#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wkd s PRO 12 N 0.00 1.92 0.28 -0.14 0.04 -1.26 -4.58 135.00 131.26 1wkd s PRO 12 Ca 0.00 0.88 0.01 0.00 0.04 0.00 0.00 61.00 61.94 1wkd s PRO 12 Cb 0.00 -1.88 0.40 0.00 0.04 0.00 0.00 34.50 33.06 1wkd s PRO 12 CO 0.00 -1.80 1.74 -0.09 0.04 0.00 0.00 177.00 176.89 1wkd h ARG 13 N -1.23 0.57 -1.12 4.56 2.43 -1.86 -1.95 114.38 115.78 1wkd h ARG 13 Ca -0.47 -0.19 0.17 0.00 -0.81 0.00 0.00 59.98 58.68 1wkd h ARG 13 Cb 1.26 -0.04 -0.28 0.00 -0.42 0.00 0.00 29.97 30.48 1wkd h ARG 13 CO 0.55 0.72 0.48 0.12 -1.51 0.00 0.00 179.97 180.33 1wkd s PHE 14 N -4.64 -0.38 -0.23 2.20 5.36 -1.21 -4.29 117.98 114.79 1wkd s PHE 14 Ca -0.08 0.72 -0.04 0.00 -0.96 0.00 0.00 56.93 56.57 1wkd s PHE 14 Cb 0.14 0.23 0.12 0.00 -0.34 0.00 0.00 43.02 43.17 1wkd s PHE 14 CO 0.80 -0.19 0.40 0.45 -1.46 0.00 0.00 175.22 175.22 1wkd s SER 15 N 1.54 -0.02 -0.22 6.13 0.15 -0.53 -4.97 113.70 115.78 1wkd s SER 15 Ca -0.06 0.55 -0.09 0.00 0.70 0.00 0.00 55.95 57.05 1wkd s SER 15 Cb -0.03 1.25 -0.04 0.00 -1.71 0.00 0.00 66.02 65.48 1wkd s SER 15 CO -0.14 -0.27 0.11 0.12 1.20 0.00 0.00 173.24 174.26 1wkd s PHE 16 N 2.58 3.23 -0.11 3.44 5.36 -1.26 -0.79 117.98 130.44 1wkd s PHE 16 Ca 0.07 0.02 0.01 0.00 -0.96 0.00 0.00 56.93 56.07 1wkd s PHE 16 Cb -0.14 -2.20 0.02 0.00 -0.34 0.00 0.00 43.02 40.35 1wkd s PHE 16 CO -0.15 -0.01 -0.11 -1.12 -1.46 0.00 0.00 175.22 172.37 1wkd s SER 17 N 1.00 2.24 -0.29 6.13 0.01 0.04 -4.99 113.70 117.84 1wkd s SER 17 Ca 0.06 -0.36 -0.20 0.00 1.31 0.00 0.00 55.95 56.75 1wkd s SER 17 Cb -0.14 -0.95 -0.01 0.00 0.21 0.00 0.00 66.02 65.13 1wkd s SER 17 CO 0.03 -0.05 0.63 -0.63 0.41 0.00 0.00 173.24 173.63 1wkd s ILE 18 N 1.32 4.95 -0.06 1.44 1.01 -1.26 -0.71 121.20 127.89 1wkd s ILE 18 Ca -0.01 0.95 0.03 0.00 0.00 0.00 0.00 60.65 61.62 1wkd s ILE 18 Cb -0.14 -3.98 -0.25 0.00 0.01 0.00 0.00 42.46 38.11 1wkd s ILE 18 CO -0.05 -0.09 0.61 0.00 0.00 0.00 0.00 174.94 175.41 1wkd h ALA 19 N 8.09 0.57 -2.45 9.38 0.00 -0.31 -3.48 119.26 131.07 1wkd h ALA 19 Ca -0.27 -1.37 -0.08 0.00 0.00 0.00 0.00 54.91 53.19 1wkd h ALA 19 Cb 1.12 0.52 -0.18 0.00 0.00 0.00 0.00 17.79 19.25 1wkd h ALA 19 CO 0.79 1.42 -0.09 0.00 0.00 0.00 0.00 179.25 181.38 1wkd s ALA 20 N -2.59 -1.10 0.10 0.00 0.00 -0.72 -5.00 121.76 112.44 1wkd s ALA 20 Ca -0.11 0.48 0.02 0.00 0.00 0.00 0.00 51.96 52.35 1wkd s ALA 20 Cb 0.07 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.40 1wkd s ALA 20 CO 0.81 -0.41 -0.07 1.03 0.00 0.00 0.00 175.76 177.12 1wkd s ARG 21 N -2.06 0.83 -0.29 0.00 0.52 -1.26 -0.83 118.95 115.86 1wkd s ARG 21 Ca -0.08 -1.27 0.02 0.00 -0.52 0.00 0.00 55.73 53.88 1wkd s ARG 21 Cb -0.02 -0.29 0.18 0.00 0.52 0.00 0.00 34.95 35.35 1wkd s ARG 21 CO 0.01 0.01 0.51 -2.00 0.02 0.00 0.00 175.30 173.84 1wkd s GLU 22 N -3.51 0.49 6.87 3.54 2.12 -0.56 -4.89 118.70 122.77 1wkd s GLU 22 Ca 0.10 0.50 0.00 0.00 0.36 0.00 0.00 54.97 55.93 1wkd s GLU 22 Cb 0.03 0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.46 1wkd s GLU 22 CO -0.03 -0.91 0.00 0.41 -0.54 0.00 0.00 175.26 174.19 1wkd n GLY 23 N 5.39 1.69 0.00 -1.50 0.00 -1.26 -2.29 105.19 107.22 1wkd n GLY 23 Ca 0.01 -0.45 0.11 0.00 0.00 0.00 0.00 46.02 45.70 1wkd n GLY 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wkd n LYS 24 N 12.76 0.01 -2.62 1.61 5.02 -1.26 -4.92 118.16 128.76 1wkd n LYS 24 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.95 1wkd n LYS 24 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.46 1wkd n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wkd s ALA 25 N -3.01 2.98 0.05 7.82 0.00 -0.97 -3.11 121.76 125.53 1wkd s ALA 25 Ca 0.10 0.58 -0.17 0.00 0.00 0.00 0.00 51.96 52.47 1wkd s ALA 25 Cb 0.17 -3.23 0.03 0.00 0.00 0.00 0.00 23.12 20.09 1wkd s ALA 25 CO 0.75 -0.16 0.40 -0.98 0.00 0.00 0.00 175.76 175.77 1wkd s ARG 26 N -2.98 0.93 0.01 0.00 3.03 -1.26 -1.49 118.95 117.18 1wkd s ARG 26 Ca 0.63 -0.42 0.03 0.00 2.03 0.00 0.00 55.73 58.00 1wkd s ARG 26 Cb -0.16 0.41 -0.01 0.00 -1.03 0.00 0.00 34.95 34.16 1wkd s ARG 26 CO 0.20 -0.32 -0.10 -0.08 -1.13 0.00 0.00 175.30 173.88 1wkd s THR 27 N -2.65 0.76 0.00 4.99 -1.32 -0.01 -4.21 115.64 113.20 1wkd s THR 27 Ca -0.04 -0.57 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 1wkd s THR 27 Cb -0.00 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.32 1wkd s THR 27 CO -0.04 0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.08 1wkd n GLY 28 N 2.53 2.03 3.18 6.08 0.00 -0.85 0.49 105.19 118.65 1wkd n GLY 28 Ca -0.15 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 1wkd n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wkd s THR 29 N -0.80 0.08 -0.20 2.61 -4.23 0.11 -1.27 115.64 111.95 1wkd s THR 29 Ca 0.00 -0.70 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 1wkd s THR 29 Cb 0.00 -0.69 0.03 0.00 1.34 0.00 0.00 72.50 73.18 1wkd s THR 29 CO 0.00 -0.38 -0.18 -0.63 -0.54 0.00 0.00 174.62 172.89 1wkd s ILE 30 N -1.86 2.06 -0.18 2.99 1.01 0.33 -0.78 121.20 124.77 1wkd s ILE 30 Ca -0.10 -1.07 -0.13 0.00 0.00 0.00 0.00 60.65 59.34 1wkd s ILE 30 Cb -0.04 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 1wkd s ILE 30 CO 0.00 0.42 0.27 -1.61 0.00 0.00 0.00 174.94 174.02 1wkd s GLU 31 N 1.26 4.23 0.19 2.79 2.02 0.03 -0.79 118.70 128.42 1wkd s GLU 31 Ca 0.02 0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.05 1wkd s GLU 31 Cb -0.14 -3.45 -0.05 0.00 0.10 0.00 0.00 34.13 30.59 1wkd s GLU 31 CO -0.11 0.20 0.04 -1.64 0.02 0.00 0.00 175.26 173.77 1wkd s MET 32 N 0.59 1.17 0.31 1.61 -1.94 -0.73 -1.46 119.30 118.85 1wkd s MET 32 Ca 0.15 -1.59 0.02 0.00 -1.71 0.00 0.00 55.69 52.56 1wkd s MET 32 Cb -0.13 -0.15 0.58 0.00 2.01 0.00 0.00 34.83 37.15 1wkd s MET 32 CO 0.03 -0.21 1.88 0.87 -0.01 0.00 0.00 175.02 177.59 1wkd h LYS 33 N 2.64 0.94 -0.00 2.03 1.57 -1.53 -2.48 116.57 119.72 1wkd h LYS 33 Ca -0.37 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1wkd h LYS 33 Cb 1.22 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1wkd h LYS 33 CO 0.61 0.62 -0.22 0.54 -0.57 0.00 0.00 179.45 180.43 1wkd n ARG 34 N -4.54 0.45 0.00 3.15 1.74 -1.26 -4.68 116.66 111.52 1wkd n ARG 34 Ca 0.16 -0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1wkd n ARG 34 Cb 0.29 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 1wkd n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wkd n GLY 35 N 1.38 1.45 3.88 -0.13 0.00 -0.93 -4.15 105.19 106.68 1wkd n GLY 35 Ca 0.11 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1wkd n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wkd s VAL 36 N -1.98 5.32 -0.21 1.61 1.01 -1.26 -1.77 120.40 123.12 1wkd s VAL 36 Ca 0.00 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.22 1wkd s VAL 36 Cb 0.00 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.88 1wkd s VAL 36 CO 0.00 0.44 -0.11 -0.63 0.00 0.00 0.00 175.10 174.79 1wkd s ILE 37 N -1.23 1.76 0.01 2.22 1.01 0.03 -4.88 121.20 120.12 1wkd s ILE 37 Ca 0.25 -1.11 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 1wkd s ILE 37 Cb -0.13 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 1wkd s ILE 37 CO 0.13 0.17 0.93 -0.13 0.00 0.00 0.00 174.94 176.04 1wkd s ARG 38 N 1.34 4.56 0.14 2.79 0.52 -1.26 -0.51 118.95 126.53 1wkd s ARG 38 Ca -0.02 1.34 0.11 0.00 -0.52 0.00 0.00 55.73 56.63 1wkd s ARG 38 Cb -0.17 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 1wkd s ARG 38 CO -0.08 0.02 -0.26 0.95 0.02 0.00 0.00 175.30 175.95 1wkd s THR 39 N 0.78 2.25 0.30 0.02 -4.23 -0.40 -3.73 115.64 110.63 1wkd s THR 39 Ca 0.49 -1.78 -0.29 0.00 -1.18 0.00 0.00 61.69 58.92 1wkd s THR 39 Cb -0.21 -2.00 -0.13 0.00 1.34 0.00 0.00 72.50 71.51 1wkd s THR 39 CO 0.27 0.06 1.34 -2.65 -0.54 0.00 0.00 174.62 173.10 1wkd n PRO 40 N 0.85 2.12 -4.44 3.99 -0.02 -1.26 -2.00 135.00 134.23 1wkd n PRO 40 Ca -0.17 0.75 -0.25 0.00 -2.02 0.00 0.00 63.50 61.80 1wkd n PRO 40 Cb 0.53 -2.36 -0.13 0.00 -0.02 0.00 0.00 33.50 31.52 1wkd n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wkd s ALA 41 N -0.67 1.88 -0.08 3.55 0.00 0.17 -4.86 121.76 121.74 1wkd s ALA 41 Ca 0.60 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 51.39 1wkd s ALA 41 Cb -0.59 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.22 1wkd s ALA 41 CO 0.57 0.40 -0.22 0.12 0.00 0.00 0.00 175.76 176.64 1wkd s PHE 42 N -1.01 2.29 -0.30 0.00 5.36 -1.26 -1.30 117.98 121.76 1wkd s PHE 42 Ca 0.08 -0.88 -0.08 0.00 -0.96 0.00 0.00 56.93 55.09 1wkd s PHE 42 Cb -0.10 -1.54 0.01 0.00 -0.34 0.00 0.00 43.02 41.04 1wkd s PHE 42 CO 0.04 -0.35 0.10 -1.64 -1.46 0.00 0.00 175.22 171.90 1wkd s MET 43 N 0.31 3.15 0.65 10.12 -1.94 -0.11 -4.76 119.30 126.73 1wkd s MET 43 Ca -0.15 -0.83 -0.18 0.00 -1.71 0.00 0.00 55.69 52.82 1wkd s MET 43 Cb -0.17 -3.43 -0.01 0.00 2.01 0.00 0.00 34.83 33.24 1wkd s MET 43 CO 0.07 -0.44 1.30 -2.14 -0.01 0.00 0.00 175.02 173.79 1wkd s PRO 44 N 1.53 2.53 -0.25 2.03 0.02 -1.25 -4.07 135.00 135.53 1wkd s PRO 44 Ca 0.03 2.07 -0.12 0.00 0.02 0.00 0.00 61.00 62.99 1wkd s PRO 44 Cb -0.17 -1.84 -0.05 0.00 0.02 0.00 0.00 34.50 32.46 1wkd s PRO 44 CO 0.03 -1.62 0.25 0.08 -0.33 0.00 0.00 177.00 175.42 1wkd s VAL 45 N -1.40 5.28 -0.53 3.83 1.01 -1.26 -0.65 120.40 126.67 1wkd s VAL 45 Ca 0.83 0.34 -0.10 0.00 0.00 0.00 0.00 61.98 63.05 1wkd s VAL 45 Cb -0.38 -3.59 0.14 0.00 0.00 0.00 0.00 36.38 32.55 1wkd s VAL 45 CO 0.40 0.26 0.42 -0.83 0.00 0.00 0.00 175.10 175.35 1wkd s GLY 46 N 1.42 2.16 0.00 4.51 0.00 0.91 -4.44 107.32 111.89 1wkd s GLY 46 Ca 0.11 -2.70 -0.04 0.00 0.00 0.00 0.00 44.72 42.09 1wkd s GLY 46 CO 0.08 1.14 0.86 -0.84 0.00 0.00 0.00 173.10 174.33 1wkd h THR 47 N 5.87 0.00 -2.37 0.90 2.02 -1.78 -3.28 112.91 114.26 1wkd h THR 47 Ca -0.16 -0.02 -0.79 0.00 0.77 0.00 0.00 66.41 66.21 1wkd h THR 47 Cb 1.06 0.00 -0.29 0.00 -1.74 0.00 0.00 68.15 67.18 1wkd h THR 47 CO 0.85 0.00 0.81 0.00 0.37 0.00 0.00 175.52 177.55 1wkd n ALA 48 N -2.08 5.76 -3.57 6.16 0.00 -1.26 -4.18 120.51 121.34 1wkd n ALA 48 Ca -0.02 -4.66 -0.26 0.00 0.00 0.00 0.00 53.44 48.51 1wkd n ALA 48 Cb 0.05 -2.06 0.04 0.00 0.00 0.00 0.00 19.45 17.48 1wkd n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wkd n ALA 49 N 0.18 -1.19 -3.64 0.00 0.00 -1.26 -4.94 120.51 109.65 1wkd n ALA 49 Ca 0.42 0.26 -0.05 0.00 0.00 0.00 0.00 53.44 54.06 1wkd n ALA 49 Cb 0.29 -4.41 -0.07 0.00 0.00 0.00 0.00 19.45 15.26 1wkd n ALA 49 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1wkd s THR 50 N -3.23 0.00 -0.45 0.00 -1.32 -1.26 -4.75 115.64 104.63 1wkd s THR 50 Ca 0.53 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.76 1wkd s THR 50 Cb -0.26 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.76 1wkd s THR 50 CO 0.66 0.00 0.95 -0.69 -2.21 0.00 0.00 174.62 173.33 1wkd s VAL 51 N 0.73 4.46 -0.30 5.08 1.01 -1.26 -3.16 120.40 126.96 1wkd s VAL 51 Ca -0.02 0.84 -0.30 0.00 0.00 0.00 0.00 61.98 62.50 1wkd s VAL 51 Cb -0.04 -4.44 -0.13 0.00 0.00 0.00 0.00 36.38 31.77 1wkd s VAL 51 CO -0.11 -0.82 1.01 0.29 0.00 0.00 0.00 175.10 175.46 1wkd n LYS 52 N 7.19 0.00 -1.34 2.72 5.02 -1.26 -1.50 118.16 128.99 1wkd n LYS 52 Ca 0.07 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.24 1wkd n LYS 52 Cb 0.48 -0.96 -0.05 0.00 -0.02 0.00 0.00 35.03 34.48 1wkd n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wkd n ALA 53 N 2.47 -0.18 -2.61 7.82 0.00 -1.26 -4.96 120.51 121.79 1wkd n ALA 53 Ca 0.19 0.19 -0.21 0.00 0.00 0.00 0.00 53.44 53.61 1wkd n ALA 53 Cb -0.03 -1.61 -0.14 0.00 0.00 0.00 0.00 19.45 17.67 1wkd n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wkd s LEU 54 N -2.66 2.07 0.51 0.00 1.43 -0.56 -4.63 118.68 114.84 1wkd s LEU 54 Ca 0.00 -0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 52.62 1wkd s LEU 54 Cb 0.00 -0.66 -0.08 0.00 0.03 0.00 0.00 46.19 45.49 1wkd s LEU 54 CO 0.00 0.12 0.99 -0.54 0.23 0.00 0.00 176.35 177.15 1wkd s LYS 55 N -0.58 3.89 0.34 1.70 1.02 -1.26 -4.51 119.74 120.34 1wkd s LYS 55 Ca 0.04 1.03 0.03 0.00 0.02 0.00 0.00 55.97 57.10 1wkd s LYS 55 Cb -0.06 -2.13 0.65 0.00 -0.52 0.00 0.00 37.83 35.78 1wkd s LYS 55 CO 0.00 -0.32 1.96 -1.35 -0.92 0.00 0.00 175.35 174.72 1wkd h PRO 56 N 1.02 0.84 -0.37 -1.68 0.11 -1.86 0.39 132.00 130.44 1wkd h PRO 56 Ca -0.47 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1wkd h PRO 56 Cb 1.19 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1wkd h PRO 56 CO 0.61 0.55 0.16 1.05 -0.21 0.00 0.00 178.00 180.16 1wkd h GLU 57 N 0.86 0.52 -0.16 1.05 4.11 -1.92 -0.52 114.58 118.52 1wkd h GLU 57 Ca 0.32 -0.06 -0.14 0.00 0.07 0.00 0.00 59.36 59.55 1wkd h GLU 57 Cb 0.15 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1wkd h GLU 57 CO -0.10 0.42 -0.49 1.15 0.07 0.00 0.00 179.01 180.05 1wkd h THR 58 N 0.52 1.33 -0.42 -1.06 2.02 -1.31 -0.12 112.91 113.88 1wkd h THR 58 Ca 0.13 -1.72 -0.13 0.00 0.77 0.00 0.00 66.41 65.46 1wkd h THR 58 Cb 0.08 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 1wkd h THR 58 CO -0.02 0.53 -0.25 0.58 0.37 0.00 0.00 175.52 176.73 1wkd h VAL 59 N 0.35 1.28 -0.29 3.16 2.07 -0.79 -2.77 116.25 119.25 1wkd h VAL 59 Ca 0.02 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 66.01 1wkd h VAL 59 Cb 0.99 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 1wkd h VAL 59 CO 0.09 0.47 -0.31 -0.09 0.02 0.00 0.00 177.57 177.75 1wkd h ARG 60 N 0.73 0.61 -0.64 1.57 9.65 -0.83 -3.03 114.38 122.45 1wkd h ARG 60 Ca 0.09 -0.27 -0.02 0.00 -1.10 0.00 0.00 59.98 58.68 1wkd h ARG 60 Cb 0.82 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.36 1wkd h ARG 60 CO 0.07 0.85 0.33 0.00 2.80 0.00 0.00 179.97 184.02 1wkd h ALA 61 N 1.14 1.39 0.00 2.80 0.00 -0.85 -1.20 119.26 122.54 1wkd h ALA 61 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wkd h ALA 61 Cb 0.80 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wkd h ALA 61 CO 0.07 0.49 0.00 0.25 0.00 0.00 0.00 179.25 180.06 1wkd n THR 62 N -4.37 0.97 0.00 0.00 -2.24 -1.06 -4.84 114.28 102.75 1wkd n THR 62 Ca 0.06 0.28 0.00 0.00 -2.27 0.00 0.00 64.05 62.12 1wkd n THR 62 Cb 0.11 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.19 1wkd n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wkd n GLY 63 N -0.16 0.81 3.73 3.38 0.00 -0.45 -4.69 105.19 107.81 1wkd n GLY 63 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1wkd n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wkd s ALA 64 N -2.00 3.76 -0.23 4.61 0.00 -1.18 -4.91 121.76 121.81 1wkd s ALA 64 Ca 0.00 1.45 0.19 0.00 0.00 0.00 0.00 51.96 53.61 1wkd s ALA 64 Cb 0.00 -3.62 -0.27 0.00 0.00 0.00 0.00 23.12 19.22 1wkd s ALA 64 CO 0.00 -0.85 0.51 -0.25 0.00 0.00 0.00 175.76 175.16 1wkd n ASP 65 N 3.02 0.69 -3.66 0.00 8.00 -1.26 -4.64 116.55 118.69 1wkd n ASP 65 Ca 0.11 -0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.25 1wkd n ASP 65 Cb 0.38 1.67 -0.06 0.00 -0.02 0.00 0.00 41.12 43.08 1wkd n ASP 65 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1wkd s ILE 66 N -3.19 0.05 0.24 0.53 2.07 -1.26 -4.23 121.20 115.41 1wkd s ILE 66 Ca -0.04 -0.43 0.04 0.00 -1.41 0.00 0.00 60.65 58.82 1wkd s ILE 66 Cb 0.13 -0.92 -0.05 0.00 0.13 0.00 0.00 42.46 41.74 1wkd s ILE 66 CO 0.79 -0.24 -0.02 0.27 -1.91 0.00 0.00 174.94 173.83 1wkd s ILE 67 N -2.32 1.20 -0.11 2.00 -4.36 -1.21 -3.94 121.20 112.46 1wkd s ILE 67 Ca -0.06 -2.06 -0.02 0.00 -0.26 0.00 0.00 60.65 58.25 1wkd s ILE 67 Cb -0.01 -2.35 -0.03 0.00 1.25 0.00 0.00 42.46 41.32 1wkd s ILE 67 CO -0.01 -0.34 -0.02 -0.22 0.24 0.00 0.00 174.94 174.59 1wkd s LEU 68 N -3.33 3.39 0.10 0.37 0.20 0.17 -1.65 118.68 117.94 1wkd s LEU 68 Ca 0.28 0.02 0.06 0.00 0.69 0.00 0.00 54.13 55.18 1wkd s LEU 68 Cb 0.05 -1.79 -0.04 0.00 -0.43 0.00 0.00 46.19 43.99 1wkd s LEU 68 CO 0.09 0.30 -0.05 -0.83 -0.29 0.00 0.00 176.35 175.57 1wkd s GLY 69 N -0.41 1.85 -0.21 7.98 0.00 0.83 -0.06 107.32 117.31 1wkd s GLY 69 Ca 0.07 -1.20 -0.13 0.00 0.00 0.00 0.00 44.72 43.46 1wkd s GLY 69 CO 0.02 -1.18 0.26 -1.31 0.00 0.00 0.00 173.10 170.89 1wkd s ASN 70 N -2.30 6.30 0.06 1.64 0.02 -1.24 -1.22 114.94 118.20 1wkd s ASN 70 Ca 0.24 0.34 0.10 0.00 -1.02 0.00 0.00 52.86 52.52 1wkd s ASN 70 Cb -0.11 -2.16 -0.20 0.00 0.02 0.00 0.00 41.25 38.80 1wkd s ASN 70 CO 0.16 0.04 1.02 0.74 0.02 0.00 0.00 177.10 179.08 1wkd h THR 71 N 4.92 1.25 0.00 1.60 2.02 -1.87 -2.89 112.91 117.93 1wkd h THR 71 Ca -0.38 -2.99 0.00 0.00 0.77 0.00 0.00 66.41 63.81 1wkd h THR 71 Cb 1.16 2.61 0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1wkd h THR 71 CO 0.71 0.71 0.00 0.00 0.37 0.00 0.00 175.52 177.31 1wkd n TYR 72 N -3.20 0.00 -0.25 3.16 9.36 -1.26 -2.48 117.16 122.49 1wkd n TYR 72 Ca -0.07 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.08 1wkd n TYR 72 Cb 0.97 -0.46 -0.06 0.00 -0.63 0.00 0.00 39.34 39.15 1wkd n TYR 72 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1wkd n HIS 73 N -1.89 -0.26 0.18 2.98 8.25 -1.26 -0.98 115.22 122.24 1wkd n HIS 73 Ca 0.00 0.74 0.14 0.00 -0.26 0.00 0.00 57.72 58.34 1wkd n HIS 73 Cb 0.00 -0.53 0.72 0.00 1.12 0.00 0.00 29.99 31.30 1wkd n HIS 73 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1wkd h LEU 74 N 0.00 0.00 -0.85 2.41 3.38 -1.61 -1.63 115.31 117.01 1wkd h LEU 74 Ca 0.09 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1wkd h LEU 74 Cb 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1wkd h LEU 74 CO -0.56 0.00 -0.53 -0.03 0.09 0.00 0.00 178.44 177.41 1wkd h MET 75 N 0.00 0.00 0.14 1.13 1.85 -0.74 0.53 114.93 117.84 1wkd h MET 75 Ca 0.08 0.00 -0.29 0.00 -0.61 0.00 0.00 59.70 58.89 1wkd h MET 75 Cb 0.37 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.40 1wkd h MET 75 CO -0.00 0.53 -1.43 -0.07 -0.40 0.00 0.00 176.91 175.54 1wkd h LEU 76 N 0.00 0.48 -7.31 3.39 3.38 -0.98 -3.34 115.31 110.93 1wkd h LEU 76 Ca -0.01 -0.89 -0.25 0.00 0.09 0.00 0.00 57.88 56.82 1wkd h LEU 76 Cb 1.01 -0.16 -0.33 0.00 0.09 0.00 0.00 40.66 41.27 1wkd h LEU 76 CO 0.07 1.64 -0.59 0.00 0.09 0.00 0.00 178.44 179.65 1wkd s ARG 77 N -2.50 0.09 0.00 1.13 1.70 -0.74 -4.37 118.95 114.26 1wkd s ARG 77 Ca -0.18 0.53 0.23 0.00 -0.47 0.00 0.00 55.73 55.85 1wkd s ARG 77 Cb 0.04 -0.18 0.64 0.00 -0.57 0.00 0.00 34.95 34.88 1wkd s ARG 77 CO 0.81 -0.24 1.50 -0.35 -1.08 0.00 0.00 175.30 175.94 1wkd n PRO 78 N 4.84 2.00 0.00 3.89 -0.04 -1.18 -3.81 135.00 140.69 1wkd n PRO 78 Ca -0.14 -1.49 0.00 0.00 -0.04 0.00 0.00 63.50 61.83 1wkd n PRO 78 Cb 0.51 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1wkd n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wkd n GLY 79 N 1.26 2.36 0.19 0.55 0.00 0.17 -4.57 105.19 105.15 1wkd n GLY 79 Ca 0.17 -1.43 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 1wkd n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wkd h ALA 80 N 0.00 -0.02 -0.62 4.61 0.00 -1.73 -1.14 119.26 120.36 1wkd h ALA 80 Ca 0.00 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wkd h ALA 80 Cb 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1wkd h ALA 80 CO 0.00 -0.58 0.40 0.93 0.00 0.00 0.00 179.25 180.00 1wkd h GLU 81 N -0.16 0.79 -0.16 0.00 3.07 -1.93 -1.58 114.58 114.62 1wkd h GLU 81 Ca 0.11 -0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.96 1wkd h GLU 81 Cb 0.32 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 1wkd h GLU 81 CO -0.27 0.52 -0.05 -0.09 -1.40 0.00 0.00 179.01 177.72 1wkd h ARG 82 N 0.82 -0.02 -0.64 2.33 2.43 -1.53 -1.39 114.38 116.38 1wkd h ARG 82 Ca 0.23 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.43 1wkd h ARG 82 Cb -0.06 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 1wkd h ARG 82 CO -0.06 -0.01 0.40 0.82 -1.51 0.00 0.00 179.97 179.60 1wkd h ILE 83 N -0.02 1.10 -0.21 1.20 2.04 -0.90 -1.22 117.51 119.50 1wkd h ILE 83 Ca 0.08 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 65.71 1wkd h ILE 83 Cb 0.14 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 1wkd h ILE 83 CO -0.18 0.15 -0.04 0.00 0.00 0.00 0.00 178.15 178.07 1wkd h ALA 84 N 1.26 0.15 -0.69 1.87 0.00 -0.89 0.16 119.26 121.11 1wkd h ALA 84 Ca 0.25 0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.32 1wkd h ALA 84 Cb -0.02 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1wkd h ALA 84 CO -0.09 -0.47 0.46 -0.22 0.00 0.00 0.00 179.25 178.93 1wkd h LYS 85 N 0.01 0.61 0.00 0.00 3.64 -0.60 0.28 116.57 120.52 1wkd h LYS 85 Ca 0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1wkd h LYS 85 Cb 0.15 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1wkd h LYS 85 CO -0.21 0.40 0.00 1.28 -2.27 0.00 0.00 179.45 178.65 1wkd n LEU 86 N -4.48 0.59 0.00 5.20 4.32 -0.45 -4.91 117.00 117.26 1wkd n LEU 86 Ca 0.11 0.56 0.00 0.00 -0.02 0.00 0.00 56.01 56.66 1wkd n LEU 86 Cb 0.30 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 41.72 1wkd n LEU 86 CO 0.33 -0.15 0.00 0.61 -1.22 0.00 0.00 177.39 176.96 1wkd n GLY 87 N 1.29 1.17 0.00 -0.72 0.00 0.09 -4.80 105.19 102.22 1wkd n GLY 87 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1wkd n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wkd n GLY 88 N 0.00 1.88 0.17 -0.02 0.00 0.38 -4.45 105.19 103.15 1wkd n GLY 88 Ca 0.00 -1.81 -0.05 0.00 0.00 0.00 0.00 46.02 44.17 1wkd n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wkd h LEU 89 N 0.00 -0.06 -0.14 0.99 5.85 -1.44 -0.22 115.31 120.28 1wkd h LEU 89 Ca 0.00 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.84 1wkd h LEU 89 Cb 0.00 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 1wkd h LEU 89 CO 0.00 0.00 -0.43 0.45 -0.34 0.00 0.00 178.44 178.12 1wkd h HIS 90 N 0.16 -1.24 -0.74 1.25 3.86 -1.77 0.15 115.15 116.82 1wkd h HIS 90 Ca 0.19 0.05 -0.06 0.00 -1.16 0.00 0.00 60.37 59.40 1wkd h HIS 90 Cb 0.25 0.56 -0.03 0.00 1.06 0.00 0.00 27.41 29.25 1wkd h HIS 90 CO -0.23 -0.48 0.24 1.03 0.86 0.00 0.00 177.93 179.36 1wkd h SER 91 N -0.49 1.05 -0.05 2.45 0.87 -1.74 0.21 113.55 115.85 1wkd h SER 91 Ca 0.07 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1wkd h SER 91 Cb 0.63 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1wkd h SER 91 CO -0.41 0.97 0.03 0.15 -0.53 0.00 0.00 176.83 177.04 1wkd h PHE 92 N 1.09 0.06 0.00 2.24 3.57 -0.12 -3.21 116.94 120.57 1wkd h PHE 92 Ca 0.24 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1wkd h PHE 92 Cb 0.28 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1wkd h PHE 92 CO 0.02 0.06 -0.90 0.00 -2.23 0.00 0.00 178.31 175.26 1wkd n MET 93 N -5.05 0.30 -1.35 1.11 0.00 0.43 -4.98 117.12 107.58 1wkd n MET 93 Ca -0.06 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.67 1wkd n MET 93 Cb 0.04 -1.63 0.00 0.00 0.00 0.00 0.00 33.22 31.63 1wkd n MET 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1wkd n GLY 94 N 1.35 0.88 3.15 3.17 0.00 0.62 -4.76 105.19 109.60 1wkd n GLY 94 Ca 0.02 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 1wkd n GLY 94 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1wkd s TRP 95 N -2.00 3.11 -2.82 1.61 -0.11 -0.54 -4.70 118.94 113.50 1wkd s TRP 95 Ca 0.00 -1.81 0.25 0.00 1.22 0.00 0.00 56.10 55.75 1wkd s TRP 95 Cb 0.00 -2.02 0.40 0.00 -1.50 0.00 0.00 33.47 30.35 1wkd s TRP 95 CO 0.00 -0.79 1.38 -0.40 -4.62 0.00 0.00 176.95 172.52 1wkd n ASP 96 N 4.59 2.73 -4.84 5.86 5.68 -1.26 -4.44 116.55 124.88 1wkd n ASP 96 Ca -0.16 -1.90 -0.22 0.00 -0.50 0.00 0.00 54.79 52.02 1wkd n ASP 96 Cb 0.45 -0.04 0.10 0.00 -1.14 0.00 0.00 41.12 40.49 1wkd n ASP 96 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1wkd s ARG 97 N -1.93 1.87 0.77 0.11 0.52 -1.26 -4.89 118.95 114.14 1wkd s ARG 97 Ca 0.31 -1.49 -0.15 0.00 -0.52 0.00 0.00 55.73 53.89 1wkd s ARG 97 Cb 0.20 -2.48 0.04 0.00 0.52 0.00 0.00 34.95 33.23 1wkd s ARG 97 CO 0.31 -1.26 1.01 -0.35 0.02 0.00 0.00 175.30 175.02 1wkd n PRO 98 N -2.60 0.31 -4.05 3.54 -0.04 -1.26 -4.95 135.00 125.95 1wkd n PRO 98 Ca 0.17 0.17 -0.17 0.00 -0.04 0.00 0.00 63.50 63.63 1wkd n PRO 98 Cb 0.61 -2.27 -0.16 0.00 -0.04 0.00 0.00 33.50 31.65 1wkd n PRO 98 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1wkd s ILE 99 N -1.99 0.31 -0.11 0.52 1.01 -1.26 -3.34 121.20 116.34 1wkd s ILE 99 Ca 0.72 -0.06 -0.03 0.00 0.00 0.00 0.00 60.65 61.28 1wkd s ILE 99 Cb -0.31 -0.34 -0.03 0.00 0.01 0.00 0.00 42.46 41.79 1wkd s ILE 99 CO 0.52 0.14 -0.02 -0.22 0.00 0.00 0.00 174.94 175.37 1wkd s LEU 100 N 0.57 3.44 -0.08 2.97 0.20 -0.66 -1.48 118.68 123.63 1wkd s LEU 100 Ca -0.06 0.03 0.04 0.00 0.69 0.00 0.00 54.13 54.83 1wkd s LEU 100 Cb -0.09 -1.80 -0.01 0.00 -0.43 0.00 0.00 46.19 43.86 1wkd s LEU 100 CO -0.01 0.29 -0.22 0.42 -0.29 0.00 0.00 176.35 176.55 1wkd s THR 101 N -0.36 2.32 0.78 3.68 -4.23 -0.78 -0.12 115.64 116.93 1wkd s THR 101 Ca 0.07 -0.95 -0.12 0.00 -1.18 0.00 0.00 61.69 59.51 1wkd s THR 101 Cb -0.12 -1.89 0.07 0.00 1.34 0.00 0.00 72.50 71.90 1wkd s THR 101 CO 0.02 0.56 1.13 0.00 -0.54 0.00 0.00 174.62 175.79 1wkd s ALA 102 N 0.03 2.07 -0.00 3.99 0.00 -0.35 -3.17 121.76 124.32 1wkd s ALA 102 Ca -0.08 0.49 0.22 0.00 0.00 0.00 0.00 51.96 52.59 1wkd s ALA 102 Cb -0.15 -3.36 0.68 0.00 0.00 0.00 0.00 23.12 20.29 1wkd s ALA 102 CO 0.05 -1.96 1.72 0.66 0.00 0.00 0.00 175.76 176.24 1wkd h SER 103 N -1.00 0.00 0.00 0.00 4.64 -1.85 -3.26 113.55 112.08 1wkd h SER 103 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1wkd h SER 103 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1wkd h SER 103 CO 0.49 0.25 0.00 0.61 -0.87 0.00 0.00 176.83 177.31 1wkd n GLY 104 N 0.50 3.31 0.36 -0.77 0.00 -1.26 -4.73 105.19 102.61 1wkd n GLY 104 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1wkd n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wkd h GLY 105 N 0.00 1.63 0.77 -0.02 0.00 -1.91 -1.41 103.07 102.13 1wkd h GLY 105 Ca 0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1wkd h GLY 105 CO 0.00 0.15 -0.09 -1.82 0.00 0.00 0.00 176.54 174.78 1wkd h TYR 106 N 0.97 0.41 0.00 5.60 3.20 -1.92 -3.00 116.97 122.24 1wkd h TYR 106 Ca 0.50 -0.11 -0.09 0.00 3.14 0.00 0.00 58.73 62.18 1wkd h TYR 106 Cb 0.52 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1wkd h TYR 106 CO -0.00 0.68 -0.42 1.96 -1.64 0.00 0.00 178.16 178.74 1wkd h GLN 107 N 0.03 0.00 0.42 1.82 7.50 -1.93 -2.75 115.11 120.20 1wkd h GLN 107 Ca 0.04 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.17 1wkd h GLN 107 Cb 0.58 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.10 1wkd h GLN 107 CO 0.03 0.42 -0.24 0.28 -1.50 0.00 0.00 178.83 177.82 1wkd h VAL 108 N 0.00 0.51 0.00 -0.54 2.07 -1.23 0.32 116.25 117.38 1wkd h VAL 108 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1wkd h VAL 108 Cb 0.79 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1wkd h VAL 108 CO 0.05 0.00 0.00 0.80 0.02 0.00 0.00 177.57 178.44 1wkd n MET 109 N -5.37 0.06 -0.03 1.57 0.00 -1.14 -1.06 117.12 111.15 1wkd n MET 109 Ca -0.11 0.43 -0.01 0.00 -0.00 0.00 0.00 57.70 58.01 1wkd n MET 109 Cb 0.27 -1.65 -0.07 0.00 0.00 0.00 0.00 33.22 31.78 1wkd n MET 109 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1wkd n SER 110 N -1.77 2.97 -0.01 6.12 7.64 -0.85 -4.76 113.62 122.95 1wkd n SER 110 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1wkd n SER 110 Cb 0.10 0.92 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 1wkd n SER 110 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1wkd n LEU 111 N -2.15 0.59 -4.87 -3.43 4.77 0.11 -5.05 117.00 106.96 1wkd n LEU 111 Ca -0.10 -0.79 -0.33 0.00 -0.03 0.00 0.00 56.01 54.76 1wkd n LEU 111 Cb 0.61 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.64 1wkd n LEU 111 CO 0.18 0.15 0.16 -0.44 -1.33 0.00 0.00 177.39 176.11 1wkd s SER 112 N -0.45 6.65 0.23 -1.43 0.01 -0.23 -4.17 113.70 114.32 1wkd s SER 112 Ca 0.00 0.87 -0.11 0.00 1.31 0.00 0.00 55.95 58.03 1wkd s SER 112 Cb 0.00 -2.21 -0.07 0.00 0.21 0.00 0.00 66.02 63.95 1wkd s SER 112 CO 0.01 0.03 0.57 -0.55 0.41 0.00 0.00 173.24 173.71 1wkd s SER 113 N -2.12 6.66 -0.83 2.44 0.15 -0.37 -4.54 113.70 115.08 1wkd s SER 113 Ca 0.42 0.97 -0.10 0.00 0.70 0.00 0.00 55.95 57.93 1wkd s SER 113 Cb -0.13 -2.25 0.01 0.00 -1.71 0.00 0.00 66.02 61.95 1wkd s SER 113 CO 0.21 -0.07 0.54 0.18 1.20 0.00 0.00 173.24 175.29 1wkd n LEU 114 N -0.08 -1.05 -4.77 3.45 4.77 -1.26 -1.10 117.00 116.96 1wkd n LEU 114 Ca 0.00 -0.95 -0.39 0.00 -0.03 0.00 0.00 56.01 54.64 1wkd n LEU 114 Cb 0.52 -1.37 -0.03 0.00 -2.33 0.00 0.00 43.42 40.21 1wkd n LEU 114 CO 0.45 0.48 0.81 0.28 -1.33 0.00 0.00 177.39 178.08 1wkd s THR 115 N -3.15 3.37 -0.25 -5.08 -1.32 -1.26 -4.35 115.64 103.61 1wkd s THR 115 Ca 0.14 1.27 0.01 0.00 -1.21 0.00 0.00 61.69 61.90 1wkd s THR 115 Cb -0.08 -3.76 0.07 0.00 -1.51 0.00 0.00 72.50 67.21 1wkd s THR 115 CO 0.80 0.22 -0.02 -0.75 -2.21 0.00 0.00 174.62 172.66 1wkd s LYS 116 N -1.85 1.43 0.15 7.08 2.20 0.24 -4.96 119.74 124.03 1wkd s LYS 116 Ca 0.50 -1.04 -0.19 0.00 -0.36 0.00 0.00 55.97 54.88 1wkd s LYS 116 Cb -0.31 -2.54 -0.07 0.00 -1.51 0.00 0.00 37.83 33.40 1wkd s LYS 116 CO 0.39 -0.68 0.64 -0.65 -0.36 0.00 0.00 175.35 174.70 1wkd s GLN 117 N 1.41 4.23 0.20 4.03 -1.52 -1.26 -1.11 119.66 125.64 1wkd s GLN 117 Ca -0.02 0.79 -0.23 0.00 -1.95 0.00 0.00 55.36 53.95 1wkd s GLN 117 Cb -0.19 -3.07 0.05 0.00 -0.22 0.00 0.00 33.01 29.58 1wkd s GLN 117 CO -0.09 0.52 0.78 -1.54 -0.25 0.00 0.00 175.29 174.71 1wkd s SER 118 N -1.41 -0.31 0.47 5.90 1.04 -0.40 -5.00 113.70 113.99 1wkd s SER 118 Ca 0.36 -0.39 0.19 0.00 0.48 0.00 0.00 55.95 56.60 1wkd s SER 118 Cb -0.18 0.61 1.15 0.00 0.10 0.00 0.00 66.02 67.70 1wkd s SER 118 CO 0.21 -1.10 2.01 -0.08 0.98 0.00 0.00 173.24 175.26 1wkd h GLU 119 N 2.00 0.00 0.00 4.02 4.57 -2.02 -2.52 114.58 120.63 1wkd h GLU 119 Ca -0.23 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.81 1wkd h GLU 119 Cb 1.26 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 1wkd h GLU 119 CO 0.27 0.18 -0.66 1.49 -1.18 0.00 0.00 179.01 179.11 1wkd h GLU 120 N 0.00 0.00 0.00 1.92 4.81 -1.98 -3.50 114.58 115.84 1wkd h GLU 120 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1wkd h GLU 120 Cb 0.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1wkd h GLU 120 CO 0.02 0.66 0.00 0.41 -0.73 0.00 0.00 179.01 179.37 1wkd n GLY 121 N 0.91 -0.46 3.04 1.92 0.00 -0.95 -4.49 105.19 105.15 1wkd n GLY 121 Ca 0.00 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 1wkd n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wkd s VAL 122 N -3.97 0.80 -0.03 1.61 0.11 0.52 -1.28 120.40 118.16 1wkd s VAL 122 Ca 0.00 -0.43 0.03 0.00 -2.93 0.00 0.00 61.98 58.65 1wkd s VAL 122 Cb 0.00 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 1wkd s VAL 122 CO 0.00 0.23 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.02 1wkd s THR 123 N -0.24 3.52 0.29 5.04 2.01 -0.27 -0.99 115.64 125.01 1wkd s THR 123 Ca 0.04 -0.69 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 1wkd s THR 123 Cb -0.04 -2.47 0.02 0.00 0.01 0.00 0.00 72.50 70.01 1wkd s THR 123 CO -0.00 0.49 0.63 0.72 -0.69 0.00 0.00 174.62 175.77 1wkd s PHE 124 N -0.89 0.15 -0.18 4.92 -0.71 -0.31 0.83 117.98 121.80 1wkd s PHE 124 Ca 0.14 -0.60 -0.02 0.00 -1.04 0.00 0.00 56.93 55.42 1wkd s PHE 124 Cb -0.11 0.50 -0.01 0.00 -1.21 0.00 0.00 43.02 42.19 1wkd s PHE 124 CO 0.04 -1.21 -0.09 0.15 -1.34 0.00 0.00 175.22 172.77 1wkd s LYS 125 N -3.59 3.36 0.28 1.99 1.02 -0.26 -3.91 119.74 118.63 1wkd s LYS 125 Ca 0.17 -0.66 -0.30 0.00 0.02 0.00 0.00 55.97 55.20 1wkd s LYS 125 Cb -0.04 -2.81 -0.13 0.00 -0.52 0.00 0.00 37.83 34.34 1wkd s LYS 125 CO 0.10 -0.01 1.43 0.45 -0.92 0.00 0.00 175.35 176.40 1wkd n SER 126 N 4.19 3.05 -0.52 2.83 2.88 -1.24 -1.23 113.62 123.58 1wkd n SER 126 Ca -0.18 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 1wkd n SER 126 Cb 0.52 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1wkd n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wkd n HIS 127 N 1.55 0.00 -0.34 0.66 1.44 -1.26 -3.91 115.22 113.36 1wkd n HIS 127 Ca 0.09 -0.01 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 1wkd n HIS 127 Cb 0.34 -0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.37 1wkd n HIS 127 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1wkd n LEU 128 N 0.14 0.00 -2.69 2.39 -0.00 -1.26 -5.06 117.00 110.52 1wkd n LEU 128 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 55.97 1wkd n LEU 128 Cb 0.20 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 43.66 1wkd n LEU 128 CO 0.00 0.00 0.46 -0.67 -0.00 0.00 0.00 177.39 177.18 1wkd n ASP 129 N 0.00 -1.75 0.00 1.45 2.03 -1.25 -5.10 116.55 111.93 1wkd n ASP 129 Ca 0.00 -1.69 0.00 0.00 0.52 0.00 0.00 54.79 53.62 1wkd n ASP 129 Cb 0.00 0.94 0.00 0.00 -0.72 0.00 0.00 41.12 41.34 1wkd n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wkd n GLY 130 N 2.15 1.67 2.69 0.27 0.00 -1.26 -4.70 105.19 106.00 1wkd n GLY 130 Ca 0.08 -0.73 -0.05 0.00 0.00 0.00 0.00 46.02 45.32 1wkd n GLY 130 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wkd n SER 131 N 5.38 -1.73 -4.55 1.61 2.88 -1.26 -3.61 113.62 112.34 1wkd n SER 131 Ca 0.00 -2.24 -0.28 0.00 -1.33 0.00 0.00 58.87 55.03 1wkd n SER 131 Cb 0.00 1.08 -0.06 0.00 -0.75 0.00 0.00 64.21 64.48 1wkd n SER 131 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1wkd n ARG 132 N 1.41 0.79 -0.03 -1.46 3.00 -1.26 -4.51 116.66 114.60 1wkd n ARG 132 Ca 0.03 -0.32 -0.12 0.00 -0.01 0.00 0.00 57.85 57.43 1wkd n ARG 132 Cb 0.69 -3.39 0.00 0.00 0.00 0.00 0.00 32.46 29.77 1wkd n ARG 132 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.63 178.75 1wkd h HIS 133 N 16.56 0.89 -3.67 -1.55 2.07 -1.97 -3.40 115.15 124.08 1wkd h HIS 133 Ca -0.14 -0.33 -0.68 0.00 -2.85 0.00 0.00 60.37 56.38 1wkd h HIS 133 Cb 1.17 -0.16 -0.28 0.00 2.57 0.00 0.00 27.41 30.71 1wkd h HIS 133 CO 1.05 1.11 -0.81 1.41 -3.07 0.00 0.00 177.93 177.62 1wkd s MET 134 N -4.00 2.92 -0.04 5.12 1.75 -1.26 -1.16 119.30 122.63 1wkd s MET 134 Ca -0.09 -0.77 -0.01 0.00 -1.25 0.00 0.00 55.69 53.57 1wkd s MET 134 Cb 0.11 -2.40 0.03 0.00 2.84 0.00 0.00 34.83 35.40 1wkd s MET 134 CO 0.87 0.35 0.02 -1.17 -0.65 0.00 0.00 175.02 174.43 1wkd s LEU 135 N -0.03 0.70 0.14 4.11 2.96 -0.16 -4.98 118.68 121.42 1wkd s LEU 135 Ca -0.05 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 1wkd s LEU 135 Cb -0.14 -0.25 -0.04 0.00 0.50 0.00 0.00 46.19 46.25 1wkd s LEU 135 CO 0.04 -0.17 0.01 -0.94 -1.32 0.00 0.00 176.35 173.98 1wkd s SER 136 N 1.62 0.77 0.19 3.68 1.04 -1.26 -0.35 113.70 119.39 1wkd s SER 136 Ca -0.01 -1.16 -0.20 0.00 0.48 0.00 0.00 55.95 55.06 1wkd s SER 136 Cb -0.13 0.20 0.14 0.00 0.10 0.00 0.00 66.02 66.33 1wkd s SER 136 CO -0.03 -0.63 1.59 -0.65 0.98 0.00 0.00 173.24 174.50 1wkd h PRO 137 N 2.83 -0.14 0.00 4.02 0.11 -1.90 0.31 132.00 137.23 1wkd h PRO 137 Ca -0.36 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.69 1wkd h PRO 137 Cb 1.19 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1wkd h PRO 137 CO 0.62 -0.09 -0.37 1.05 -0.21 0.00 0.00 178.00 178.99 1wkd h GLU 138 N -0.15 0.00 -0.09 1.05 9.09 -1.93 -1.38 114.58 121.18 1wkd h GLU 138 Ca 0.24 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.45 1wkd h GLU 138 Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.65 1wkd h GLU 138 CO -0.70 0.37 -0.78 -0.09 0.05 0.00 0.00 179.01 177.87 1wkd h ARG 139 N 0.00 0.53 0.06 1.06 9.65 -1.33 -2.32 114.38 122.03 1wkd h ARG 139 Ca -0.00 -0.45 -0.00 0.00 -1.10 0.00 0.00 59.98 58.42 1wkd h ARG 139 Cb 0.67 0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1wkd h ARG 139 CO 0.05 1.08 -0.03 1.03 2.80 0.00 0.00 179.97 184.90 1wkd h SER 140 N 0.36 -0.07 -0.46 -3.80 0.87 -0.02 0.20 113.55 110.62 1wkd h SER 140 Ca -0.05 -0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.47 1wkd h SER 140 Cb 1.38 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.33 1wkd h SER 140 CO 0.14 0.01 0.30 0.40 -0.53 0.00 0.00 176.83 177.15 1wkd h ILE 141 N -0.15 1.11 0.27 2.23 1.08 -1.29 -0.80 117.51 119.97 1wkd h ILE 141 Ca -0.01 -0.21 -0.01 0.00 -0.39 0.00 0.00 64.86 64.24 1wkd h ILE 141 Cb 0.12 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 34.32 1wkd h ILE 141 CO 0.01 0.11 -0.13 -0.08 -0.69 0.00 0.00 178.15 177.37 1wkd h GLU 142 N 0.61 -0.35 -0.17 2.37 4.81 -1.00 -1.54 114.58 119.30 1wkd h GLU 142 Ca 0.17 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.48 1wkd h GLU 142 Cb -0.05 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.34 1wkd h GLU 142 CO -0.04 -0.02 -0.27 0.82 -0.73 0.00 0.00 179.01 178.77 1wkd h ILE 143 N -0.73 0.36 -0.31 2.32 2.04 -0.68 0.14 117.51 120.66 1wkd h ILE 143 Ca -0.04 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.91 1wkd h ILE 143 Cb 0.49 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1wkd h ILE 143 CO 0.06 0.00 0.25 1.56 0.00 0.00 0.00 178.15 180.02 1wkd h GLN 144 N -0.32 0.00 -0.09 2.37 4.20 -1.15 0.32 115.11 120.44 1wkd h GLN 144 Ca 0.11 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.65 1wkd h GLN 144 Cb 0.49 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.28 1wkd h GLN 144 CO -0.35 0.00 -0.62 1.25 -0.67 0.00 0.00 178.83 178.44 1wkd h HIS 145 N 0.00 0.81 -0.81 2.96 2.76 -0.00 -2.06 115.15 118.81 1wkd h HIS 145 Ca 0.15 -0.37 0.01 0.00 -2.20 0.00 0.00 60.37 57.95 1wkd h HIS 145 Cb 0.64 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 29.45 1wkd h HIS 145 CO 0.00 1.17 0.53 -0.07 -1.30 0.00 0.00 177.93 178.26 1wkd h LEU 146 N 0.21 0.95 -1.25 0.26 3.38 0.22 -1.06 115.31 118.03 1wkd h LEU 146 Ca -0.05 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 1wkd h LEU 146 Cb 1.27 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1wkd h LEU 146 CO 0.13 0.70 -0.31 -0.07 0.09 0.00 0.00 178.44 178.97 1wkd h LEU 147 N 1.11 0.10 -0.40 1.67 3.38 -1.19 -3.33 115.31 116.65 1wkd h LEU 147 Ca 0.30 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1wkd h LEU 147 Cb -0.11 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1wkd h LEU 147 CO -0.06 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.49 1wkd n GLY 148 N -0.54 0.83 3.79 0.83 0.00 -0.40 -1.29 105.19 108.41 1wkd n GLY 148 Ca -0.02 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 1wkd n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wkd s SER 149 N -2.80 6.22 0.04 1.61 1.04 -0.99 -4.88 113.70 113.94 1wkd s SER 149 Ca 0.00 2.03 -0.15 0.00 0.48 0.00 0.00 55.95 58.31 1wkd s SER 149 Cb 0.00 -2.57 -0.32 0.00 0.10 0.00 0.00 66.02 63.23 1wkd s SER 149 CO 0.00 -0.87 1.06 0.44 0.98 0.00 0.00 173.24 174.85 1wkd h ASP 150 N 1.60 0.84 -3.44 7.02 5.19 -1.62 -3.43 116.42 122.58 1wkd h ASP 150 Ca -0.49 -0.84 -0.67 0.00 -0.62 0.00 0.00 57.03 54.40 1wkd h ASP 150 Cb 1.23 -0.27 -0.33 0.00 0.18 0.00 0.00 39.33 40.14 1wkd h ASP 150 CO 0.59 1.65 -0.78 -0.63 -3.12 0.00 0.00 179.24 176.95 1wkd s ILE 151 N -2.78 2.63 -0.16 0.35 1.01 -0.96 0.54 121.20 121.83 1wkd s ILE 151 Ca -0.09 -1.04 -0.11 0.00 0.00 0.00 0.00 60.65 59.41 1wkd s ILE 151 Cb 0.05 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.17 1wkd s ILE 151 CO 0.94 0.27 0.20 -0.69 0.00 0.00 0.00 174.94 175.65 1wkd s VAL 152 N 1.30 5.38 -0.18 2.92 1.01 0.26 -1.87 120.40 129.22 1wkd s VAL 152 Ca 0.01 0.34 -0.11 0.00 0.00 0.00 0.00 61.98 62.21 1wkd s VAL 152 Cb -0.16 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1wkd s VAL 152 CO -0.06 0.47 0.20 -0.04 0.00 0.00 0.00 175.10 175.66 1wkd s MET 153 N 0.02 4.19 0.52 2.72 -1.94 -1.19 -1.02 119.30 122.59 1wkd s MET 153 Ca 0.13 -0.09 -0.23 0.00 -1.71 0.00 0.00 55.69 53.80 1wkd s MET 153 Cb -0.12 -3.41 -0.06 0.00 2.01 0.00 0.00 34.83 33.25 1wkd s MET 153 CO 0.02 0.29 1.34 0.00 -0.01 0.00 0.00 175.02 176.66 1wkd s ALA 154 N 0.35 2.91 0.03 3.03 0.00 -0.85 -4.41 121.76 122.82 1wkd s ALA 154 Ca 0.12 1.29 -0.29 0.00 0.00 0.00 0.00 51.96 53.07 1wkd s ALA 154 Cb -0.12 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 1wkd s ALA 154 CO 0.01 -1.22 0.95 0.12 0.00 0.00 0.00 175.76 175.61 1wkd s PHE 155 N -1.32 3.70 0.33 0.00 5.36 -1.26 -4.75 117.98 120.04 1wkd s PHE 155 Ca 0.68 1.69 0.06 0.00 -0.96 0.00 0.00 56.93 58.41 1wkd s PHE 155 Cb -0.39 -3.07 -0.03 0.00 -0.34 0.00 0.00 43.02 39.19 1wkd s PHE 155 CO 0.47 0.07 0.29 0.16 -1.46 0.00 0.00 175.22 174.75 1wkd s ASP 156 N 0.66 1.55 -0.35 6.13 -4.77 -1.26 -4.34 116.67 114.28 1wkd s ASP 156 Ca 0.49 -1.72 0.00 0.00 -3.30 0.00 0.00 52.55 48.02 1wkd s ASP 156 Cb -0.21 0.56 0.09 0.00 -1.09 0.00 0.00 42.92 42.27 1wkd s ASP 156 CO 0.28 -1.08 0.09 -0.70 0.70 0.00 0.00 175.17 174.46 1wkd s GLU 157 N -3.43 1.94 0.18 2.11 2.12 -1.26 -4.77 118.70 115.59 1wkd s GLU 157 Ca 0.40 -1.69 -0.30 0.00 0.36 0.00 0.00 54.97 53.73 1wkd s GLU 157 Cb 0.02 -3.33 -0.08 0.00 0.26 0.00 0.00 34.13 31.00 1wkd s GLU 157 CO 0.26 -0.90 1.27 0.00 -0.54 0.00 0.00 175.26 175.35 1wkd s THR 159 N 0.15 5.01 0.69 0.00 2.01 -1.26 -5.05 115.64 117.19 1wkd s THR 159 Ca 0.56 1.23 -0.14 0.00 0.31 0.00 0.00 61.69 63.65 1wkd s THR 159 Cb -0.35 -3.96 0.02 0.00 0.01 0.00 0.00 72.50 68.22 1wkd s THR 159 CO 0.37 0.12 1.11 -2.16 -0.69 0.00 0.00 174.62 173.37 1wkd s PRO 160 N 1.84 2.62 -0.16 4.92 0.04 -1.26 -4.90 135.00 138.10 1wkd s PRO 160 Ca 0.30 1.36 -0.03 0.00 0.04 0.00 0.00 61.00 62.67 1wkd s PRO 160 Cb -0.16 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1wkd s PRO 160 CO 0.11 -1.39 -0.06 -0.47 0.04 0.00 0.00 177.00 175.23 1wkd s TYR 161 N -2.45 2.95 0.77 0.56 5.04 -1.26 -3.26 117.35 119.70 1wkd s TYR 161 Ca 0.66 -0.53 -0.12 0.00 -2.44 0.00 0.00 57.07 54.64 1wkd s TYR 161 Cb -0.20 -1.97 0.05 0.00 0.35 0.00 0.00 41.96 40.20 1wkd s TYR 161 CO 0.45 -0.20 1.13 -2.14 -1.34 0.00 0.00 175.55 173.45 1wkd s PRO 162 N 0.63 2.33 -0.03 4.97 0.02 -1.26 -4.95 135.00 136.70 1wkd s PRO 162 Ca -0.04 0.35 -0.02 0.00 0.02 0.00 0.00 61.00 61.31 1wkd s PRO 162 Cb -0.15 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.42 1wkd s PRO 162 CO 0.03 -1.39 0.08 0.00 -0.33 0.00 0.00 177.00 175.38 1wkd s ALA 163 N -3.41 -0.12 0.54 -1.55 0.00 -1.20 -5.11 121.76 110.90 1wkd s ALA 163 Ca 0.60 0.34 -0.17 0.00 0.00 0.00 0.00 51.96 52.73 1wkd s ALA 163 Cb -0.12 -0.23 -0.07 0.00 0.00 0.00 0.00 23.12 22.71 1wkd s ALA 163 CO 0.51 -0.08 1.01 0.95 0.00 0.00 0.00 175.76 178.15 1wkd s THR 164 N 0.58 4.19 0.22 0.00 -4.23 -1.26 -4.76 115.64 110.39 1wkd s THR 164 Ca -0.05 1.10 -0.10 0.00 -1.18 0.00 0.00 61.69 61.46 1wkd s THR 164 Cb -0.06 -3.56 0.23 0.00 1.34 0.00 0.00 72.50 70.44 1wkd s THR 164 CO -0.02 -0.56 1.65 -0.65 -0.54 0.00 0.00 174.62 174.50 1wkd h PRO 165 N 0.87 0.08 -0.70 3.99 0.11 -2.00 0.30 132.00 134.64 1wkd h PRO 165 Ca -0.47 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 1wkd h PRO 165 Cb 1.20 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1wkd h PRO 165 CO 0.60 0.05 0.33 0.66 -0.21 0.00 0.00 178.00 179.43 1wkd h SER 166 N 0.08 0.93 0.11 -2.05 4.64 -1.98 0.32 113.55 115.60 1wkd h SER 166 Ca 0.34 -0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 1wkd h SER 166 Cb 0.56 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1wkd h SER 166 CO -0.60 0.81 -0.05 -0.09 -0.87 0.00 0.00 176.83 176.03 1wkd h ARG 167 N 0.98 -0.15 -0.85 4.77 2.43 -1.46 -0.14 114.38 119.96 1wkd h ARG 167 Ca 0.24 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1wkd h ARG 167 Cb 0.14 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 1wkd h ARG 167 CO -0.03 -0.05 0.45 0.00 -1.51 0.00 0.00 179.97 178.83 1wkd h ALA 168 N 0.68 1.19 0.09 2.80 0.00 -0.30 -1.99 119.26 121.74 1wkd h ALA 168 Ca -0.02 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1wkd h ALA 168 Cb 0.16 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1wkd h ALA 168 CO 0.03 0.64 -0.04 0.00 0.00 0.00 0.00 179.25 179.87 1wkd h ALA 169 N 1.30 -0.12 -0.41 0.00 0.00 0.02 -0.84 119.26 119.20 1wkd h ALA 169 Ca 0.30 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1wkd h ALA 169 Cb 0.05 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1wkd h ALA 169 CO -0.05 -0.49 0.04 0.77 0.00 0.00 0.00 179.25 179.53 1wkd h SER 170 N -0.29 0.59 -0.20 0.00 0.02 -0.88 0.32 113.55 113.11 1wkd h SER 170 Ca -0.01 -0.11 -0.16 0.00 -0.84 0.00 0.00 61.79 60.67 1wkd h SER 170 Cb 0.24 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1wkd h SER 170 CO 0.02 0.64 -0.50 -1.28 -1.14 0.00 0.00 176.83 174.57 1wkd h SER 171 N 0.61 0.78 -0.19 3.07 0.87 -1.29 -1.83 113.55 115.56 1wkd h SER 171 Ca 0.13 -0.57 -0.01 0.00 -1.23 0.00 0.00 61.79 60.11 1wkd h SER 171 Cb 0.32 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1wkd h SER 171 CO 0.01 1.21 0.09 -0.03 -0.53 0.00 0.00 176.83 177.58 1wkd h MET 172 N 0.39 0.29 -0.56 2.24 -1.53 -0.88 -1.93 114.93 112.94 1wkd h MET 172 Ca -0.01 -0.05 0.06 0.00 -3.44 0.00 0.00 59.70 56.27 1wkd h MET 172 Cb 1.11 -0.05 -0.05 0.00 -0.55 0.00 0.00 31.60 32.06 1wkd h MET 172 CO 0.11 0.33 0.27 0.93 0.14 0.00 0.00 176.91 178.69 1wkd h GLU 173 N 0.17 0.50 -0.04 0.39 5.08 -0.92 -0.55 114.58 119.21 1wkd h GLU 173 Ca 0.07 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1wkd h GLU 173 Cb 0.14 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1wkd h GLU 173 CO -0.01 0.33 -0.00 -0.09 -1.00 0.00 0.00 179.01 178.25 1wkd h ARG 174 N 0.52 0.01 -0.59 2.33 9.65 -1.20 -2.24 114.38 122.86 1wkd h ARG 174 Ca 0.26 -0.00 0.02 0.00 -1.10 0.00 0.00 59.98 59.15 1wkd h ARG 174 Cb 0.19 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 1wkd h ARG 174 CO -0.19 0.01 0.39 0.77 2.80 0.00 0.00 179.97 183.75 1wkd h SER 175 N 0.01 0.63 -0.38 -3.80 0.02 -0.81 0.32 113.55 109.54 1wkd h SER 175 Ca 0.02 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 1wkd h SER 175 Cb 0.02 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1wkd h SER 175 CO -0.03 0.45 -0.11 0.24 -1.14 0.00 0.00 176.83 176.24 1wkd h MET 176 N 0.74 0.83 -0.48 3.45 2.86 -0.70 0.41 114.93 122.04 1wkd h MET 176 Ca 0.23 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1wkd h MET 176 Cb 0.00 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1wkd h MET 176 CO -0.06 0.90 0.20 0.00 1.06 0.00 0.00 176.91 179.02 1wkd h ARG 177 N 0.75 0.70 0.00 1.72 3.08 -0.57 -1.31 114.38 118.75 1wkd h ARG 177 Ca 0.13 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1wkd h ARG 177 Cb 0.60 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1wkd h ARG 177 CO 0.04 0.62 -0.20 -1.49 -1.07 0.00 0.00 179.97 177.87 1wkd h TRP 178 N 0.63 0.00 -0.32 3.04 4.06 -0.59 -1.82 115.95 120.94 1wkd h TRP 178 Ca 0.16 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.00 1wkd h TRP 178 Cb 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 1wkd h TRP 178 CO -0.00 0.20 -0.25 0.00 -3.56 0.00 0.00 178.44 174.83 1wkd h ALA 179 N 1.80 0.46 -0.22 1.49 0.00 0.87 0.19 119.26 123.84 1wkd h ALA 179 Ca -0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1wkd h ALA 179 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1wkd h ALA 179 CO 0.03 0.45 0.13 -0.22 0.00 0.00 0.00 179.25 179.63 1wkd h LYS 180 N 0.49 0.31 -0.94 0.00 1.63 -0.65 -0.92 116.57 116.50 1wkd h LYS 180 Ca 0.06 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.83 1wkd h LYS 180 Cb 0.81 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 32.33 1wkd h LYS 180 CO 0.07 0.27 0.61 0.00 -3.45 0.00 0.00 179.45 176.95 1wkd h ARG 181 N 0.26 1.24 -0.63 1.90 3.08 -1.23 -0.39 114.38 118.61 1wkd h ARG 181 Ca 0.08 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1wkd h ARG 181 Cb 0.05 -0.28 -0.03 0.00 0.08 0.00 0.00 29.97 29.80 1wkd h ARG 181 CO -0.01 0.83 0.20 0.77 -1.07 0.00 0.00 179.97 180.69 1wkd h SER 182 N 1.27 0.91 -0.24 7.04 0.02 -0.70 -0.13 113.55 121.72 1wkd h SER 182 Ca 0.34 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1wkd h SER 182 Cb -0.13 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.16 1wkd h SER 182 CO -0.07 0.87 0.16 -0.09 -1.14 0.00 0.00 176.83 176.55 1wkd h ARG 183 N 0.90 0.31 0.03 3.45 9.65 -0.15 -0.49 114.38 128.09 1wkd h ARG 183 Ca 0.20 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1wkd h ARG 183 Cb 0.28 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 1wkd h ARG 183 CO -0.01 0.21 -0.02 -0.44 2.80 0.00 0.00 179.97 182.51 1wkd h ASP 184 N 0.32 -0.04 -0.12 -3.80 3.32 -0.90 -1.47 116.42 113.73 1wkd h ASP 184 Ca 0.09 -0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.03 1wkd h ASP 184 Cb -0.04 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.48 1wkd h ASP 184 CO -0.02 0.13 -0.15 0.00 -1.72 0.00 0.00 179.24 177.47 1wkd h ALA 185 N 0.77 -0.08 -0.46 3.45 0.00 -0.89 -0.97 119.26 121.07 1wkd h ALA 185 Ca -0.00 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1wkd h ALA 185 Cb 0.18 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 1wkd h ALA 185 CO 0.01 -0.61 0.04 0.35 0.00 0.00 0.00 179.25 179.03 1wkd h PHE 186 N -0.20 0.04 -0.17 0.00 3.57 -1.02 -2.39 116.94 116.78 1wkd h PHE 186 Ca 0.09 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1wkd h PHE 186 Cb 0.33 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1wkd h PHE 186 CO -0.27 -0.06 -0.17 -0.44 -2.23 0.00 0.00 178.31 175.14 1wkd h ASP 187 N 0.15 0.27 0.66 0.41 3.32 -0.54 -2.91 116.42 117.78 1wkd h ASP 187 Ca 0.23 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1wkd h ASP 187 Cb 0.32 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1wkd h ASP 187 CO -0.35 0.46 -0.07 0.77 -1.72 0.00 0.00 179.24 178.34 1wkd h SER 188 N 0.26 0.00 -3.10 6.45 4.64 -0.66 -3.37 113.55 117.77 1wkd h SER 188 Ca 0.05 0.00 -0.73 0.00 -0.47 0.00 0.00 61.79 60.64 1wkd h SER 188 Cb 0.47 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.34 1wkd h SER 188 CO 0.03 0.07 -0.11 -0.60 -0.87 0.00 0.00 176.83 175.35 1wkd s ARG 189 N -3.89 3.02 0.19 4.77 3.52 -1.10 -4.94 118.95 120.53 1wkd s ARG 189 Ca -0.01 -1.42 -0.12 0.00 -0.13 0.00 0.00 55.73 54.06 1wkd s ARG 189 Cb 0.11 -4.23 0.16 0.00 -1.56 0.00 0.00 34.95 29.43 1wkd s ARG 189 CO 0.55 -1.31 1.80 1.57 -0.81 0.00 0.00 175.30 177.09 1wkd h LYS 190 N 8.96 0.57 -0.80 5.12 2.10 -1.83 -0.59 116.57 130.10 1wkd h LYS 190 Ca -0.29 -0.03 0.09 0.00 -2.00 0.00 0.00 60.65 58.41 1wkd h LYS 190 Cb 1.10 -0.13 -0.07 0.00 -0.90 0.00 0.00 32.23 32.23 1wkd h LYS 190 CO 1.01 0.38 0.45 1.49 -2.00 0.00 0.00 179.45 180.79 1wkd h GLU 191 N 0.59 0.75 -0.02 0.07 4.81 -1.94 0.47 114.58 119.31 1wkd h GLU 191 Ca 0.24 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1wkd h GLU 191 Cb 0.12 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1wkd h GLU 191 CO -0.15 0.49 -0.02 0.37 -0.73 0.00 0.00 179.01 178.97 1wkd h GLN 192 N 0.77 0.05 0.00 1.92 4.15 -1.80 -2.74 115.11 117.46 1wkd h GLN 192 Ca 0.38 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.76 1wkd h GLN 192 Cb 0.34 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.03 1wkd h GLN 192 CO -0.24 0.54 -0.07 0.00 -1.93 0.00 0.00 178.83 177.13 1wkd h ALA 193 N 0.51 1.43 0.00 3.38 0.00 -0.70 0.42 119.26 124.29 1wkd h ALA 193 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1wkd h ALA 193 Cb 0.53 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1wkd h ALA 193 CO 0.01 0.08 -1.23 0.93 0.00 0.00 0.00 179.25 179.03 1wkd h GLU 194 N 0.00 0.00 0.00 0.00 5.08 -0.86 -3.40 114.58 115.40 1wkd h GLU 194 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wkd h GLU 194 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1wkd h GLU 194 CO 0.01 0.29 -1.02 0.09 -1.00 0.00 0.00 179.01 177.38 1wkd n ASN 195 N -2.92 2.72 -4.90 1.42 4.13 -1.04 -4.76 115.26 109.91 1wkd n ASN 195 Ca -0.07 -0.17 -0.25 0.00 1.68 0.00 0.00 54.58 55.78 1wkd n ASN 195 Cb 0.80 1.21 -0.01 0.00 -1.54 0.00 0.00 39.78 40.24 1wkd n ASN 195 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wkd s ALA 196 N -2.20 4.34 0.12 5.41 0.00 0.12 -4.77 121.76 124.77 1wkd s ALA 196 Ca -0.01 -1.49 0.09 0.00 0.00 0.00 0.00 51.96 50.54 1wkd s ALA 196 Cb 0.04 -0.82 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1wkd s ALA 196 CO 0.25 -0.43 -0.21 0.00 0.00 0.00 0.00 175.76 175.38 1wkd s ALA 197 N -2.70 1.93 -0.11 0.00 0.00 0.19 -4.81 121.76 116.26 1wkd s ALA 197 Ca 0.39 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 51.05 1wkd s ALA 197 Cb -0.02 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.85 1wkd s ALA 197 CO 0.24 0.36 -0.20 -1.17 0.00 0.00 0.00 175.76 174.98 1wkd s LEU 198 N -2.10 1.97 -0.07 0.00 2.96 -1.26 0.92 118.68 121.09 1wkd s LEU 198 Ca 0.10 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1wkd s LEU 198 Cb -0.09 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 1wkd s LEU 198 CO 0.05 0.09 -0.00 -0.36 -1.32 0.00 0.00 176.35 174.81 1wkd s PHE 199 N 0.67 3.14 0.22 5.38 0.40 -0.19 -0.40 117.98 127.21 1wkd s PHE 199 Ca -0.12 0.17 0.05 0.00 -0.60 0.00 0.00 56.93 56.43 1wkd s PHE 199 Cb -0.16 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.57 1wkd s PHE 199 CO 0.03 0.46 0.34 0.20 0.70 0.00 0.00 175.22 176.95 1wkd s GLY 200 N -0.98 1.31 -0.17 4.36 0.00 -0.30 -2.01 107.32 109.53 1wkd s GLY 200 Ca 0.14 -1.20 0.01 0.00 0.00 0.00 0.00 44.72 43.66 1wkd s GLY 200 CO 0.03 -1.22 -0.17 -0.42 0.00 0.00 0.00 173.10 171.33 1wkd s ILE 201 N -1.94 1.83 0.19 0.90 1.01 -1.26 -0.87 121.20 121.06 1wkd s ILE 201 Ca 0.34 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.86 1wkd s ILE 201 Cb -0.09 -1.70 -0.08 0.00 0.01 0.00 0.00 42.46 40.60 1wkd s ILE 201 CO 0.29 0.47 1.10 -1.58 0.00 0.00 0.00 174.94 175.21 1wkd s GLN 202 N 1.38 4.60 0.28 2.79 0.74 0.19 -4.83 119.66 124.81 1wkd s GLN 202 Ca 0.04 1.72 0.02 0.00 0.05 0.00 0.00 55.36 57.19 1wkd s GLN 202 Cb -0.13 -3.27 -0.01 0.00 1.10 0.00 0.00 33.01 30.70 1wkd s GLN 202 CO -0.12 0.10 0.06 1.04 -0.55 0.00 0.00 175.29 175.82 1wkd n GLN 203 N 2.23 0.91 0.00 1.67 1.13 -1.26 -1.42 117.38 120.64 1wkd n GLN 203 Ca 0.02 -2.25 0.00 0.00 -1.94 0.00 0.00 57.00 52.83 1wkd n GLN 203 Cb 0.46 0.97 0.00 0.00 0.11 0.00 0.00 30.24 31.78 1wkd n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1wkd n GLY 204 N 0.67 -0.18 7.00 1.08 0.00 -1.26 -3.93 105.19 108.57 1wkd n GLY 204 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1wkd n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wkd n SER 205 N 0.00 0.00 -1.15 1.61 2.88 -1.26 -2.41 113.62 113.30 1wkd n SER 205 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1wkd n SER 205 Cb 0.00 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 63.74 1wkd n SER 205 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1wkd n VAL 206 N 0.00 1.94 -3.52 2.46 0.24 -1.26 -4.93 118.33 113.26 1wkd n VAL 206 Ca 0.00 -1.44 -0.41 0.00 -2.04 0.00 0.00 64.34 60.44 1wkd n VAL 206 Cb 0.00 0.02 -0.10 0.00 -1.47 0.00 0.00 33.84 32.28 1wkd n VAL 206 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1wkd s PHE 207 N -2.15 3.23 0.45 6.34 0.08 -1.01 -4.98 117.98 119.94 1wkd s PHE 207 Ca 0.42 -0.49 0.11 0.00 0.12 0.00 0.00 56.93 57.09 1wkd s PHE 207 Cb 0.30 -2.51 1.00 0.00 -0.57 0.00 0.00 43.02 41.23 1wkd s PHE 207 CO 0.16 -0.50 2.06 1.05 -0.10 0.00 0.00 175.22 177.88 1wkd h GLU 208 N 8.54 0.26 -0.59 0.44 4.11 -1.92 -1.34 114.58 124.08 1wkd h GLU 208 Ca -0.29 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.10 1wkd h GLU 208 Cb 1.13 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1wkd h GLU 208 CO 0.68 0.22 0.32 -2.95 0.07 0.00 0.00 179.01 177.35 1wkd h ASN 209 N 0.26 0.74 -0.33 3.06 -1.07 -1.94 0.50 115.58 116.81 1wkd h ASN 209 Ca 0.07 -0.10 -0.01 0.00 0.07 0.00 0.00 56.30 56.32 1wkd h ASN 209 Cb 0.07 -0.19 -0.01 0.00 -2.07 0.00 0.00 38.32 36.11 1wkd h ASN 209 CO -0.01 0.63 0.15 -0.07 0.07 0.00 0.00 177.43 178.20 1wkd h LEU 210 N 0.80 0.44 -1.19 6.14 4.07 -1.60 -0.67 115.31 123.29 1wkd h LEU 210 Ca 0.21 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 57.99 1wkd h LEU 210 Cb 0.06 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1wkd h LEU 210 CO -0.03 0.45 0.10 0.03 -1.08 0.00 0.00 178.44 177.92 1wkd h ARG 211 N 0.39 0.67 -0.43 1.13 2.47 -0.78 0.11 114.38 117.94 1wkd h ARG 211 Ca 0.11 -0.12 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 1wkd h ARG 211 Cb 0.14 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1wkd h ARG 211 CO -0.01 0.61 -0.08 0.37 0.56 0.00 0.00 179.97 181.42 1wkd h GLN 212 N 0.65 0.81 -0.14 0.04 5.75 0.50 0.96 115.11 123.68 1wkd h GLN 212 Ca 0.15 -0.30 -0.00 0.00 -0.15 0.00 0.00 58.65 58.35 1wkd h GLN 212 Cb 0.25 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 1wkd h GLN 212 CO -0.00 0.92 0.08 1.96 -2.65 0.00 0.00 178.83 179.14 1wkd h GLN 213 N 0.63 0.19 -0.94 1.69 4.20 -0.57 -1.45 115.11 118.86 1wkd h GLN 213 Ca 0.11 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1wkd h GLN 213 Cb 0.60 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 1wkd h GLN 213 CO 0.04 0.17 0.59 1.03 -0.67 0.00 0.00 178.83 179.99 1wkd h SER 214 N 0.15 1.11 -0.47 1.46 0.87 -0.85 -1.27 113.55 114.56 1wkd h SER 214 Ca 0.05 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.43 1wkd h SER 214 Cb 0.03 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.70 1wkd h SER 214 CO -0.01 0.83 -0.22 0.00 -0.53 0.00 0.00 176.83 176.91 1wkd h ALA 215 N 1.36 0.71 -0.37 6.23 0.00 -0.55 -2.08 119.26 124.56 1wkd h ALA 215 Ca 0.34 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1wkd h ALA 215 Cb -0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1wkd h ALA 215 CO -0.07 0.67 -0.11 -0.44 0.00 0.00 0.00 179.25 179.31 1wkd h ASP 216 N 0.85 0.74 0.36 0.00 3.32 -0.91 -0.88 116.42 119.90 1wkd h ASP 216 Ca 0.11 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 1wkd h ASP 216 Cb 0.79 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 1wkd h ASP 216 CO 0.07 0.94 -0.32 0.00 -1.72 0.00 0.00 179.24 178.21 1wkd h ALA 217 N 0.82 -0.70 -0.63 3.45 0.00 -1.23 0.21 119.26 121.18 1wkd h ALA 217 Ca 0.09 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.00 1wkd h ALA 217 Cb 0.63 0.44 -0.09 0.00 0.00 0.00 0.00 17.79 18.78 1wkd h ALA 217 CO 0.04 -0.93 0.18 -0.07 0.00 0.00 0.00 179.25 178.47 1wkd h LEU 218 N -0.69 0.10 -1.07 0.00 4.07 -1.33 0.14 115.31 116.52 1wkd h LEU 218 Ca -0.03 0.11 -0.08 0.00 0.08 0.00 0.00 57.88 57.96 1wkd h LEU 218 Cb 0.61 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.46 1wkd h LEU 218 CO -0.04 0.05 -0.18 0.00 -1.08 0.00 0.00 178.44 177.19 1wkd h ALA 219 N 1.48 1.22 -0.43 1.53 0.00 -0.84 0.15 119.26 122.38 1wkd h ALA 219 Ca 0.33 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1wkd h ALA 219 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1wkd h ALA 219 CO -0.39 0.50 -0.03 1.49 0.00 0.00 0.00 179.25 180.82 1wkd h GLU 220 N 0.41 0.78 -0.16 0.00 4.81 0.13 -3.05 114.58 117.49 1wkd h GLU 220 Ca 0.07 -0.27 -0.07 0.00 -0.13 0.00 0.00 59.36 58.97 1wkd h GLU 220 Cb 0.55 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 1wkd h GLU 220 CO 0.04 0.87 -0.15 0.82 -0.73 0.00 0.00 179.01 179.85 1wkd h ILE 221 N 0.62 1.34 -0.27 2.32 2.04 -0.76 -3.50 117.51 119.29 1wkd h ILE 221 Ca 0.12 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1wkd h ILE 221 Cb 0.54 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1wkd h ILE 221 CO 0.03 0.39 0.00 0.61 0.00 0.00 0.00 178.15 179.18 1wkd n GLY 222 N 0.17 -1.34 3.18 5.37 0.00 0.52 -5.10 105.19 107.99 1wkd n GLY 222 Ca -0.06 -1.06 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 1wkd n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wkd s PHE 223 N -0.30 1.05 -0.14 1.61 0.08 -1.26 -5.01 117.98 114.01 1wkd s PHE 223 Ca 0.00 -1.32 0.15 0.00 0.12 0.00 0.00 56.93 55.88 1wkd s PHE 223 Cb 0.00 -0.54 0.04 0.00 -0.57 0.00 0.00 43.02 41.95 1wkd s PHE 223 CO 0.00 -0.58 1.40 -0.44 -0.10 0.00 0.00 175.22 175.49 1wkd h ASP 224 N 2.71 0.00 -5.02 1.36 3.32 -1.11 -3.47 116.42 114.20 1wkd h ASP 224 Ca -0.36 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.61 1wkd h ASP 224 Cb 1.23 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.61 1wkd h ASP 224 CO 0.56 0.53 -0.09 -0.83 -1.72 0.00 0.00 179.24 177.69 1wkd s GLY 225 N -4.49 -0.30 -0.13 2.75 0.00 -1.22 -4.37 107.32 99.56 1wkd s GLY 225 Ca 0.03 0.43 0.02 0.00 0.00 0.00 0.00 44.72 45.20 1wkd s GLY 225 CO 0.75 0.16 -0.18 -0.19 0.00 0.00 0.00 173.10 173.65 1wkd s TYR 226 N -2.21 2.30 -0.06 1.90 1.51 0.00 -1.15 117.35 119.64 1wkd s TYR 226 Ca -0.07 -1.17 -0.04 0.00 -1.01 0.00 0.00 57.07 54.78 1wkd s TYR 226 Cb -0.01 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1wkd s TYR 226 CO -0.00 -0.58 0.13 0.00 -1.11 0.00 0.00 175.55 173.99 1wkd s ALA 227 N 1.02 3.80 -0.65 3.71 0.00 -0.04 -1.51 121.76 128.10 1wkd s ALA 227 Ca -0.04 -0.74 -0.17 0.00 0.00 0.00 0.00 51.96 51.01 1wkd s ALA 227 Cb -0.15 -1.83 0.13 0.00 0.00 0.00 0.00 23.12 21.28 1wkd s ALA 227 CO -0.04 0.67 0.69 0.08 0.00 0.00 0.00 175.76 177.16 1wkd s VAL 228 N -1.14 5.07 0.62 0.00 1.01 0.60 -0.64 120.40 125.92 1wkd s VAL 228 Ca 0.20 -1.45 -0.02 0.00 0.00 0.00 0.00 61.98 60.71 1wkd s VAL 228 Cb -0.12 -4.47 0.05 0.00 0.00 0.00 0.00 36.38 31.84 1wkd s VAL 228 CO 0.10 -1.07 0.88 -0.83 0.00 0.00 0.00 175.10 174.19 1wkd s GLY 229 N 3.36 1.77 0.00 4.51 0.00 -0.51 -3.85 107.32 112.60 1wkd s GLY 229 Ca 0.12 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.68 1wkd s GLY 229 CO 0.01 -0.82 0.00 0.61 0.00 0.00 0.00 173.10 172.91 1wkd n GLY 230 N -2.60 1.08 3.97 0.20 0.00 -1.26 -4.63 105.19 101.94 1wkd n GLY 230 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 1wkd n GLY 230 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wkd s LEU 231 N 0.00 3.71 -1.19 0.99 1.43 -1.26 -4.47 118.68 117.88 1wkd s LEU 231 Ca 0.00 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 52.67 1wkd s LEU 231 Cb 0.00 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.67 1wkd s LEU 231 CO 0.00 -0.60 0.28 0.00 0.23 0.00 0.00 176.35 176.26 1wkd n ALA 232 N -1.69 -0.61 -1.40 4.21 0.00 -1.26 -4.89 120.51 114.86 1wkd n ALA 232 Ca 0.04 0.18 0.08 0.00 0.00 0.00 0.00 53.44 53.73 1wkd n ALA 232 Cb 0.59 -2.52 0.17 0.00 0.00 0.00 0.00 19.45 17.69 1wkd n ALA 232 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1wkd n VAL 233 N -4.11 1.94 0.00 0.00 3.14 -1.26 -4.94 118.33 113.09 1wkd n VAL 233 Ca -0.12 -2.66 0.00 0.00 -2.96 0.00 0.00 64.34 58.60 1wkd n VAL 233 Cb 0.61 -0.18 0.00 0.00 -1.06 0.00 0.00 33.84 33.20 1wkd n VAL 233 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wkd n GLY 234 N -1.18 1.00 0.01 7.55 0.00 -1.26 -4.40 105.19 106.91 1wkd n GLY 234 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1wkd n GLY 234 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1wkd n GLU 235 N -1.36 0.18 -0.01 1.61 0.00 -1.26 -5.03 120.64 114.76 1wkd n GLU 235 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.14 1wkd n GLU 235 Cb 0.00 -1.50 -0.00 0.00 0.00 0.00 0.00 31.44 29.94 1wkd n GLU 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1wkd n GLY 236 N 1.42 -2.74 0.33 -1.84 0.00 -1.26 -4.01 105.19 97.10 1wkd n GLY 236 Ca 0.10 -1.35 0.08 0.00 0.00 0.00 0.00 46.02 44.85 1wkd n GLY 236 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1wkd h GLN 237 N -0.00 0.76 -0.20 1.61 4.15 -1.99 -1.02 115.11 118.42 1wkd h GLN 237 Ca -0.00 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.39 1wkd h GLN 237 Cb 0.01 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 1wkd h GLN 237 CO 0.00 0.50 0.08 -0.44 -1.93 0.00 0.00 178.83 177.04 1wkd h ASP 238 N 0.78 0.11 -0.32 -0.69 5.19 -1.99 -0.19 116.42 119.30 1wkd h ASP 238 Ca 0.49 0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.85 1wkd h ASP 238 Cb 0.63 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.12 1wkd h ASP 238 CO -0.33 0.09 -0.06 -0.33 -3.12 0.00 0.00 179.24 175.50 1wkd h GLU 239 N 0.18 0.61 0.14 3.56 4.39 -1.54 -1.26 114.58 120.66 1wkd h GLU 239 Ca 0.08 -0.22 0.02 0.00 0.34 0.00 0.00 59.36 59.58 1wkd h GLU 239 Cb 0.04 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 1wkd h GLU 239 CO -0.07 0.78 -0.44 1.98 -1.16 0.00 0.00 179.01 180.09 1wkd h MET 240 N 0.39 -0.66 -0.75 2.33 4.05 -1.05 0.36 114.93 119.60 1wkd h MET 240 Ca 0.08 0.05 0.05 0.00 -0.28 0.00 0.00 59.70 59.60 1wkd h MET 240 Cb 0.54 0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 31.44 1wkd h MET 240 CO 0.03 -0.44 0.49 0.74 0.23 0.00 0.00 176.91 177.96 1wkd h PHE 241 N -0.69 0.84 -0.53 1.39 0.04 -0.98 0.30 116.94 117.32 1wkd h PHE 241 Ca 0.01 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1wkd h PHE 241 Cb 0.70 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.55 1wkd h PHE 241 CO -0.37 0.47 0.15 -0.09 -0.60 0.00 0.00 178.31 177.86 1wkd h ARG 242 N 0.85 0.83 -0.21 1.51 2.43 -0.31 -1.10 114.38 118.39 1wkd h ARG 242 Ca 0.31 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1wkd h ARG 242 Cb 0.14 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1wkd h ARG 242 CO -0.10 0.78 -0.02 0.28 -1.51 0.00 0.00 179.97 179.40 1wkd h VAL 243 N 0.73 1.27 -0.92 0.20 2.07 0.12 -2.87 116.25 116.85 1wkd h VAL 243 Ca 0.17 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 66.82 1wkd h VAL 243 Cb 0.31 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 1wkd h VAL 243 CO -0.00 0.29 0.60 -0.07 0.02 0.00 0.00 177.57 178.40 1wkd h LEU 244 N 0.13 0.90 -0.49 2.57 3.38 -0.37 0.69 115.31 122.12 1wkd h LEU 244 Ca 0.06 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.14 1wkd h LEU 244 Cb 0.44 -0.18 -0.09 0.00 0.09 0.00 0.00 40.66 40.92 1wkd h LEU 244 CO 0.01 0.56 -0.12 0.44 0.09 0.00 0.00 178.44 179.42 1wkd h ASP 245 N 1.01 -0.46 0.50 -0.43 3.32 -0.96 -1.98 116.42 117.42 1wkd h ASP 245 Ca 0.41 0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.52 1wkd h ASP 245 Cb 0.27 0.30 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1wkd h ASP 245 CO -0.17 -0.16 -1.58 2.22 -1.72 0.00 0.00 179.24 177.83 1wkd n PHE 246 N -5.35 0.58 0.04 4.55 1.16 -1.07 -4.44 117.46 112.92 1wkd n PHE 246 Ca 0.04 0.18 -0.11 0.00 -1.87 0.00 0.00 57.45 55.70 1wkd n PHE 246 Cb 0.26 -0.87 -0.08 0.00 -1.61 0.00 0.00 39.48 37.19 1wkd n PHE 246 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1wkd h SER 247 N 0.00 -0.17 -0.72 5.98 0.02 -0.64 -3.34 113.55 114.68 1wkd h SER 247 Ca -0.11 -0.37 0.14 0.00 -0.84 0.00 0.00 61.79 60.61 1wkd h SER 247 Cb 1.31 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.85 1wkd h SER 247 CO 0.02 0.41 0.48 0.58 -1.14 0.00 0.00 176.83 177.17 1wkd h VAL 248 N -0.87 0.80 0.00 2.27 2.07 -1.58 0.15 116.25 119.09 1wkd h VAL 248 Ca -0.02 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1wkd h VAL 248 Cb 0.53 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1wkd h VAL 248 CO 0.03 0.07 0.00 -2.65 0.02 0.00 0.00 177.57 175.04 1wkd n PRO 249 N -4.46 0.15 0.18 1.57 -0.02 -1.25 -2.53 135.00 128.64 1wkd n PRO 249 Ca 0.13 0.37 0.12 0.00 -2.02 0.00 0.00 63.50 62.11 1wkd n PRO 249 Cb 0.52 -1.78 0.19 0.00 -0.02 0.00 0.00 33.50 32.41 1wkd n PRO 249 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1wkd h MET 250 N 0.00 0.00 -6.45 -0.52 2.86 -0.82 -3.46 114.93 106.54 1wkd h MET 250 Ca 0.00 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.10 1wkd h MET 250 Cb 0.35 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 1wkd h MET 250 CO 0.00 0.00 -0.10 -0.51 1.06 0.00 0.00 176.91 177.36 1wkd s LEU 251 N -5.79 4.17 0.09 1.22 1.43 -1.05 -4.77 118.68 113.98 1wkd s LEU 251 Ca 0.07 0.95 -0.36 0.00 -1.03 0.00 0.00 54.13 53.76 1wkd s LEU 251 Cb 0.07 -3.70 -0.15 0.00 0.03 0.00 0.00 46.19 42.44 1wkd s LEU 251 CO 0.67 -0.08 1.49 -2.65 0.23 0.00 0.00 176.35 176.01 1wkd n PRO 252 N -0.12 1.63 -0.05 1.29 -0.02 -1.26 -4.86 135.00 131.59 1wkd n PRO 252 Ca 0.01 0.59 -0.04 0.00 -2.02 0.00 0.00 63.50 62.04 1wkd n PRO 252 Cb 0.52 -2.30 0.19 0.00 -0.02 0.00 0.00 33.50 31.90 1wkd n PRO 252 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1wkd h ASP 253 N 5.48 0.64 -0.03 2.55 3.58 -1.92 -3.00 116.42 123.72 1wkd h ASP 253 Ca -0.46 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 56.82 1wkd h ASP 253 Cb 1.30 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.18 1wkd h ASP 253 CO 0.84 0.77 0.00 -0.90 -2.88 0.00 0.00 179.24 177.07 1wkd n ASP 254 N -4.19 0.33 -4.19 2.28 5.75 -1.26 -4.80 116.55 110.47 1wkd n ASP 254 Ca 0.01 -2.01 -0.26 0.00 -0.01 0.00 0.00 54.79 52.53 1wkd n ASP 254 Cb 0.33 -0.10 -0.16 0.00 -1.03 0.00 0.00 41.12 40.17 1wkd n ASP 254 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1wkd s LYS 255 N -1.82 1.56 0.37 0.11 -0.14 -1.14 -4.88 119.74 113.80 1wkd s LYS 255 Ca 0.02 -0.67 -0.26 0.00 -1.36 0.00 0.00 55.97 53.70 1wkd s LYS 255 Cb 0.01 -1.49 -0.11 0.00 -1.68 0.00 0.00 37.83 34.56 1wkd s LYS 255 CO 0.01 0.39 1.19 -0.35 -0.76 0.00 0.00 175.35 175.84 1wkd n PRO 256 N 2.66 1.81 -4.25 -1.68 -0.04 -1.26 -4.74 135.00 127.50 1wkd n PRO 256 Ca -0.15 0.64 -0.34 0.00 -0.04 0.00 0.00 63.50 63.61 1wkd n PRO 256 Cb 0.53 -2.22 -0.14 0.00 -0.04 0.00 0.00 33.50 31.64 1wkd n PRO 256 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1wkd s HIS 257 N -1.16 2.94 -0.22 0.54 3.76 -1.26 -0.82 115.29 119.08 1wkd s HIS 257 Ca 0.59 -0.69 -0.00 0.00 -0.15 0.00 0.00 55.06 54.80 1wkd s HIS 257 Cb -0.57 -2.00 0.02 0.00 1.11 0.00 0.00 32.58 31.14 1wkd s HIS 257 CO 0.60 -0.33 -0.13 -0.47 -0.85 0.00 0.00 174.74 173.56 1wkd s TYR 258 N 0.92 2.96 -0.39 1.40 5.04 -0.57 -0.20 117.35 126.50 1wkd s TYR 258 Ca -0.01 -1.62 -0.18 0.00 -2.44 0.00 0.00 57.07 52.82 1wkd s TYR 258 Cb -0.15 -1.99 0.01 0.00 0.35 0.00 0.00 41.96 40.18 1wkd s TYR 258 CO 0.01 -0.76 0.51 -1.17 -1.34 0.00 0.00 175.55 172.80 1wkd s LEU 259 N 1.30 4.52 0.13 6.97 2.96 -0.24 -0.29 118.68 134.02 1wkd s LEU 259 Ca 0.02 -0.28 -0.30 0.00 -0.22 0.00 0.00 54.13 53.35 1wkd s LEU 259 Cb -0.15 -2.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.93 1wkd s LEU 259 CO -0.08 -0.56 1.03 -0.04 -1.32 0.00 0.00 176.35 175.37 1wkd s MET 260 N 2.40 4.64 -1.40 1.98 -1.94 -1.25 -3.97 119.30 119.76 1wkd s MET 260 Ca 0.17 1.57 0.00 0.00 -1.71 0.00 0.00 55.69 55.72 1wkd s MET 260 Cb -0.16 -3.34 0.00 0.00 2.01 0.00 0.00 34.83 33.34 1wkd s MET 260 CO 0.15 0.12 0.00 0.41 -0.01 0.00 0.00 175.02 175.69 1wkd n GLY 261 N 2.27 1.35 3.44 -0.03 0.00 -1.13 -4.82 105.19 106.27 1wkd n GLY 261 Ca 0.03 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1wkd n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wkd s VAL 262 N -2.36 4.25 0.00 1.61 1.01 -0.99 -4.83 120.40 119.08 1wkd s VAL 262 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1wkd s VAL 262 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1wkd s VAL 262 CO 0.00 0.35 0.06 0.61 0.00 0.00 0.00 175.10 176.12 1wkd n GLY 263 N 4.86 0.52 3.77 4.51 0.00 -1.26 -3.98 105.19 113.61 1wkd n GLY 263 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1wkd n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wkd s LYS 264 N 0.00 4.02 0.29 1.61 1.02 -1.26 -4.81 119.74 120.61 1wkd s LYS 264 Ca 0.00 2.18 0.04 0.00 0.02 0.00 0.00 55.97 58.21 1wkd s LYS 264 Cb 0.00 -2.80 0.73 0.00 -0.52 0.00 0.00 37.83 35.24 1wkd s LYS 264 CO 0.00 -0.46 1.70 -1.35 -0.92 0.00 0.00 175.35 174.32 1wkd h PRO 265 N 2.77 0.41 -0.01 -1.68 0.11 -2.00 0.17 132.00 131.77 1wkd h PRO 265 Ca -0.50 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.49 1wkd h PRO 265 Cb 1.24 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1wkd h PRO 265 CO 0.63 0.27 -0.47 0.38 -0.21 0.00 0.00 178.00 178.59 1wkd h ASP 266 N 0.42 0.03 -0.20 -2.05 2.03 -2.00 -2.05 116.42 112.60 1wkd h ASP 266 Ca 0.56 -0.01 -0.03 0.00 -0.73 0.00 0.00 57.03 56.82 1wkd h ASP 266 Cb 1.05 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 39.54 1wkd h ASP 266 CO -0.52 0.50 0.00 0.44 -1.03 0.00 0.00 179.24 178.64 1wkd h ASP 267 N 0.02 0.34 0.17 4.15 3.32 -1.06 -1.59 116.42 121.77 1wkd h ASP 267 Ca -0.00 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1wkd h ASP 267 Cb 0.85 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 1wkd h ASP 267 CO 0.06 0.56 -0.17 0.40 -1.72 0.00 0.00 179.24 178.37 1wkd h ILE 268 N 0.12 0.62 -0.65 0.35 2.04 -1.10 0.21 117.51 119.09 1wkd h ILE 268 Ca 0.06 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.98 1wkd h ILE 268 Cb 0.38 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 1wkd h ILE 268 CO 0.01 0.00 0.35 0.58 0.00 0.00 0.00 178.15 179.09 1wkd h VAL 269 N -0.37 0.94 -0.41 1.67 2.07 -1.35 0.15 116.25 118.95 1wkd h VAL 269 Ca 0.00 -0.22 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 1wkd h VAL 269 Cb 0.35 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1wkd h VAL 269 CO -0.05 0.12 -0.20 1.23 0.02 0.00 0.00 177.57 178.69 1wkd h GLY 270 N 0.63 0.86 1.30 2.17 0.00 -0.98 -2.67 103.07 104.39 1wkd h GLY 270 Ca 0.30 -0.72 -0.10 0.00 0.00 0.00 0.00 47.33 46.81 1wkd h GLY 270 CO -0.20 0.65 -0.13 0.00 0.00 0.00 0.00 176.54 176.86 1wkd h ALA 271 N 1.08 0.93 -0.05 3.60 0.00 0.45 -2.51 119.26 122.77 1wkd h ALA 271 Ca 0.10 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1wkd h ALA 271 Cb 0.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1wkd h ALA 271 CO 0.05 0.62 -0.33 0.28 0.00 0.00 0.00 179.25 179.87 1wkd h VAL 272 N 0.73 1.26 0.00 0.00 2.07 -0.63 -1.42 116.25 118.27 1wkd h VAL 272 Ca 0.12 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.40 1wkd h VAL 272 Cb 0.63 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1wkd h VAL 272 CO 0.04 0.36 -0.08 -0.33 0.02 0.00 0.00 177.57 177.58 1wkd h GLU 273 N 0.08 0.00 -0.56 1.57 5.08 -1.10 -2.57 114.58 117.09 1wkd h GLU 273 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1wkd h GLU 273 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1wkd h GLU 273 CO 0.05 0.08 0.00 0.54 -1.00 0.00 0.00 179.01 178.68 1wkd n ARG 274 N -3.36 3.86 -0.22 2.33 1.74 -0.59 -3.97 116.66 116.45 1wkd n ARG 274 Ca -0.01 -2.90 0.00 0.00 -0.77 0.00 0.00 57.85 54.17 1wkd n ARG 274 Cb 0.25 -1.94 0.00 0.00 -1.02 0.00 0.00 32.46 29.76 1wkd n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wkd n GLY 275 N 0.73 0.89 3.78 -0.13 0.00 -0.97 -4.77 105.19 104.72 1wkd n GLY 275 Ca 0.25 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1wkd n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wkd s ILE 276 N -2.00 4.31 -0.02 -0.61 -1.09 -0.86 -4.63 121.20 116.29 1wkd s ILE 276 Ca 0.00 1.76 0.08 0.00 -2.23 0.00 0.00 60.65 60.26 1wkd s ILE 276 Cb 0.00 -4.14 -0.12 0.00 -1.58 0.00 0.00 42.46 36.62 1wkd s ILE 276 CO 0.00 0.45 0.16 0.47 -1.23 0.00 0.00 174.94 174.79 1wkd n ASP 277 N 1.38 3.08 -3.95 3.58 8.00 0.72 -4.44 116.55 124.92 1wkd n ASP 277 Ca -0.04 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 1wkd n ASP 277 Cb 0.49 1.27 -0.13 0.00 -0.02 0.00 0.00 41.12 42.73 1wkd n ASP 277 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1wkd s MET 278 N -2.52 0.29 0.11 -1.24 -1.94 -0.87 0.46 119.30 113.58 1wkd s MET 278 Ca -0.03 -0.29 -0.01 0.00 -1.71 0.00 0.00 55.69 53.66 1wkd s MET 278 Cb 0.05 -0.19 -0.04 0.00 2.01 0.00 0.00 34.83 36.66 1wkd s MET 278 CO 0.34 0.04 0.01 -0.06 -0.01 0.00 0.00 175.02 175.35 1wkd s PHE 279 N -0.49 0.78 -0.12 -0.03 0.40 -0.42 -1.08 117.98 117.02 1wkd s PHE 279 Ca -0.03 -1.14 -0.22 0.00 -0.60 0.00 0.00 56.93 54.94 1wkd s PHE 279 Cb -0.04 -0.47 0.05 0.00 0.51 0.00 0.00 43.02 43.07 1wkd s PHE 279 CO -0.00 -0.42 0.55 0.16 0.70 0.00 0.00 175.22 176.22 1wkd s ASP 280 N -3.02 -0.53 -0.20 1.36 1.47 -1.25 -0.93 116.67 113.56 1wkd s ASP 280 Ca 0.17 0.79 -0.29 0.00 1.18 0.00 0.00 52.55 54.40 1wkd s ASP 280 Cb 0.07 0.79 0.14 0.00 -0.34 0.00 0.00 42.92 43.58 1wkd s ASP 280 CO -0.02 -0.38 1.07 0.00 0.68 0.00 0.00 175.17 176.52 1wkd n VAL 282 N 0.98 0.02 -0.11 0.00 0.24 -1.26 -4.31 118.33 113.89 1wkd n VAL 282 Ca -0.09 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.34 62.07 1wkd n VAL 282 Cb 0.58 0.18 -0.07 0.00 -1.47 0.00 0.00 33.84 33.06 1wkd n VAL 282 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1wkd h LEU 283 N 0.00 -1.56 -0.43 1.34 5.85 -1.95 0.21 115.31 118.76 1wkd h LEU 283 Ca 0.00 0.22 0.08 0.00 0.84 0.00 0.00 57.88 59.02 1wkd h LEU 283 Cb 0.52 0.66 -0.08 0.00 0.37 0.00 0.00 40.66 42.13 1wkd h LEU 283 CO 0.00 -0.40 -0.07 1.55 -0.34 0.00 0.00 178.44 179.18 1wkd h PRO 284 N -0.39 0.03 0.16 5.25 0.13 -1.92 0.25 132.00 135.51 1wkd h PRO 284 Ca 0.11 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1wkd h PRO 284 Cb 0.60 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1wkd h PRO 284 CO -0.55 0.02 -0.08 1.79 -0.23 0.00 0.00 178.00 178.96 1wkd h THR 285 N 0.03 0.94 0.22 1.56 1.35 -1.81 -2.48 112.91 112.72 1wkd h THR 285 Ca 0.21 -0.43 0.01 0.00 -0.55 0.00 0.00 66.41 65.65 1wkd h THR 285 Cb 0.32 1.21 -0.04 0.00 -1.73 0.00 0.00 68.15 67.90 1wkd h THR 285 CO -0.42 0.10 -0.40 -0.09 -0.25 0.00 0.00 175.52 174.47 1wkd h ARG 286 N -0.42 -0.67 -0.49 4.72 2.43 -0.12 -1.71 114.38 118.12 1wkd h ARG 286 Ca -0.02 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1wkd h ARG 286 Cb 0.33 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1wkd h ARG 286 CO 0.04 -0.45 0.31 0.77 -1.51 0.00 0.00 179.97 179.13 1wkd h SER 287 N -0.70 0.57 -0.29 -3.80 0.02 -0.63 -2.26 113.55 106.46 1wkd h SER 287 Ca 0.00 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 1wkd h SER 287 Cb 0.68 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 1wkd h SER 287 CO -0.17 0.42 0.09 1.23 -1.14 0.00 0.00 176.83 177.26 1wkd h GLY 288 N 0.69 0.35 2.00 -3.77 0.00 -0.83 0.14 103.07 101.64 1wkd h GLY 288 Ca 0.18 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 1wkd h GLY 288 CO -0.04 0.02 -0.22 -0.09 0.00 0.00 0.00 176.54 176.21 1wkd h ARG 289 N 0.21 0.00 0.00 4.80 2.43 -1.11 -2.53 114.38 118.17 1wkd h ARG 289 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1wkd h ARG 289 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1wkd h ARG 289 CO -0.15 0.22 0.00 -0.91 -1.51 0.00 0.00 179.97 177.62 1wkd h ASN 290 N 0.00 0.00 0.00 -3.80 -0.26 -0.45 -3.48 115.58 107.60 1wkd h ASN 290 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1wkd h ASN 290 Cb 0.39 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.65 1wkd h ASN 290 CO 0.03 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 177.01 1wkd n GLY 291 N 0.75 0.66 3.60 2.83 0.00 0.28 -4.98 105.19 108.34 1wkd n GLY 291 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1wkd n GLY 291 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wkd s GLN 292 N -0.72 3.97 -0.04 1.61 0.74 -0.52 -0.29 119.66 124.42 1wkd s GLN 292 Ca 0.00 -0.31 0.03 0.00 0.05 0.00 0.00 55.36 55.13 1wkd s GLN 292 Cb 0.00 -3.64 -0.03 0.00 1.10 0.00 0.00 33.01 30.44 1wkd s GLN 292 CO 0.00 -0.14 -0.12 0.00 -0.55 0.00 0.00 175.29 174.48 1wkd s ALA 293 N 1.63 2.77 0.04 1.58 0.00 0.01 -3.88 121.76 123.91 1wkd s ALA 293 Ca 0.07 -0.98 -0.19 0.00 0.00 0.00 0.00 51.96 50.86 1wkd s ALA 293 Cb -0.16 -1.02 -0.06 0.00 0.00 0.00 0.00 23.12 21.88 1wkd s ALA 293 CO 0.10 0.57 0.56 -0.06 0.00 0.00 0.00 175.76 176.93 1wkd s PHE 294 N -0.79 3.76 0.17 0.00 0.08 -1.26 -0.46 117.98 119.47 1wkd s PHE 294 Ca 0.13 1.22 -0.01 0.00 0.12 0.00 0.00 56.93 58.39 1wkd s PHE 294 Cb -0.11 -2.51 -0.04 0.00 -0.57 0.00 0.00 43.02 39.79 1wkd s PHE 294 CO 0.02 0.52 0.09 0.95 -0.10 0.00 0.00 175.22 176.70 1wkd s THR 295 N -0.81 0.07 -0.75 0.64 -4.23 -1.10 -4.88 115.64 104.58 1wkd s THR 295 Ca 0.29 -1.96 0.17 0.00 -1.18 0.00 0.00 61.69 59.01 1wkd s THR 295 Cb -0.19 -2.27 0.16 0.00 1.34 0.00 0.00 72.50 71.54 1wkd s THR 295 CO 0.18 -0.24 1.53 0.79 -0.54 0.00 0.00 174.62 176.34 1wkd n TRP 296 N -0.19 0.36 -1.21 3.99 7.02 -1.26 -2.21 117.44 123.94 1wkd n TRP 296 Ca -0.02 0.15 -0.05 0.00 -1.02 0.00 0.00 57.50 56.56 1wkd n TRP 296 Cb 0.65 -0.74 0.24 0.00 -2.42 0.00 0.00 31.31 29.04 1wkd n TRP 296 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1wkd n ASP 297 N -1.83 3.61 0.00 -0.99 8.00 -1.26 -3.06 116.55 121.01 1wkd n ASP 297 Ca 0.02 -3.44 0.00 0.00 0.71 0.00 0.00 54.79 52.08 1wkd n ASP 297 Cb 0.17 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 1wkd n ASP 297 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wkd n GLY 298 N -0.75 1.85 3.85 0.44 0.00 -0.94 -4.80 105.19 104.84 1wkd n GLY 298 Ca 0.37 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 1wkd n GLY 298 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1wkd s PRO 299 N -2.33 3.66 0.07 1.61 0.02 -1.26 -2.72 135.00 134.04 1wkd s PRO 299 Ca 0.00 0.91 0.04 0.00 0.02 0.00 0.00 61.00 61.97 1wkd s PRO 299 Cb 0.00 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 1wkd s PRO 299 CO 0.00 -0.52 -0.12 0.96 -0.33 0.00 0.00 177.00 176.99 1wkd s ILE 300 N -2.85 0.93 -0.41 2.83 -4.36 0.39 -4.92 121.20 112.81 1wkd s ILE 300 Ca 0.58 -1.29 -0.12 0.00 -0.26 0.00 0.00 60.65 59.56 1wkd s ILE 300 Cb -0.11 -0.98 0.05 0.00 1.25 0.00 0.00 42.46 42.66 1wkd s ILE 300 CO 0.42 -0.32 0.27 0.21 0.24 0.00 0.00 174.94 175.77 1wkd s ASN 301 N -1.80 5.87 0.64 4.36 3.84 -1.26 -0.81 114.94 125.78 1wkd s ASN 301 Ca -0.03 -1.16 0.31 0.00 0.21 0.00 0.00 52.86 52.19 1wkd s ASN 301 Cb -0.09 -2.07 1.72 0.00 -0.55 0.00 0.00 41.25 40.26 1wkd s ASN 301 CO 0.01 -0.49 2.01 -0.29 -2.79 0.00 0.00 177.10 175.56 1wkd h ILE 302 N 5.85 0.15 0.00 -5.21 6.09 -1.03 -2.02 117.51 121.34 1wkd h ILE 302 Ca -0.26 0.00 -0.07 0.00 -1.37 0.00 0.00 64.86 63.16 1wkd h ILE 302 Cb 1.10 0.73 -0.01 0.00 0.47 0.00 0.00 36.82 39.12 1wkd h ILE 302 CO 0.74 0.00 -0.34 0.03 -3.07 0.00 0.00 178.15 175.51 1wkd h ARG 303 N 0.00 0.00 -6.35 2.19 3.08 -1.87 -3.40 114.38 108.02 1wkd h ARG 303 Ca 0.05 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.46 1wkd h ARG 303 Cb 0.63 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.72 1wkd h ARG 303 CO -0.00 0.34 0.75 -1.71 -1.07 0.00 0.00 179.97 178.28 1wkd n ASN 304 N -4.12 2.60 0.23 7.04 2.85 -0.76 -4.86 115.26 118.24 1wkd n ASN 304 Ca -0.02 1.08 0.11 0.00 -0.11 0.00 0.00 54.58 55.63 1wkd n ASN 304 Cb 0.38 -1.31 0.37 0.00 1.24 0.00 0.00 39.78 40.47 1wkd n ASN 304 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wkd h ALA 305 N 6.17 1.96 0.00 5.20 0.00 -1.90 -1.07 119.26 129.62 1wkd h ALA 305 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1wkd h ALA 305 Cb 1.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1wkd h ALA 305 CO 0.87 -0.89 0.00 2.89 0.00 0.00 0.00 179.25 182.12 1wkd n ARG 306 N -2.83 0.50 -0.02 0.00 1.85 -1.26 -2.85 116.66 112.04 1wkd n ARG 306 Ca 0.04 0.02 0.09 0.00 -1.00 0.00 0.00 57.85 57.00 1wkd n ARG 306 Cb 0.86 -1.50 0.09 0.00 -1.05 0.00 0.00 32.46 30.86 1wkd n ARG 306 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1wkd n PHE 307 N -1.22 0.06 -0.03 2.89 3.72 -0.40 -4.57 117.46 117.90 1wkd n PHE 307 Ca 0.15 -0.04 0.14 0.00 -0.05 0.00 0.00 57.45 57.65 1wkd n PHE 307 Cb 0.19 -0.00 0.57 0.00 -0.94 0.00 0.00 39.48 39.30 1wkd n PHE 307 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1wkd h SER 308 N 3.52 0.22 0.00 4.37 4.64 -1.70 -2.77 113.55 121.84 1wkd h SER 308 Ca 0.00 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 1wkd h SER 308 Cb 0.76 -0.04 -0.12 0.00 -0.31 0.00 0.00 62.40 62.69 1wkd h SER 308 CO 0.00 0.13 -0.57 -0.62 -0.87 0.00 0.00 176.83 174.90 1wkd n GLU 309 N -4.45 0.75 -2.89 4.77 1.02 -1.26 -4.67 120.64 113.90 1wkd n GLU 309 Ca 0.09 -2.35 -0.42 0.00 -0.02 0.00 0.00 57.16 54.46 1wkd n GLU 309 Cb 0.42 -0.89 -0.04 0.00 -0.02 0.00 0.00 31.44 30.90 1wkd n GLU 309 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wkd s ASP 310 N -2.38 6.75 0.00 1.62 -1.08 -1.05 -4.92 116.67 115.61 1wkd s ASP 310 Ca 0.29 0.84 0.28 0.00 -0.52 0.00 0.00 52.55 53.44 1wkd s ASP 310 Cb 0.29 -2.43 1.16 0.00 -1.46 0.00 0.00 42.92 40.48 1wkd s ASP 310 CO -0.07 -0.61 1.81 0.18 0.52 0.00 0.00 175.17 177.00 1wkd n LEU 311 N 6.21 0.88 -4.82 -1.34 7.99 -1.26 -1.10 117.00 123.56 1wkd n LEU 311 Ca 0.05 -0.23 -0.33 0.00 -0.01 0.00 0.00 56.01 55.50 1wkd n LEU 311 Cb 0.48 -0.08 -0.04 0.00 -0.11 0.00 0.00 43.42 43.67 1wkd n LEU 311 CO 0.50 0.15 0.68 -0.54 -1.51 0.00 0.00 177.39 176.68 1wkd s LYS 312 N -2.25 3.91 0.99 3.23 1.02 -1.26 -4.61 119.74 120.76 1wkd s LYS 312 Ca 0.34 1.10 -0.12 0.00 0.02 0.00 0.00 55.97 57.30 1wkd s LYS 312 Cb 0.20 -2.13 0.18 0.00 -0.52 0.00 0.00 37.83 35.57 1wkd s LYS 312 CO 0.42 -0.31 1.09 -1.25 -0.92 0.00 0.00 175.35 174.38 1wkd s PRO 313 N -3.70 0.51 0.44 -1.68 0.04 -1.26 -1.01 135.00 128.33 1wkd s PRO 313 Ca 0.62 0.62 0.20 0.00 0.04 0.00 0.00 61.00 62.48 1wkd s PRO 313 Cb -0.11 -1.74 1.16 0.00 0.04 0.00 0.00 34.50 33.85 1wkd s PRO 313 CO 0.25 -2.70 1.86 -0.07 0.04 0.00 0.00 177.00 176.38 1wkd h LEU 314 N -1.88 0.33 -7.06 -3.56 4.07 -1.88 -3.39 115.31 101.94 1wkd h LEU 314 Ca -0.54 0.04 -0.10 0.00 0.08 0.00 0.00 57.88 57.36 1wkd h LEU 314 Cb 1.32 -0.02 -0.28 0.00 1.08 0.00 0.00 40.66 42.76 1wkd h LEU 314 CO 0.56 0.13 -0.38 -0.62 -1.08 0.00 0.00 178.44 177.05 1wkd s ASP 315 N -5.62 -0.22 0.00 -0.43 -1.08 -1.26 -4.85 116.67 103.21 1wkd s ASP 315 Ca -0.08 0.93 0.09 0.00 -0.52 0.00 0.00 52.55 52.97 1wkd s ASP 315 Cb 0.23 1.33 0.40 0.00 -1.46 0.00 0.00 42.92 43.41 1wkd s ASP 315 CO 0.78 -0.24 1.22 -1.20 0.52 0.00 0.00 175.17 176.25 1wkd n SER 316 N 5.39 0.00 -0.18 -0.34 7.64 -1.26 -1.99 113.62 122.89 1wkd n SER 316 Ca -0.08 0.35 0.05 0.00 1.01 0.00 0.00 58.87 60.21 1wkd n SER 316 Cb 0.49 -0.41 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 1wkd n SER 316 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1wkd n GLU 317 N -1.41 2.47 -2.61 1.43 1.02 -1.26 -4.98 120.64 115.31 1wkd n GLU 317 Ca 0.03 -0.45 -0.42 0.00 -0.02 0.00 0.00 57.16 56.30 1wkd n GLU 317 Cb 0.09 -1.08 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1wkd n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wkd n HIS 319 N 4.68 0.89 -1.53 0.00 8.25 -1.26 -4.68 115.22 121.57 1wkd n HIS 319 Ca 0.09 -0.36 -0.30 0.00 -0.26 0.00 0.00 57.72 56.88 1wkd n HIS 319 Cb 0.48 -0.16 0.07 0.00 1.12 0.00 0.00 29.99 31.51 1wkd n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1wkd h ALA 321 N -0.94 2.05 -0.04 0.00 0.00 -1.94 -1.60 119.26 116.78 1wkd h ALA 321 Ca -0.45 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 1wkd h ALA 321 Cb 1.24 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1wkd h ALA 321 CO 0.57 -0.17 -0.55 0.28 0.00 0.00 0.00 179.25 179.39 1wkd h VAL 322 N 0.00 1.40 0.00 0.00 2.07 -1.91 -2.42 116.25 115.39 1wkd h VAL 322 Ca 0.06 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.62 1wkd h VAL 322 Cb 0.27 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.47 1wkd h VAL 322 CO -0.00 0.58 0.00 0.00 0.02 0.00 0.00 177.57 178.17 1wkd h GLN 324 N 0.00 0.00 0.00 0.00 1.08 -1.31 -3.41 115.11 111.48 1wkd h GLN 324 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1wkd h GLN 324 Cb 0.71 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 1wkd h GLN 324 CO 0.00 0.22 -0.64 1.63 -0.95 0.00 0.00 178.83 179.08 1wkd n LYS 325 N -2.97 2.58 -4.26 1.46 5.02 -0.92 -5.07 118.16 114.01 1wkd n LYS 325 Ca -0.01 -0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.11 1wkd n LYS 325 Cb 0.68 -0.83 -0.10 0.00 -0.02 0.00 0.00 35.03 34.76 1wkd n LYS 325 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1wkd s TRP 326 N -1.66 1.38 0.31 2.13 0.51 0.29 -5.08 118.94 116.83 1wkd s TRP 326 Ca -0.00 -0.64 0.06 0.00 -2.12 0.00 0.00 56.10 53.40 1wkd s TRP 326 Cb 0.00 -0.70 -0.02 0.00 -0.81 0.00 0.00 33.47 31.95 1wkd s TRP 326 CO 0.02 0.15 0.42 -1.54 -0.51 0.00 0.00 176.95 175.49 1wkd s SER 327 N -2.90 5.98 0.38 2.95 1.04 -1.26 -4.39 113.70 115.49 1wkd s SER 327 Ca 0.14 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.46 1wkd s SER 327 Cb -0.01 -1.37 0.74 0.00 0.10 0.00 0.00 66.02 65.48 1wkd s SER 327 CO 0.03 -0.32 2.02 0.03 0.98 0.00 0.00 173.24 175.98 1wkd h ARG 328 N 1.02 0.71 -0.33 4.02 3.08 -1.06 -2.59 114.38 119.23 1wkd h ARG 328 Ca -0.47 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.53 1wkd h ARG 328 Cb 1.25 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.12 1wkd h ARG 328 CO 0.56 0.47 0.20 0.00 -1.07 0.00 0.00 179.97 180.12 1wkd h ALA 329 N 1.66 0.43 0.38 0.04 0.00 -1.06 0.25 119.26 120.95 1wkd h ALA 329 Ca 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1wkd h ALA 329 Cb -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1wkd h ALA 329 CO -0.05 -0.07 -0.18 -0.92 0.00 0.00 0.00 179.25 178.03 1wkd h TYR 330 N 0.43 -0.47 -0.76 0.00 3.20 -1.78 -1.86 116.97 115.73 1wkd h TYR 330 Ca 0.12 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.03 1wkd h TYR 330 Cb 0.01 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.39 1wkd h TYR 330 CO -0.04 -0.17 0.50 0.82 -1.64 0.00 0.00 178.16 177.63 1wkd h ILE 331 N -0.73 1.06 -0.40 1.81 2.04 -1.40 0.21 117.51 120.10 1wkd h ILE 331 Ca -0.05 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.56 1wkd h ILE 331 Cb 0.51 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 1wkd h ILE 331 CO 0.08 0.15 0.15 -0.74 0.00 0.00 0.00 178.15 177.80 1wkd h HIS 332 N 0.85 0.27 -0.00 1.37 2.76 -0.37 -0.89 115.15 119.15 1wkd h HIS 332 Ca 0.32 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.51 1wkd h HIS 332 Cb 0.18 -0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.08 1wkd h HIS 332 CO -0.00 0.12 0.00 1.25 -1.30 0.00 0.00 177.93 178.00 1wkd h HIS 333 N 0.32 0.00 -0.09 5.26 -0.00 0.07 -1.13 115.15 119.58 1wkd h HIS 333 Ca 0.18 -0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.59 1wkd h HIS 333 Cb 0.15 -0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 27.50 1wkd h HIS 333 CO -0.14 0.14 -0.31 -0.07 -0.00 0.00 0.00 177.93 177.55 1wkd h LEU 334 N -0.13 -0.95 -0.75 0.26 4.07 -0.31 0.13 115.31 117.62 1wkd h LEU 334 Ca 0.00 0.14 -0.05 0.00 0.08 0.00 0.00 57.88 58.05 1wkd h LEU 334 Cb 0.14 0.40 -0.03 0.00 1.08 0.00 0.00 40.66 42.25 1wkd h LEU 334 CO -0.00 -0.36 0.28 0.40 -1.08 0.00 0.00 178.44 177.68 1wkd h ILE 335 N -0.41 1.26 0.00 1.22 1.08 -1.13 -0.87 117.51 118.66 1wkd h ILE 335 Ca 0.09 -0.85 -0.07 0.00 -0.39 0.00 0.00 64.86 63.64 1wkd h ILE 335 Cb 0.54 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.67 1wkd h ILE 335 CO -0.32 0.34 -0.33 0.03 -0.69 0.00 0.00 178.15 177.18 1wkd h ARG 336 N 1.10 0.00 0.00 2.37 3.08 -0.82 -2.44 114.38 117.67 1wkd h ARG 336 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1wkd h ARG 336 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1wkd h ARG 336 CO -0.02 0.33 -0.14 0.00 -1.07 0.00 0.00 179.97 179.08 1wkd n ALA 337 N -2.31 2.55 -1.07 0.04 0.00 0.42 -4.92 120.51 115.22 1wkd n ALA 337 Ca -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.29 1wkd n ALA 337 Cb 0.45 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 1wkd n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wkd n GLY 338 N 1.43 0.48 3.76 0.00 0.00 -0.65 -5.01 105.19 105.20 1wkd n GLY 338 Ca 0.06 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.66 1wkd n GLY 338 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wkd s GLU 339 N -2.18 4.61 0.28 1.61 0.41 -0.42 -4.92 118.70 118.08 1wkd s GLU 339 Ca 0.00 1.78 -0.00 0.00 -0.41 0.00 0.00 54.97 56.34 1wkd s GLU 339 Cb 0.00 -3.14 0.50 0.00 -1.78 0.00 0.00 34.13 29.71 1wkd s GLU 339 CO 0.00 0.19 1.85 0.82 -0.49 0.00 0.00 175.26 177.62 1wkd h ILE 340 N 3.03 0.97 -0.30 -1.63 2.04 -1.95 -2.06 117.51 117.61 1wkd h ILE 340 Ca -0.47 -0.36 0.09 0.00 1.00 0.00 0.00 64.86 65.12 1wkd h ILE 340 Cb 1.21 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1wkd h ILE 340 CO 0.67 0.19 0.24 0.25 0.00 0.00 0.00 178.15 179.50 1wkd h LEU 341 N 1.04 0.00 -0.41 1.44 5.85 -1.93 0.18 115.31 121.48 1wkd h LEU 341 Ca 0.47 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 59.04 1wkd h LEU 341 Cb 0.39 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1wkd h LEU 341 CO -0.24 0.00 -0.36 1.23 -0.34 0.00 0.00 178.44 178.73 1wkd h GLY 342 N 0.00 1.04 1.27 3.75 0.00 -1.65 -0.64 103.07 106.84 1wkd h GLY 342 Ca 0.14 -1.04 -0.11 0.00 0.00 0.00 0.00 47.33 46.32 1wkd h GLY 342 CO -0.00 0.94 -0.14 0.00 0.00 0.00 0.00 176.54 177.34 1wkd h ALA 343 N 0.79 0.89 0.35 3.60 0.00 -1.06 -0.48 119.26 123.35 1wkd h ALA 343 Ca 0.07 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1wkd h ALA 343 Cb 0.96 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1wkd h ALA 343 CO 0.09 0.63 -0.17 0.52 0.00 0.00 0.00 179.25 180.33 1wkd h MET 344 N 0.76 -0.45 -0.41 0.00 2.07 -1.19 -1.93 114.93 113.78 1wkd h MET 344 Ca 0.12 0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.77 1wkd h MET 344 Cb 0.66 0.10 -0.02 0.00 -1.87 0.00 0.00 31.60 30.47 1wkd h MET 344 CO 0.05 -0.17 0.23 -0.07 1.07 0.00 0.00 176.91 178.02 1wkd h LEU 345 N -0.70 0.51 -0.05 1.22 4.07 -1.11 -1.14 115.31 118.11 1wkd h LEU 345 Ca -0.05 -0.09 -0.00 0.00 0.08 0.00 0.00 57.88 57.83 1wkd h LEU 345 Cb 0.49 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.10 1wkd h LEU 345 CO 0.08 0.45 0.03 0.24 -1.08 0.00 0.00 178.44 178.15 1wkd h MET 346 N 0.53 0.06 -0.38 1.13 2.86 -1.13 -1.90 114.93 116.09 1wkd h MET 346 Ca 0.14 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1wkd h MET 346 Cb 0.05 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1wkd h MET 346 CO -0.02 0.08 0.24 1.15 1.06 0.00 0.00 176.91 179.42 1wkd h THR 347 N 0.03 1.11 -0.43 2.22 2.02 -1.29 0.38 112.91 116.96 1wkd h THR 347 Ca 0.02 -0.23 0.06 0.00 0.77 0.00 0.00 66.41 67.02 1wkd h THR 347 Cb 0.03 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 1wkd h THR 347 CO -0.00 0.11 0.11 -0.08 0.37 0.00 0.00 175.52 176.03 1wkd h GLU 348 N 0.51 0.25 0.34 6.66 4.81 -1.09 -0.64 114.58 125.42 1wkd h GLU 348 Ca 0.14 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1wkd h GLU 348 Cb -0.03 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1wkd h GLU 348 CO -0.03 0.17 -0.18 1.25 -0.73 0.00 0.00 179.01 179.49 1wkd h HIS 349 N 0.26 -0.46 -0.47 0.92 2.76 -0.85 -0.12 115.15 117.19 1wkd h HIS 349 Ca 0.20 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.40 1wkd h HIS 349 Cb 0.23 0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.31 1wkd h HIS 349 CO -0.18 -0.28 0.26 -0.91 -1.30 0.00 0.00 177.93 175.51 1wkd h ASN 350 N -0.48 0.40 -0.37 3.26 -0.26 -0.56 0.44 115.58 118.01 1wkd h ASN 350 Ca -0.04 0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 55.70 1wkd h ASN 350 Cb 0.38 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 1wkd h ASN 350 CO 0.06 0.28 0.17 0.40 -1.06 0.00 0.00 177.43 177.29 1wkd h ILE 351 N 0.52 1.17 -0.69 2.81 2.04 -1.08 -0.92 117.51 121.36 1wkd h ILE 351 Ca 0.20 -0.50 0.05 0.00 1.00 0.00 0.00 64.86 65.60 1wkd h ILE 351 Cb 0.06 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 36.91 1wkd h ILE 351 CO -0.11 0.19 0.41 0.00 0.00 0.00 0.00 178.15 178.63 1wkd h ALA 352 N 1.02 0.91 -0.26 1.87 0.00 0.01 -1.26 119.26 121.56 1wkd h ALA 352 Ca 0.13 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1wkd h ALA 352 Cb 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1wkd h ALA 352 CO -0.01 0.13 0.07 0.35 0.00 0.00 0.00 179.25 179.79 1wkd h PHE 353 N 0.77 0.13 -0.39 0.00 3.57 0.49 -0.70 116.94 120.81 1wkd h PHE 353 Ca 0.29 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 1wkd h PHE 353 Cb 0.11 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1wkd h PHE 353 CO -0.06 0.05 0.20 1.88 -2.23 0.00 0.00 178.31 178.16 1wkd h TYR 354 N 0.18 0.51 -0.02 0.41 -1.99 -0.68 -1.08 116.97 114.30 1wkd h TYR 354 Ca 0.12 -0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.69 1wkd h TYR 354 Cb 0.10 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 38.64 1wkd h TYR 354 CO -0.14 0.37 -0.71 1.96 -0.00 0.00 0.00 178.16 179.64 1wkd h GLN 355 N 0.53 0.10 -0.13 4.88 1.08 -0.55 -2.26 115.11 118.75 1wkd h GLN 355 Ca 0.14 -0.08 -0.18 0.00 -1.45 0.00 0.00 58.65 57.07 1wkd h GLN 355 Cb 0.03 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1wkd h GLN 355 CO -0.02 0.77 -0.67 1.96 -0.95 0.00 0.00 178.83 179.91 1wkd h GLN 356 N 0.06 0.54 -0.55 1.46 4.20 -0.65 -2.09 115.11 118.08 1wkd h GLN 356 Ca -0.01 -0.40 -0.06 0.00 0.06 0.00 0.00 58.65 58.24 1wkd h GLN 356 Cb 1.26 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.09 1wkd h GLN 356 CO 0.10 1.02 0.12 1.25 -0.67 0.00 0.00 178.83 180.65 1wkd h LEU 357 N 0.39 0.85 -1.18 1.46 5.85 -1.16 0.09 115.31 121.60 1wkd h LEU 357 Ca -0.02 -0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.37 1wkd h LEU 357 Cb 1.25 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1wkd h LEU 357 CO 0.12 0.88 -0.39 0.24 -0.34 0.00 0.00 178.44 178.95 1wkd h MET 358 N 0.79 0.04 -0.15 1.25 2.86 -1.29 -1.29 114.93 117.15 1wkd h MET 358 Ca 0.17 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 1wkd h MET 358 Cb 0.37 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1wkd h MET 358 CO 0.01 0.43 -0.28 0.37 1.06 0.00 0.00 176.91 178.50 1wkd h GLN 359 N 0.04 0.45 -0.66 1.72 5.75 -1.06 -1.52 115.11 119.83 1wkd h GLN 359 Ca 0.00 -0.28 -0.02 0.00 -0.15 0.00 0.00 58.65 58.20 1wkd h GLN 359 Cb 0.71 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 1wkd h GLN 359 CO 0.05 0.88 0.32 0.87 -2.65 0.00 0.00 178.83 178.31 1wkd h LYS 360 N 0.06 0.93 -0.28 1.69 1.57 -0.75 -0.07 116.57 119.72 1wkd h LYS 360 Ca 0.01 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1wkd h LYS 360 Cb 0.86 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1wkd h LYS 360 CO 0.06 0.71 -0.06 0.82 -0.57 0.00 0.00 179.45 180.42 1wkd h ILE 361 N 0.93 1.28 -0.65 1.86 2.04 -1.22 -1.40 117.51 120.35 1wkd h ILE 361 Ca 0.23 -1.07 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1wkd h ILE 361 Cb 0.08 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 1wkd h ILE 361 CO -0.03 0.34 0.28 0.03 0.00 0.00 0.00 178.15 178.77 1wkd h ARG 362 N 0.29 0.95 -0.30 2.37 3.08 -0.76 -1.63 114.38 118.38 1wkd h ARG 362 Ca 0.07 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 1wkd h ARG 362 Cb 0.53 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1wkd h ARG 362 CO 0.03 0.78 -0.20 -0.44 -1.07 0.00 0.00 179.97 179.06 1wkd h ASP 363 N 0.90 0.70 -0.52 7.04 3.32 -1.02 -1.93 116.42 124.91 1wkd h ASP 363 Ca 0.22 -0.44 -0.05 0.00 0.02 0.00 0.00 57.03 56.78 1wkd h ASP 363 Cb 0.17 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1wkd h ASP 363 CO -0.02 0.99 0.15 0.77 -1.72 0.00 0.00 179.24 179.40 1wkd h SER 364 N 0.42 0.82 -0.12 6.45 4.64 -1.14 -1.74 113.55 122.88 1wkd h SER 364 Ca 0.06 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1wkd h SER 364 Cb 0.75 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1wkd h SER 364 CO 0.06 0.79 -0.02 0.40 -0.87 0.00 0.00 176.83 177.19 1wkd h ILE 365 N 0.84 1.28 -0.49 0.95 2.04 -1.21 0.52 117.51 121.45 1wkd h ILE 365 Ca 0.19 -0.94 0.11 0.00 1.00 0.00 0.00 64.86 65.22 1wkd h ILE 365 Cb 0.29 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 1wkd h ILE 365 CO -0.00 0.27 0.34 0.28 0.00 0.00 0.00 178.15 179.04 1wkd h SER 366 N -0.08 0.15 -0.12 1.72 0.02 -1.22 -1.50 113.55 112.51 1wkd h SER 366 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1wkd h SER 366 Cb 0.43 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1wkd h SER 366 CO 0.01 0.09 0.00 -0.62 -1.14 0.00 0.00 176.83 175.17 1wkd n GLU 367 N -4.44 2.01 -2.23 3.45 1.02 -0.67 -4.96 120.64 114.82 1wkd n GLU 367 Ca 0.08 -1.48 -0.13 0.00 -0.02 0.00 0.00 57.16 55.61 1wkd n GLU 367 Cb 0.45 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 30.40 1wkd n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wkd n GLY 368 N 1.27 -0.14 1.23 0.62 0.00 -0.38 -4.91 105.19 102.88 1wkd n GLY 368 Ca 0.17 -0.33 0.04 0.00 0.00 0.00 0.00 46.02 45.90 1wkd n GLY 368 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1wkd n ARG 369 N -2.27 0.72 -0.06 1.61 1.85 0.03 -4.85 116.66 113.69 1wkd n ARG 369 Ca -0.16 -2.58 -0.11 0.00 -1.00 0.00 0.00 57.85 54.01 1wkd n ARG 369 Cb 0.61 -0.70 0.03 0.00 -1.05 0.00 0.00 32.46 31.36 1wkd n ARG 369 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1wkd h PHE 370 N 1.08 0.92 -0.99 2.89 3.57 -1.84 -2.03 116.94 120.53 1wkd h PHE 370 Ca -0.13 -0.28 0.02 0.00 3.53 0.00 0.00 57.97 61.10 1wkd h PHE 370 Cb 1.54 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 40.04 1wkd h PHE 370 CO 0.42 1.05 0.66 1.03 -2.23 0.00 0.00 178.31 179.24 1wkd h SER 371 N 0.61 1.13 -0.01 0.41 0.87 -1.91 0.10 113.55 114.76 1wkd h SER 371 Ca 0.04 -0.03 -0.19 0.00 -1.23 0.00 0.00 61.79 60.39 1wkd h SER 371 Cb 0.98 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1wkd h SER 371 CO 0.09 0.81 -0.68 -0.61 -0.53 0.00 0.00 176.83 175.91 1wkd h GLN 372 N 1.33 0.64 -0.41 2.24 5.75 -1.91 -2.61 115.11 120.15 1wkd h GLN 372 Ca 0.37 -0.48 -0.01 0.00 -0.15 0.00 0.00 58.65 58.38 1wkd h GLN 372 Cb -0.13 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1wkd h GLN 372 CO -0.09 1.10 0.20 0.35 -2.65 0.00 0.00 178.83 177.74 1wkd h PHE 373 N 0.46 0.59 -0.77 3.99 3.57 -0.67 0.13 116.94 124.23 1wkd h PHE 373 Ca -0.02 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 1wkd h PHE 373 Cb 1.27 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.79 1wkd h PHE 373 CO 0.06 0.48 0.42 0.00 -2.23 0.00 0.00 178.31 177.05 1wkd h ALA 374 N 1.05 0.99 -0.09 2.41 0.00 -0.82 0.43 119.26 123.22 1wkd h ALA 374 Ca 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1wkd h ALA 374 Cb 0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1wkd h ALA 374 CO -0.02 0.51 0.04 0.37 0.00 0.00 0.00 179.25 180.15 1wkd h GLN 375 N 1.07 0.14 -0.42 0.00 4.15 -1.13 -1.40 115.11 117.53 1wkd h GLN 375 Ca 0.27 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.55 1wkd h GLN 375 Cb 0.04 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 1wkd h GLN 375 CO -0.04 0.25 -0.21 -0.44 -1.93 0.00 0.00 178.83 176.46 1wkd h ASP 376 N -0.01 0.84 0.14 -0.69 3.32 -0.51 -1.95 116.42 117.56 1wkd h ASP 376 Ca 0.03 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 56.79 1wkd h ASP 376 Cb 0.17 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1wkd h ASP 376 CO -0.00 1.03 -0.22 0.15 -1.72 0.00 0.00 179.24 178.48 1wkd h PHE 377 N 0.72 -0.57 -0.69 4.55 3.57 0.08 -2.10 116.94 122.50 1wkd h PHE 377 Ca 0.10 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1wkd h PHE 377 Cb 0.74 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 1wkd h PHE 377 CO 0.04 -0.31 0.33 0.00 -2.23 0.00 0.00 178.31 176.13 1wkd h ARG 378 N -0.42 0.98 -0.72 1.11 3.08 -1.21 -0.01 114.38 117.18 1wkd h ARG 378 Ca 0.02 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1wkd h ARG 378 Cb 0.43 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1wkd h ARG 378 CO -0.10 0.76 0.20 0.00 -1.07 0.00 0.00 179.97 179.76 1wkd h ALA 379 N 1.38 0.95 0.19 0.04 0.00 -1.01 -2.58 119.26 118.23 1wkd h ALA 379 Ca 0.24 -0.24 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1wkd h ALA 379 Cb 0.11 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1wkd h ALA 379 CO -0.03 0.65 -1.74 -0.09 0.00 0.00 0.00 179.25 178.04 1wkd h ARG 380 N 1.08 0.40 -0.07 0.00 2.43 -1.24 -3.35 114.38 113.63 1wkd h ARG 380 Ca 0.23 -0.68 -0.04 0.00 -0.81 0.00 0.00 59.98 58.69 1wkd h ARG 380 Cb 0.34 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1wkd h ARG 380 CO -0.00 1.32 -0.12 -0.92 -1.51 0.00 0.00 179.97 178.73 1wkd h TYR 381 N 0.11 0.11 -0.02 2.20 3.20 -0.92 -3.41 116.97 118.24 1wkd h TYR 381 Ca -0.34 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.52 1wkd h TYR 381 Cb 2.10 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 40.34 1wkd h TYR 381 CO 0.10 0.24 0.00 1.19 -1.64 0.00 0.00 178.16 178.05