0.02 -0.80 0.02 0.00 1.00 0.00 0.00 64.86 65.10 1wke h ILE 331 Cb 0.66 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 1wke h ILE 331 CO 0.03 0.30 0.35 -0.74 0.00 0.00 0.00 178.15 178.09 1wke h HIS 332 N 0.78 0.65 0.05 1.37 2.76 -0.28 -0.68 115.15 119.80 1wke h HIS 332 Ca 0.17 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.36 1wke h HIS 332 Cb 0.29 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.03 1wke h HIS 332 CO 0.02 0.38 -0.02 1.25 -1.30 0.00 0.00 177.93 178.25 1wke h HIS 333 N 0.69 -0.06 -0.07 5.26 -0.00 -0.66 -1.66 115.15 118.65 1wke h HIS 333 Ca 0.22 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.62 1wke h HIS 333 Cb 0.00 0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.40 1wke h HIS 333 CO -0.06 0.05 -0.12 -0.07 -0.00 0.00 0.00 177.93 177.73 1wke h LEU 334 N -0.15 -0.37 -0.65 0.26 4.07 -0.66 0.66 115.31 118.46 1wke h LEU 334 Ca -0.01 0.07 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1wke h LEU 334 Cb 0.13 0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.01 1wke h LEU 334 CO 0.01 -0.17 0.29 0.40 -1.08 0.00 0.00 178.44 177.89 1wke h ILE 335 N -0.17 1.23 0.00 1.22 1.08 -1.12 -0.15 117.51 119.59 1wke h ILE 335 Ca 0.07 -0.68 -0.05 0.00 -0.39 0.00 0.00 64.86 63.80 1wke h ILE 335 Cb 0.27 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 1wke h ILE 335 CO -0.17 0.28 -0.25 0.03 -0.69 0.00 0.00 178.15 177.35 1wke h ARG 336 N 0.91 0.00 -0.00 2.37 3.08 -1.01 -2.05 114.38 117.68 1wke h ARG 336 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1wke h ARG 336 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1wke h ARG 336 CO -0.02 0.25 -0.21 0.00 -1.07 0.00 0.00 179.97 178.91 1wke n ALA 337 N -2.27 2.95 -1.77 0.04 0.00 0.20 -4.93 120.51 114.73 1wke n ALA 337 Ca -0.01 -0.30 -0.08 0.00 0.00 0.00 0.00 53.44 53.06 1wke n ALA 337 Cb 0.40 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 1wke n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wke n GLY 338 N 1.37 0.42 3.75 0.00 0.00 -0.70 -5.00 105.19 105.02 1wke n GLY 338 Ca 0.11 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 1wke n GLY 338 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wke s GLU 339 N -3.67 4.71 0.33 1.61 0.41 -0.15 -4.95 118.70 116.98 1wke s GLU 339 Ca 0.00 1.65 0.03 0.00 -0.41 0.00 0.00 54.97 56.24 1wke s GLU 339 Cb 0.00 -3.25 0.62 0.00 -1.78 0.00 0.00 34.13 29.72 1wke s GLU 339 CO 0.00 0.29 1.92 0.82 -0.49 0.00 0.00 175.26 177.80 1wke h ILE 340 N 3.32 1.03 -0.09 -1.63 2.04 -1.94 -0.09 117.51 120.15 1wke h ILE 340 Ca -0.45 -0.31 0.03 0.00 1.00 0.00 0.00 64.86 65.12 1wke h ILE 340 Cb 1.21 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1wke h ILE 340 CO 0.69 0.17 0.07 0.25 0.00 0.00 0.00 178.15 179.33 1wke h LEU 341 N 0.91 0.00 -0.36 1.44 5.85 -1.93 -1.07 115.31 120.14 1wke h LEU 341 Ca 0.37 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.06 1wke h LEU 341 Cb 0.26 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1wke h LEU 341 CO -0.14 0.00 0.10 1.23 -0.34 0.00 0.00 178.44 179.29 1wke h GLY 342 N 0.00 0.62 0.98 3.75 0.00 -1.27 -0.30 103.07 106.85 1wke h GLY 342 Ca 0.04 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1wke h GLY 342 CO -0.00 0.36 0.05 0.00 0.00 0.00 0.00 176.54 176.95 1wke h ALA 343 N 0.94 0.64 0.02 3.60 0.00 -1.28 -1.48 119.26 121.70 1wke h ALA 343 Ca 0.12 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1wke h ALA 343 Cb 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wke h ALA 343 CO -0.00 0.40 -0.01 0.52 0.00 0.00 0.00 179.25 180.16 1wke h MET 344 N 0.68 -0.02 -0.31 0.00 2.07 -1.22 -1.07 114.93 115.06 1wke h MET 344 Ca 0.14 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.74 1wke h MET 344 Cb 0.43 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.16 1wke h MET 344 CO 0.01 -0.00 0.07 -0.07 1.07 0.00 0.00 176.91 177.99 1wke h LEU 345 N -0.03 0.48 -0.64 1.22 4.07 -1.03 -2.09 115.31 117.28 1wke h LEU 345 Ca -0.00 -0.24 -0.06 0.00 0.08 0.00 0.00 57.88 57.66 1wke h LEU 345 Cb 0.03 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1wke h LEU 345 CO 0.00 0.59 0.16 0.24 -1.08 0.00 0.00 178.44 178.35 1wke h MET 346 N 0.34 1.02 -0.23 1.13 2.86 -1.23 -2.11 114.93 116.71 1wke h MET 346 Ca 0.10 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.45 1wke h MET 346 Cb 0.31 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1wke h MET 346 CO 0.00 0.92 -0.01 1.15 1.06 0.00 0.00 176.91 180.03 1wke h THR 347 N 0.94 1.26 -0.72 2.22 2.02 -1.19 -1.33 112.91 116.11 1wke h THR 347 Ca 0.20 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.47 1wke h THR 347 Cb 0.36 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1wke h THR 347 CO 0.00 0.29 0.46 -0.08 0.37 0.00 0.00 175.52 176.56 1wke h GLU 348 N 0.18 0.89 -0.20 6.66 4.81 -1.33 -0.88 114.58 124.71 1wke h GLU 348 Ca 0.06 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1wke h GLU 348 Cb 0.43 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1wke h GLU 348 CO 0.01 0.59 0.06 1.25 -0.73 0.00 0.00 179.01 180.19 1wke h HIS 349 N 0.92 0.32 -0.83 0.92 2.76 -1.26 -1.47 115.15 116.50 1wke h HIS 349 Ca 0.28 -0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 1wke h HIS 349 Cb -0.03 -0.09 -0.04 0.00 1.55 0.00 0.00 27.41 28.80 1wke h HIS 349 CO -0.03 0.40 0.46 -0.91 -1.30 0.00 0.00 177.93 176.54 1wke h ASN 350 N 0.14 1.03 -0.32 3.26 -0.26 -0.86 0.48 115.58 119.06 1wke h ASN 350 Ca 0.06 -0.09 -0.16 0.00 -0.56 0.00 0.00 56.30 55.55 1wke h ASN 350 Cb 0.24 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 37.23 1wke h ASN 350 CO -0.00 0.82 -0.44 0.40 -1.06 0.00 0.00 177.43 177.15 1wke h ILE 351 N 1.16 1.28 -0.89 2.81 2.04 -1.19 -1.61 117.51 121.11 1wke h ILE 351 Ca 0.29 -1.63 -0.02 0.00 1.00 0.00 0.00 64.86 64.51 1wke h ILE 351 Cb 0.02 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1wke h ILE 351 CO -0.05 0.53 0.48 0.00 0.00 0.00 0.00 178.15 179.12 1wke h ALA 352 N 0.71 1.15 -0.47 1.87 0.00 -0.52 -1.12 119.26 120.87 1wke h ALA 352 Ca 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1wke h ALA 352 Cb 1.05 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1wke h ALA 352 CO 0.10 0.66 0.20 0.35 0.00 0.00 0.00 179.25 180.56 1wke h PHE 353 N 1.25 0.71 -0.40 0.00 3.57 0.14 -1.39 116.94 120.83 1wke h PHE 353 Ca 0.31 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1wke h PHE 353 Cb 0.04 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 1wke h PHE 353 CO 0.01 0.59 0.17 1.88 -2.23 0.00 0.00 178.31 178.73 1wke h TYR 354 N 0.62 0.60 -0.64 0.41 -1.99 -0.89 -1.55 116.97 113.54 1wke h TYR 354 Ca 0.16 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.83 1wke h TYR 354 Cb 0.18 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.69 1wke h TYR 354 CO 0.00 0.53 0.32 1.96 -0.00 0.00 0.00 178.16 180.97 1wke h GLN 355 N 0.50 0.89 -0.45 4.88 1.08 -1.02 -1.72 115.11 119.28 1wke h GLN 355 Ca 0.13 -0.11 -0.11 0.00 -1.45 0.00 0.00 58.65 57.12 1wke h GLN 355 Cb 0.17 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1wke h GLN 355 CO -0.01 0.68 -0.14 1.96 -0.95 0.00 0.00 178.83 180.36 1wke h GLN 356 N 0.89 0.85 -0.71 1.46 4.20 -1.07 -1.11 115.11 119.61 1wke h GLN 356 Ca 0.22 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 1wke h GLN 356 Cb 0.07 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1wke h GLN 356 CO -0.03 0.94 0.23 1.25 -0.67 0.00 0.00 178.83 180.55 1wke h LEU 357 N 0.75 1.03 -0.70 1.46 5.85 -0.70 -0.78 115.31 122.23 1wke h LEU 357 Ca 0.12 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.53 1wke h LEU 357 Cb 0.66 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1wke h LEU 357 CO 0.05 0.96 -0.14 0.24 -0.34 0.00 0.00 178.44 179.21 1wke h MET 358 N 1.05 0.86 -0.60 1.25 2.86 -1.01 -0.98 114.93 118.35 1wke h MET 358 Ca 0.23 -0.31 -0.10 0.00 -2.06 0.00 0.00 59.70 57.46 1wke h MET 358 Cb 0.29 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1wke h MET 358 CO -0.01 0.95 -0.01 0.37 1.06 0.00 0.00 176.91 179.27 1wke h GLN 359 N 0.77 1.07 -0.39 1.72 5.75 -0.88 0.84 115.11 123.98 1wke h GLN 359 Ca 0.12 -0.35 -0.08 0.00 -0.15 0.00 0.00 58.65 58.19 1wke h GLN 359 Cb 0.66 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 1wke h GLN 359 CO 0.05 1.05 -0.10 0.87 -2.65 0.00 0.00 178.83 178.05 1wke h LYS 360 N 0.97 0.69 -0.11 1.69 1.57 -0.99 -0.38 116.57 120.01 1wke h LYS 360 Ca 0.17 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1wke h LYS 360 Cb 0.57 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1wke h LYS 360 CO 0.03 0.77 -0.05 0.82 -0.57 0.00 0.00 179.45 180.45 1wke h ILE 361 N 0.63 1.32 -0.41 1.86 2.04 -0.68 -1.69 117.51 120.56 1wke h ILE 361 Ca 0.11 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1wke h ILE 361 Cb 0.54 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1wke h ILE 361 CO 0.03 0.30 0.27 0.03 0.00 0.00 0.00 178.15 178.78 1wke h ARG 362 N -0.13 0.55 -0.46 2.37 3.08 -0.71 -1.83 114.38 117.24 1wke h ARG 362 Ca 0.02 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 1wke h ARG 362 Cb 0.50 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1wke h ARG 362 CO 0.02 0.38 0.13 -0.44 -1.07 0.00 0.00 179.97 178.98 1wke h ASP 363 N 0.56 0.69 0.23 7.04 3.32 -1.12 -1.89 116.42 125.25 1wke h ASP 363 Ca 0.15 -0.22 -0.09 0.00 0.02 0.00 0.00 57.03 56.89 1wke h ASP 363 Cb -0.05 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1wke h ASP 363 CO -0.03 0.73 -0.36 0.77 -1.72 0.00 0.00 179.24 178.62 1wke h SER 364 N 0.62 0.19 -0.14 6.45 4.64 -1.19 -1.70 113.55 122.42 1wke h SER 364 Ca 0.15 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1wke h SER 364 Cb 0.30 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1wke h SER 364 CO -0.00 0.55 -0.05 0.40 -0.87 0.00 0.00 176.83 176.85 1wke h ILE 365 N 0.16 1.30 -0.00 0.95 2.04 -1.17 0.16 117.51 120.95 1wke h ILE 365 Ca 0.02 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1wke h ILE 365 Cb 0.72 1.71 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1wke h ILE 365 CO 0.05 0.31 0.00 0.28 0.00 0.00 0.00 178.15 178.80 1wke h SER 366 N -0.04 0.00 0.07 1.72 0.02 -1.24 -1.68 113.55 112.41 1wke h SER 366 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1wke h SER 366 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1wke h SER 366 CO 0.02 0.00 -0.27 -0.62 -1.14 0.00 0.00 176.83 174.82 1wke n GLU 367 N -4.26 1.31 -2.53 3.45 1.02 -0.65 -4.97 120.64 114.02 1wke n GLU 367 Ca -0.03 -0.96 -0.11 0.00 -0.02 0.00 0.00 57.16 56.04 1wke n GLU 367 Cb 0.09 -1.48 0.01 0.00 -0.02 0.00 0.00 31.44 30.04 1wke n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wke n GLY 368 N 1.35 0.03 1.13 0.62 0.00 -0.49 -4.92 105.19 102.91 1wke n GLY 368 Ca 0.12 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.83 1wke n GLY 368 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1wke n ARG 369 N -2.31 0.35 -0.13 1.61 1.85 0.44 -4.88 116.66 113.60 1wke n ARG 369 Ca -0.08 -2.13 -0.12 0.00 -1.00 0.00 0.00 57.85 54.52 1wke n ARG 369 Cb 0.57 -0.43 -0.02 0.00 -1.05 0.00 0.00 32.46 31.52 1wke n ARG 369 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1wke h PHE 370 N 0.82 0.95 -0.97 2.89 3.57 -1.80 -1.79 116.94 120.61 1wke h PHE 370 Ca -0.15 -0.25 0.10 0.00 3.53 0.00 0.00 57.97 61.21 1wke h PHE 370 Cb 1.62 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 40.07 1wke h PHE 370 CO 0.27 1.01 0.61 1.03 -2.23 0.00 0.00 178.31 179.00 1wke h SER 371 N 0.62 0.91 -0.31 0.41 0.87 -1.90 0.13 113.55 114.30 1wke h SER 371 Ca 0.08 0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.51 1wke h SER 371 Cb 0.77 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1wke h SER 371 CO 0.06 0.52 -0.46 -0.61 -0.53 0.00 0.00 176.83 175.81 1wke h GLN 372 N 1.01 0.85 -0.14 2.24 5.75 -1.92 -2.65 115.11 120.26 1wke h GLN 372 Ca 0.46 -0.51 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1wke h GLN 372 Cb 0.38 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 1wke h GLN 372 CO -0.24 1.15 0.08 0.35 -2.65 0.00 0.00 178.83 177.52 1wke h PHE 373 N 0.64 0.15 -0.43 3.99 3.57 -0.33 0.06 116.94 124.58 1wke h PHE 373 Ca 0.03 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.60 1wke h PHE 373 Cb 1.06 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.70 1wke h PHE 373 CO 0.07 0.09 0.13 0.00 -2.23 0.00 0.00 178.31 176.37 1wke h ALA 374 N 1.06 0.50 -0.10 2.41 0.00 -0.79 0.32 119.26 122.66 1wke h ALA 374 Ca 0.05 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1wke h ALA 374 Cb -0.01 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1wke h ALA 374 CO -0.02 -0.27 0.06 0.37 0.00 0.00 0.00 179.25 179.39 1wke h GLN 375 N 0.28 0.13 -0.44 0.00 4.15 -1.25 -0.83 115.11 117.15 1wke h GLN 375 Ca 0.21 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.53 1wke h GLN 375 Cb 0.23 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 1wke h GLN 375 CO -0.24 0.10 -0.10 -0.44 -1.93 0.00 0.00 178.83 176.23 1wke h ASP 376 N 0.12 0.77 0.43 -0.69 3.32 -0.48 -2.07 116.42 117.82 1wke h ASP 376 Ca 0.04 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 1wke h ASP 376 Cb 0.00 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1wke h ASP 376 CO -0.01 0.90 -0.20 0.15 -1.72 0.00 0.00 179.24 178.36 1wke h PHE 377 N 0.71 -0.53 -0.72 4.55 3.57 -0.03 -2.55 116.94 121.94 1wke h PHE 377 Ca 0.12 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 1wke h PHE 377 Cb 0.58 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1wke h PHE 377 CO 0.03 -0.32 0.38 0.00 -2.23 0.00 0.00 178.31 176.17 1wke h ARG 378 N -0.58 1.00 -0.68 1.11 3.08 -1.08 0.85 114.38 118.08 1wke h ARG 378 Ca -0.06 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 1wke h ARG 378 Cb 0.44 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1wke h ARG 378 CO 0.10 0.75 0.30 0.00 -1.07 0.00 0.00 179.97 180.04 1wke h ALA 379 N 1.41 0.88 0.19 0.04 0.00 -1.27 -2.39 119.26 118.12 1wke h ALA 379 Ca 0.25 -0.16 -0.29 0.00 0.00 0.00 0.00 54.91 54.71 1wke h ALA 379 Cb 0.05 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 17.59 1wke h ALA 379 CO -0.04 0.48 -1.37 -0.09 0.00 0.00 0.00 179.25 178.22 1wke h ARG 380 N 0.96 0.40 -0.22 0.00 2.43 -1.26 -3.35 114.38 113.35 1wke h ARG 380 Ca 0.23 -0.68 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1wke h ARG 380 Cb 0.17 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1wke h ARG 380 CO -0.02 1.33 0.08 -0.92 -1.51 0.00 0.00 179.97 178.92 1wke h TYR 381 N -0.07 0.29 -0.02 2.20 3.20 -0.79 -3.41 116.97 118.36 1wke h TYR 381 Ca -0.26 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.61 1wke h TYR 381 Cb 1.95 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 40.13 1wke h TYR 381 CO 0.14 0.24 0.00 1.19 -1.64 0.00 0.00 178.16 178.09