#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pud s PRO 12 N 0.00 1.43 0.12 -0.14 0.04 -1.26 -4.56 135.00 130.63 1pud s PRO 12 Ca 0.00 0.78 -0.15 0.00 0.04 0.00 0.00 61.00 61.67 1pud s PRO 12 Cb 0.00 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.69 1pud s PRO 12 CO 0.00 -2.11 1.58 -0.09 0.04 0.00 0.00 177.00 176.41 1pud h ARG 13 N -1.45 0.68 -1.76 4.56 2.43 -1.86 -2.18 114.38 114.80 1pud h ARG 13 Ca -0.49 -0.21 0.07 0.00 -0.81 0.00 0.00 59.98 58.55 1pud h ARG 13 Cb 1.28 -0.07 -0.23 0.00 -0.42 0.00 0.00 29.97 30.54 1pud h ARG 13 CO 0.55 0.77 0.12 0.12 -1.51 0.00 0.00 179.97 180.02 1pud s PHE 14 N -5.05 -0.94 -0.17 2.20 5.36 -1.25 -4.12 117.98 114.01 1pud s PHE 14 Ca -0.13 1.80 -0.07 0.00 -0.96 0.00 0.00 56.93 57.57 1pud s PHE 14 Cb 0.10 0.56 0.08 0.00 -0.34 0.00 0.00 43.02 43.42 1pud s PHE 14 CO 0.79 -0.47 0.37 0.45 -1.46 0.00 0.00 175.22 174.90 1pud s SER 15 N 1.87 -0.13 -0.19 6.13 0.15 -0.49 -4.97 113.70 116.07 1pud s SER 15 Ca -0.08 0.85 -0.04 0.00 0.70 0.00 0.00 55.95 57.38 1pud s SER 15 Cb -0.06 1.04 -0.02 0.00 -1.71 0.00 0.00 66.02 65.28 1pud s SER 15 CO -0.18 -0.23 -0.05 0.12 1.20 0.00 0.00 173.24 174.11 1pud s PHE 16 N 2.32 2.96 -0.07 3.44 5.36 -1.26 -0.02 117.98 130.71 1pud s PHE 16 Ca -0.02 -0.67 0.04 0.00 -0.96 0.00 0.00 56.93 55.31 1pud s PHE 16 Cb -0.11 -2.04 0.00 0.00 -0.34 0.00 0.00 43.02 40.53 1pud s PHE 16 CO -0.11 -0.34 -0.19 -1.12 -1.46 0.00 0.00 175.22 171.99 1pud s SER 17 N 1.01 2.50 -0.31 6.13 0.01 -0.07 -4.99 113.70 117.99 1pud s SER 17 Ca 0.01 -0.43 -0.15 0.00 1.31 0.00 0.00 55.95 56.68 1pud s SER 17 Cb -0.15 -1.02 -0.02 0.00 0.21 0.00 0.00 66.02 65.04 1pud s SER 17 CO 0.00 0.13 0.38 -0.63 0.41 0.00 0.00 173.24 173.53 1pud s ILE 18 N 0.34 5.15 -0.01 1.44 1.01 -1.26 -1.04 121.20 126.83 1pud s ILE 18 Ca -0.13 0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.86 1pud s ILE 18 Cb -0.16 -3.77 -0.26 0.00 0.01 0.00 0.00 42.46 38.28 1pud s ILE 18 CO 0.06 0.02 0.79 0.00 0.00 0.00 0.00 174.94 175.80 1pud h ALA 19 N 8.32 0.38 -2.58 9.38 0.00 -0.86 -3.48 119.26 130.41 1pud h ALA 19 Ca -0.31 -1.19 -0.07 0.00 0.00 0.00 0.00 54.91 53.35 1pud h ALA 19 Cb 1.15 0.34 -0.16 0.00 0.00 0.00 0.00 17.79 19.13 1pud h ALA 19 CO 0.68 1.24 -0.06 0.00 0.00 0.00 0.00 179.25 181.10 1pud s ALA 20 N -2.61 -1.07 0.05 0.00 0.00 -0.97 -5.01 121.76 112.15 1pud s ALA 20 Ca -0.09 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.17 1pud s ALA 20 Cb 0.07 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 1pud s ALA 20 CO 0.84 -0.51 -0.06 1.03 0.00 0.00 0.00 175.76 177.06 1pud s ARG 21 N -2.77 0.58 -0.27 0.00 0.52 -1.26 -1.12 118.95 114.63 1pud s ARG 21 Ca -0.03 -0.98 -0.01 0.00 -0.52 0.00 0.00 55.73 54.19 1pud s ARG 21 Cb -0.00 -0.08 0.16 0.00 0.52 0.00 0.00 34.95 35.54 1pud s ARG 21 CO -0.04 -0.02 0.46 -2.00 0.02 0.00 0.00 175.30 173.71 1pud s GLU 22 N -2.65 0.43 6.91 3.54 2.12 -0.27 -4.90 118.70 123.88 1pud s GLU 22 Ca -0.02 0.58 0.00 0.00 0.36 0.00 0.00 54.97 55.89 1pud s GLU 22 Cb -0.02 -0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.24 1pud s GLU 22 CO -0.03 -0.74 0.00 0.41 -0.54 0.00 0.00 175.26 174.35 1pud n GLY 23 N 5.38 2.57 0.08 -1.50 0.00 -1.26 -1.32 105.19 109.15 1pud n GLY 23 Ca -0.02 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1pud n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pud h LYS 24 N 0.00 0.00 -6.99 1.61 1.57 -1.90 -3.46 116.57 107.39 1pud h LYS 24 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 1pud h LYS 24 Cb 0.00 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.35 1pud h LYS 24 CO 0.00 0.00 0.44 0.00 -0.57 0.00 0.00 179.45 179.32 1pud s ALA 25 N -3.16 3.02 0.06 3.86 0.00 -0.43 -3.46 121.76 121.65 1pud s ALA 25 Ca 0.07 0.78 -0.15 0.00 0.00 0.00 0.00 51.96 52.66 1pud s ALA 25 Cb 0.13 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.96 1pud s ALA 25 CO 0.69 -0.39 0.35 -0.98 0.00 0.00 0.00 175.76 175.42 1pud s ARG 26 N -2.66 0.90 0.01 0.00 3.03 -1.26 -1.11 118.95 117.86 1pud s ARG 26 Ca 0.61 -0.54 0.04 0.00 2.03 0.00 0.00 55.73 57.87 1pud s ARG 26 Cb -0.24 0.39 -0.01 0.00 -1.03 0.00 0.00 34.95 34.06 1pud s ARG 26 CO 0.29 -0.31 -0.12 -0.08 -1.13 0.00 0.00 175.30 173.96 1pud s THR 27 N -2.89 0.92 0.00 4.99 -1.32 -0.28 -4.20 115.64 112.86 1pud s THR 27 Ca -0.03 -0.69 0.00 0.00 -1.21 0.00 0.00 61.69 59.76 1pud s THR 27 Cb 0.00 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 1pud s THR 27 CO -0.05 0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.08 1pud n GLY 28 N 2.40 2.02 3.07 6.08 0.00 -0.76 -0.11 105.19 117.89 1pud n GLY 28 Ca -0.16 -0.49 -0.11 0.00 0.00 0.00 0.00 46.02 45.26 1pud n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pud s THR 29 N -1.63 0.07 -0.21 2.61 -4.23 -0.20 -0.89 115.64 111.15 1pud s THR 29 Ca 0.00 -0.59 -0.02 0.00 -1.18 0.00 0.00 61.69 59.90 1pud s THR 29 Cb 0.00 -0.37 0.01 0.00 1.34 0.00 0.00 72.50 73.48 1pud s THR 29 CO 0.00 -0.32 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.03 1pud s ILE 30 N -1.12 2.84 -0.17 2.99 1.01 0.63 -0.89 121.20 126.50 1pud s ILE 30 Ca -0.12 -0.75 -0.08 0.00 0.00 0.00 0.00 60.65 59.70 1pud s ILE 30 Cb -0.07 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 1pud s ILE 30 CO 0.01 0.42 0.12 -1.61 0.00 0.00 0.00 174.94 173.88 1pud s GLU 31 N 1.39 3.88 0.22 2.79 2.02 0.97 -0.14 118.70 129.83 1pud s GLU 31 Ca 0.04 -0.21 -0.00 0.00 0.02 0.00 0.00 54.97 54.82 1pud s GLU 31 Cb -0.14 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 1pud s GLU 31 CO -0.07 0.47 0.12 -1.64 0.02 0.00 0.00 175.26 174.16 1pud s MET 32 N -0.15 1.28 0.27 1.61 -1.94 -0.43 -1.40 119.30 118.53 1pud s MET 32 Ca 0.10 -1.68 -0.02 0.00 -1.71 0.00 0.00 55.69 52.38 1pud s MET 32 Cb -0.11 0.09 0.43 0.00 2.01 0.00 0.00 34.83 37.25 1pud s MET 32 CO 0.00 -0.36 1.87 0.87 -0.01 0.00 0.00 175.02 177.39 1pud h LYS 33 N 2.54 1.09 -0.00 2.03 1.57 -1.54 -2.47 116.57 119.79 1pud h LYS 33 Ca -0.37 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1pud h LYS 33 Cb 1.25 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1pud h LYS 33 CO 0.55 0.72 -0.16 0.54 -0.57 0.00 0.00 179.45 180.54 1pud n ARG 34 N -4.54 0.49 0.00 3.15 1.74 -1.26 -4.65 116.66 111.59 1pud n ARG 34 Ca 0.16 -0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1pud n ARG 34 Cb 0.22 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1pud n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pud n GLY 35 N 1.35 0.54 3.82 -0.13 0.00 -0.93 -4.23 105.19 105.61 1pud n GLY 35 Ca 0.12 -1.23 -0.36 0.00 0.00 0.00 0.00 46.02 44.55 1pud n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pud s VAL 36 N -1.99 5.10 -0.17 1.61 1.01 -1.26 -1.32 120.40 123.38 1pud s VAL 36 Ca 0.00 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1pud s VAL 36 Cb 0.00 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1pud s VAL 36 CO 0.00 0.58 -0.19 -0.63 0.00 0.00 0.00 175.10 174.86 1pud s ILE 37 N -1.02 2.18 -0.02 2.22 1.01 0.80 -4.89 121.20 121.49 1pud s ILE 37 Ca 0.16 -0.91 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 1pud s ILE 37 Cb -0.12 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1pud s ILE 37 CO 0.05 0.53 0.72 -0.13 0.00 0.00 0.00 174.94 176.12 1pud s ARG 38 N 1.19 4.45 0.11 2.79 0.52 -1.26 -0.27 118.95 126.47 1pud s ARG 38 Ca 0.02 0.95 0.10 0.00 -0.52 0.00 0.00 55.73 56.28 1pud s ARG 38 Cb -0.14 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.89 1pud s ARG 38 CO -0.09 0.18 -0.26 0.95 0.02 0.00 0.00 175.30 176.09 1pud s THR 39 N 0.38 2.31 0.34 0.02 -4.23 -0.07 -3.54 115.64 110.85 1pud s THR 39 Ca 0.38 -1.64 -0.29 0.00 -1.18 0.00 0.00 61.69 58.96 1pud s THR 39 Cb -0.19 -2.00 -0.11 0.00 1.34 0.00 0.00 72.50 71.54 1pud s THR 39 CO 0.20 0.15 1.53 -2.65 -0.54 0.00 0.00 174.62 173.31 1pud n PRO 40 N 1.09 2.67 -4.35 3.99 -0.02 -1.26 -1.83 135.00 135.30 1pud n PRO 40 Ca -0.17 0.94 -0.29 0.00 -2.02 0.00 0.00 63.50 61.96 1pud n PRO 40 Cb 0.53 -2.69 -0.12 0.00 -0.02 0.00 0.00 33.50 31.19 1pud n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pud s ALA 41 N -0.68 2.53 -0.12 3.55 0.00 0.12 -4.85 121.76 122.32 1pud s ALA 41 Ca 0.57 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1pud s ALA 41 Cb -0.49 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1pud s ALA 41 CO 0.58 0.56 -0.23 0.12 0.00 0.00 0.00 175.76 176.79 1pud s PHE 42 N -1.12 2.60 -0.28 0.00 5.36 -1.26 -1.25 117.98 122.03 1pud s PHE 42 Ca 0.16 -1.18 -0.08 0.00 -0.96 0.00 0.00 56.93 54.88 1pud s PHE 42 Cb -0.10 -1.75 -0.01 0.00 -0.34 0.00 0.00 43.02 40.81 1pud s PHE 42 CO 0.08 -0.50 0.09 -1.64 -1.46 0.00 0.00 175.22 171.79 1pud s MET 43 N 0.55 3.40 0.51 10.12 -1.94 0.35 -4.76 119.30 127.53 1pud s MET 43 Ca -0.14 -0.65 -0.21 0.00 -1.71 0.00 0.00 55.69 52.98 1pud s MET 43 Cb -0.17 -3.38 -0.06 0.00 2.01 0.00 0.00 34.83 33.23 1pud s MET 43 CO 0.04 -0.32 1.20 -2.14 -0.01 0.00 0.00 175.02 173.79 1pud s PRO 44 N 1.58 3.47 -0.19 2.03 0.02 -1.26 -3.81 135.00 136.84 1pud s PRO 44 Ca 0.05 1.83 -0.16 0.00 0.02 0.00 0.00 61.00 62.74 1pud s PRO 44 Cb -0.16 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 32.08 1pud s PRO 44 CO 0.04 -0.81 0.39 0.08 -0.33 0.00 0.00 177.00 176.37 1pud s VAL 45 N -1.55 5.21 -0.47 3.83 1.01 -1.26 -1.32 120.40 125.85 1pud s VAL 45 Ca 0.69 0.70 -0.09 0.00 0.00 0.00 0.00 61.98 63.27 1pud s VAL 45 Cb -0.30 -3.72 0.12 0.00 0.00 0.00 0.00 36.38 32.47 1pud s VAL 45 CO 0.35 0.27 0.34 -0.83 0.00 0.00 0.00 175.10 175.24 1pud s GLY 46 N 0.94 2.03 -0.01 4.51 0.00 0.15 -4.41 107.32 110.54 1pud s GLY 46 Ca 0.19 -2.50 -0.03 0.00 0.00 0.00 0.00 44.72 42.38 1pud s GLY 46 CO 0.08 1.10 0.43 -0.84 0.00 0.00 0.00 173.10 173.87 1pud h THR 47 N 6.12 0.00 -2.09 0.90 2.02 -1.77 -2.46 112.91 115.62 1pud h THR 47 Ca -0.22 -0.14 -0.76 0.00 0.77 0.00 0.00 66.41 66.06 1pud h THR 47 Cb 1.07 0.00 -0.29 0.00 -1.74 0.00 0.00 68.15 67.20 1pud h THR 47 CO 0.86 0.00 0.83 0.00 0.37 0.00 0.00 175.52 177.58 1pud n ALA 48 N -2.16 6.12 -2.72 6.16 0.00 -1.26 -4.00 120.51 122.65 1pud n ALA 48 Ca -0.01 -4.38 -0.17 0.00 0.00 0.00 0.00 53.44 48.87 1pud n ALA 48 Cb 0.05 -1.90 0.02 0.00 0.00 0.00 0.00 19.45 17.61 1pud n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pud n ALA 49 N -0.31 -0.69 -3.64 0.00 0.00 -1.26 -4.99 120.51 109.61 1pud n ALA 49 Ca 0.49 0.21 -0.10 0.00 0.00 0.00 0.00 53.44 54.03 1pud n ALA 49 Cb 0.28 -2.85 -0.07 0.00 0.00 0.00 0.00 19.45 16.81 1pud n ALA 49 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1pud s THR 50 N -2.99 0.00 -0.43 0.00 -1.32 -1.26 -4.73 115.64 104.91 1pud s THR 50 Ca 0.18 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.42 1pud s THR 50 Cb -0.08 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.93 1pud s THR 50 CO 0.22 0.00 0.85 -0.69 -2.21 0.00 0.00 174.62 172.79 1pud s VAL 51 N 0.76 4.60 -0.26 5.08 1.01 -1.26 -2.84 120.40 127.48 1pud s VAL 51 Ca -0.03 0.72 -0.24 0.00 0.00 0.00 0.00 61.98 62.44 1pud s VAL 51 Cb -0.05 -4.34 -0.10 0.00 0.00 0.00 0.00 36.38 31.89 1pud s VAL 51 CO -0.08 -0.68 0.93 1.17 0.00 0.00 0.00 175.10 176.44 1pud n LYS 52 N 6.82 0.00 -1.47 2.72 0.00 -1.26 -1.19 118.16 123.78 1pud n LYS 52 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 58.31 58.19 1pud n LYS 52 Cb 0.48 -0.77 -0.07 0.00 0.00 0.00 0.00 35.03 34.67 1pud n LYS 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1pud n ALA 53 N 2.75 -0.25 -2.71 3.14 0.00 -1.26 -4.96 120.51 117.22 1pud n ALA 53 Ca 0.21 0.26 -0.20 0.00 0.00 0.00 0.00 53.44 53.71 1pud n ALA 53 Cb -0.03 -1.82 -0.15 0.00 0.00 0.00 0.00 19.45 17.45 1pud n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1pud s LEU 54 N -3.68 1.98 0.48 0.00 1.43 -0.33 -4.66 118.68 113.90 1pud s LEU 54 Ca 0.00 -0.19 -0.19 0.00 -1.03 0.00 0.00 54.13 52.72 1pud s LEU 54 Cb 0.00 -0.54 -0.09 0.00 0.03 0.00 0.00 46.19 45.59 1pud s LEU 54 CO 0.00 0.12 0.99 -0.54 0.23 0.00 0.00 176.35 177.15 1pud s LYS 55 N -0.17 3.98 0.29 1.70 1.02 -1.26 -4.42 119.74 120.88 1pud s LYS 55 Ca 0.03 1.13 0.03 0.00 0.02 0.00 0.00 55.97 57.18 1pud s LYS 55 Cb -0.05 -2.14 0.62 0.00 -0.52 0.00 0.00 37.83 35.75 1pud s LYS 55 CO -0.00 -0.25 1.80 -1.35 -0.92 0.00 0.00 175.35 174.63 1pud h PRO 56 N 1.43 0.83 -0.37 -1.68 0.11 -1.85 0.40 132.00 130.87 1pud h PRO 56 Ca -0.48 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1pud h PRO 56 Cb 1.19 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1pud h PRO 56 CO 0.60 0.55 0.19 1.05 -0.21 0.00 0.00 178.00 180.18 1pud h GLU 57 N 0.86 0.51 -0.07 1.05 4.11 -1.92 -0.06 114.58 119.05 1pud h GLU 57 Ca 0.53 -0.05 -0.18 0.00 0.07 0.00 0.00 59.36 59.72 1pud h GLU 57 Cb 0.68 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1pud h GLU 57 CO -0.32 0.39 -0.73 1.15 0.07 0.00 0.00 179.01 179.56 1pud h THR 58 N 0.51 1.38 -0.37 -1.06 2.02 -1.31 -0.19 112.91 113.89 1pud h THR 58 Ca 0.13 -2.15 -0.06 0.00 0.77 0.00 0.00 66.41 65.10 1pud h THR 58 Cb 0.04 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 1pud h THR 58 CO -0.02 0.65 0.01 0.58 0.37 0.00 0.00 175.52 177.10 1pud h VAL 59 N 0.27 1.26 -0.73 3.16 2.07 -0.69 -2.42 116.25 119.17 1pud h VAL 59 Ca -0.03 -0.97 -0.05 0.00 0.82 0.00 0.00 66.70 66.47 1pud h VAL 59 Cb 1.31 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 1pud h VAL 59 CO 0.13 0.33 0.26 -0.09 0.02 0.00 0.00 177.57 178.21 1pud h ARG 60 N 0.47 1.11 -0.29 1.57 9.65 -0.92 -2.54 114.38 123.43 1pud h ARG 60 Ca 0.11 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 58.81 1pud h ARG 60 Cb 0.45 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 1pud h ARG 60 CO 0.02 0.92 0.20 0.00 2.80 0.00 0.00 179.97 183.91 1pud h ALA 61 N 1.21 1.97 0.00 2.80 0.00 -0.68 0.20 119.26 124.76 1pud h ALA 61 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1pud h ALA 61 Cb 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1pud h ALA 61 CO -0.01 -0.01 0.00 0.25 0.00 0.00 0.00 179.25 179.47 1pud n THR 62 N -4.49 0.75 0.00 0.00 -2.24 -0.94 -4.88 114.28 102.48 1pud n THR 62 Ca 0.03 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1pud n THR 62 Cb 0.19 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 1pud n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pud n GLY 63 N 0.40 0.96 3.73 3.38 0.00 0.06 -4.69 105.19 109.02 1pud n GLY 63 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1pud n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pud s ALA 64 N -2.00 3.57 -0.09 4.61 0.00 -1.20 -4.92 121.76 121.73 1pud s ALA 64 Ca 0.00 1.15 0.21 0.00 0.00 0.00 0.00 51.96 53.32 1pud s ALA 64 Cb 0.00 -3.52 -0.27 0.00 0.00 0.00 0.00 23.12 19.34 1pud s ALA 64 CO 0.00 -0.60 0.53 -0.25 0.00 0.00 0.00 175.76 175.44 1pud n ASP 65 N 3.22 0.18 -3.67 0.00 8.00 -1.26 -4.61 116.55 118.41 1pud n ASP 65 Ca 0.09 0.07 -0.15 0.00 0.71 0.00 0.00 54.79 55.51 1pud n ASP 65 Cb 0.42 1.53 -0.08 0.00 -0.02 0.00 0.00 41.12 42.98 1pud n ASP 65 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1pud s ILE 66 N -3.33 0.03 0.25 0.53 2.07 -1.26 -4.17 121.20 115.32 1pud s ILE 66 Ca -0.07 -0.28 0.08 0.00 -1.41 0.00 0.00 60.65 58.97 1pud s ILE 66 Cb 0.12 -0.77 -0.05 0.00 0.13 0.00 0.00 42.46 41.89 1pud s ILE 66 CO 0.88 -0.15 -0.11 0.27 -1.91 0.00 0.00 174.94 173.91 1pud s ILE 67 N -1.22 1.80 -0.10 2.00 -4.36 -1.16 -4.01 121.20 114.14 1pud s ILE 67 Ca -0.12 -2.20 -0.03 0.00 -0.26 0.00 0.00 60.65 58.04 1pud s ILE 67 Cb -0.03 -2.25 -0.03 0.00 1.25 0.00 0.00 42.46 41.39 1pud s ILE 67 CO 0.06 -0.45 0.02 -0.22 0.24 0.00 0.00 174.94 174.60 1pud s LEU 68 N -3.40 3.68 -0.13 0.37 0.20 -0.43 -1.19 118.68 117.78 1pud s LEU 68 Ca 0.26 0.17 -0.01 0.00 0.69 0.00 0.00 54.13 55.25 1pud s LEU 68 Cb 0.01 -1.86 -0.02 0.00 -0.43 0.00 0.00 46.19 43.89 1pud s LEU 68 CO 0.10 0.37 -0.09 -0.83 -0.29 0.00 0.00 176.35 175.60 1pud s GLY 69 N -0.80 1.62 -0.54 7.98 0.00 0.10 0.32 107.32 115.99 1pud s GLY 69 Ca 0.12 -0.87 -0.25 0.00 0.00 0.00 0.00 44.72 43.72 1pud s GLY 69 CO 0.02 -0.23 1.00 -1.31 0.00 0.00 0.00 173.10 172.59 1pud s ASN 70 N 0.18 6.40 0.31 1.64 0.02 -0.93 -2.51 114.94 120.05 1pud s ASN 70 Ca -0.05 -0.15 -0.00 0.00 -1.02 0.00 0.00 52.86 51.63 1pud s ASN 70 Cb -0.15 -2.47 0.49 0.00 0.02 0.00 0.00 41.25 39.15 1pud s ASN 70 CO 0.04 -1.26 1.92 0.74 0.02 0.00 0.00 177.10 178.57 1pud h THR 71 N 6.07 1.20 0.09 1.60 2.02 -1.89 -2.83 112.91 119.17 1pud h THR 71 Ca -0.25 -0.55 0.02 0.00 0.77 0.00 0.00 66.41 66.40 1pud h THR 71 Cb 1.07 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 1pud h THR 71 CO 1.10 0.23 -0.26 0.22 0.37 0.00 0.00 175.52 177.19 1pud h TYR 72 N 0.89 -0.69 -0.28 3.16 3.20 -1.87 -0.61 116.97 120.77 1pud h TYR 72 Ca 0.22 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1pud h TYR 72 Cb 0.07 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1pud h TYR 72 CO 0.01 -0.36 0.15 0.45 -1.64 0.00 0.00 178.16 176.78 1pud h HIS 73 N -0.45 0.38 -0.26 -3.82 3.86 -1.84 -3.03 115.15 110.00 1pud h HIS 73 Ca 0.04 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1pud h HIS 73 Cb 0.49 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 1pud h HIS 73 CO -0.25 0.31 -0.03 -0.07 0.86 0.00 0.00 177.93 178.75 1pud h LEU 74 N 0.34 0.37 -1.13 2.43 3.38 -1.31 -0.05 115.31 119.34 1pud h LEU 74 Ca 0.10 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1pud h LEU 74 Cb 0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1pud h LEU 74 CO -0.02 0.46 -0.25 0.00 0.09 0.00 0.00 178.44 178.72 1pud h MET 75 N 0.38 0.00 0.00 1.13 -0.00 -0.99 0.12 114.93 115.57 1pud h MET 75 Ca 0.08 0.00 -0.10 0.00 -0.00 0.00 0.00 59.70 59.68 1pud h MET 75 Cb 0.31 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.90 1pud h MET 75 CO 0.01 0.25 -0.63 -0.07 -0.00 0.00 0.00 176.91 176.47 1pud h LEU 76 N 0.00 0.00 -7.44 -0.10 3.38 -1.34 -3.36 115.31 106.46 1pud h LEU 76 Ca -0.00 -0.54 -0.38 0.00 0.09 0.00 0.00 57.88 57.05 1pud h LEU 76 Cb 0.75 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.13 1pud h LEU 76 CO 0.03 1.13 -0.75 -0.13 0.09 0.00 0.00 178.44 178.81 1pud s ARG 77 N -2.22 0.22 0.00 1.13 0.52 -0.08 -3.95 118.95 114.58 1pud s ARG 77 Ca -0.21 0.22 0.22 0.00 -0.52 0.00 0.00 55.73 55.44 1pud s ARG 77 Cb 0.02 -0.64 0.85 0.00 0.52 0.00 0.00 34.95 35.71 1pud s ARG 77 CO 0.51 -0.27 1.61 -0.35 0.02 0.00 0.00 175.30 176.81 1pud n PRO 78 N 4.95 1.61 0.00 3.54 -0.04 -1.22 -3.84 135.00 139.99 1pud n PRO 78 Ca -0.11 -0.91 0.00 0.00 -0.04 0.00 0.00 63.50 62.44 1pud n PRO 78 Cb 0.50 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 1pud n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pud n GLY 79 N 1.09 2.38 0.34 0.55 0.00 0.41 -4.59 105.19 105.36 1pud n GLY 79 Ca 0.16 -1.44 -0.03 0.00 0.00 0.00 0.00 46.02 44.71 1pud n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pud h ALA 80 N 0.00 1.13 -0.75 4.61 0.00 -1.73 -2.07 119.26 120.45 1pud h ALA 80 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1pud h ALA 80 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 1pud h ALA 80 CO 0.00 0.55 0.39 0.93 0.00 0.00 0.00 179.25 181.12 1pud h GLU 81 N 1.21 1.05 -0.40 0.00 3.07 -1.93 -1.33 114.58 116.26 1pud h GLU 81 Ca 0.32 -0.14 -0.07 0.00 -0.50 0.00 0.00 59.36 58.98 1pud h GLU 81 Cb -0.11 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.59 1pud h GLU 81 CO -0.07 0.80 -0.02 -0.09 -1.40 0.00 0.00 179.01 178.24 1pud h ARG 82 N 1.04 0.71 -0.70 2.33 2.43 -1.72 -1.51 114.38 116.95 1pud h ARG 82 Ca 0.26 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1pud h ARG 82 Cb 0.07 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1pud h ARG 82 CO -0.04 0.81 0.43 0.82 -1.51 0.00 0.00 179.97 180.48 1pud h ILE 83 N 0.53 1.20 -0.36 1.20 2.04 -1.17 0.63 117.51 121.58 1pud h ILE 83 Ca 0.11 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 1pud h ILE 83 Cb 0.50 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1pud h ILE 83 CO 0.02 0.20 0.22 0.00 0.00 0.00 0.00 178.15 178.59 1pud h ALA 84 N 1.23 0.46 -0.56 1.87 0.00 -1.09 0.14 119.26 121.31 1pud h ALA 84 Ca 0.25 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1pud h ALA 84 Cb -0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1pud h ALA 84 CO -0.05 -0.05 0.37 -0.22 0.00 0.00 0.00 179.25 179.30 1pud h LYS 85 N 0.47 0.72 0.00 0.00 3.64 -0.72 -1.17 116.57 119.51 1pud h LYS 85 Ca 0.13 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1pud h LYS 85 Cb -0.00 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1pud h LYS 85 CO -0.02 0.47 0.00 1.28 -2.27 0.00 0.00 179.45 178.91 1pud n LEU 86 N -4.46 0.00 0.00 5.20 4.32 0.16 -4.88 117.00 117.35 1pud n LEU 86 Ca 0.06 0.21 0.00 0.00 -0.02 0.00 0.00 56.01 56.26 1pud n LEU 86 Cb 0.06 -0.21 0.00 0.00 -1.62 0.00 0.00 43.42 41.65 1pud n LEU 86 CO 0.35 -0.01 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 1pud n GLY 87 N 1.07 1.04 0.00 -0.72 0.00 -0.44 -4.73 105.19 101.42 1pud n GLY 87 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1pud n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pud n GLY 88 N -0.43 1.81 0.27 -0.02 0.00 -0.04 -4.43 105.19 102.35 1pud n GLY 88 Ca 0.00 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.09 1pud n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pud h LEU 89 N 0.00 0.75 0.23 0.99 5.85 -1.09 -1.65 115.31 120.40 1pud h LEU 89 Ca 0.00 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1pud h LEU 89 Cb 0.00 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1pud h LEU 89 CO 0.00 0.53 -0.36 0.45 -0.34 0.00 0.00 178.44 178.72 1pud h HIS 90 N 0.89 -0.98 -0.34 1.25 3.86 -1.78 -0.59 115.15 117.46 1pud h HIS 90 Ca 0.27 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.43 1pud h HIS 90 Cb -0.02 0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.83 1pud h HIS 90 CO -0.04 -0.48 -0.07 1.03 0.86 0.00 0.00 177.93 179.23 1pud h SER 91 N -0.66 0.53 0.47 2.45 0.87 -1.76 0.74 113.55 116.19 1pud h SER 91 Ca 0.00 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.41 1pud h SER 91 Cb 0.64 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1pud h SER 91 CO -0.14 0.66 -0.22 0.15 -0.53 0.00 0.00 176.83 176.74 1pud h PHE 92 N 0.52 -0.58 0.00 2.24 3.57 -0.85 -3.25 116.94 118.59 1pud h PHE 92 Ca 0.10 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1pud h PHE 92 Cb 0.45 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1pud h PHE 92 CO 0.02 -0.33 -0.53 0.00 -2.23 0.00 0.00 178.31 175.24 1pud n MET 93 N -5.34 0.03 -1.26 1.11 0.00 -0.27 -4.97 117.12 106.43 1pud n MET 93 Ca -0.11 0.01 0.00 0.00 0.00 0.00 0.00 57.70 57.59 1pud n MET 93 Cb 0.28 -1.52 0.00 0.00 0.00 0.00 0.00 33.22 31.98 1pud n MET 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1pud n GLY 94 N 1.48 0.64 3.26 3.17 0.00 0.19 -4.76 105.19 109.18 1pud n GLY 94 Ca 0.05 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 1pud n GLY 94 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1pud s TRP 95 N -2.00 3.05 -2.75 1.61 -0.11 -0.84 -4.75 118.94 113.15 1pud s TRP 95 Ca 0.00 -1.26 0.24 0.00 1.22 0.00 0.00 56.10 56.30 1pud s TRP 95 Cb 0.00 -2.11 0.41 0.00 -1.50 0.00 0.00 33.47 30.27 1pud s TRP 95 CO 0.00 -0.65 1.38 -0.40 -4.62 0.00 0.00 176.95 172.67 1pud n ASP 96 N 4.75 2.82 -4.82 5.86 5.75 -1.26 -4.41 116.55 125.24 1pud n ASP 96 Ca -0.17 -1.91 -0.22 0.00 -0.01 0.00 0.00 54.79 52.49 1pud n ASP 96 Cb 0.48 -0.07 0.09 0.00 -1.03 0.00 0.00 41.12 40.59 1pud n ASP 96 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1pud s ARG 97 N -1.86 1.95 0.67 0.11 0.52 -1.26 -4.89 118.95 114.19 1pud s ARG 97 Ca 0.32 -1.29 -0.17 0.00 -0.52 0.00 0.00 55.73 54.07 1pud s ARG 97 Cb 0.21 -2.46 -0.00 0.00 0.52 0.00 0.00 34.95 33.22 1pud s ARG 97 CO 0.31 -1.19 1.23 -0.35 0.02 0.00 0.00 175.30 175.32 1pud n PRO 98 N -2.59 0.96 -4.28 3.54 -0.04 -1.26 -4.95 135.00 126.38 1pud n PRO 98 Ca 0.15 0.39 -0.21 0.00 -0.04 0.00 0.00 63.50 63.79 1pud n PRO 98 Cb 0.61 -2.47 -0.16 0.00 -0.04 0.00 0.00 33.50 31.44 1pud n PRO 98 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1pud s ILE 99 N -1.50 0.67 -0.14 0.52 1.01 -1.26 -2.99 121.20 117.51 1pud s ILE 99 Ca 0.81 -0.23 -0.05 0.00 0.00 0.00 0.00 60.65 61.18 1pud s ILE 99 Cb -0.37 -0.65 -0.04 0.00 0.01 0.00 0.00 42.46 41.41 1pud s ILE 99 CO 0.42 0.24 0.04 -0.22 0.00 0.00 0.00 174.94 175.43 1pud s LEU 100 N 0.70 3.72 -0.04 2.97 0.20 -0.33 -0.96 118.68 124.94 1pud s LEU 100 Ca -0.11 0.11 0.04 0.00 0.69 0.00 0.00 54.13 54.87 1pud s LEU 100 Cb -0.13 -1.91 -0.03 0.00 -0.43 0.00 0.00 46.19 43.69 1pud s LEU 100 CO 0.01 0.26 -0.15 0.42 -0.29 0.00 0.00 176.35 176.59 1pud s THR 101 N -0.14 2.96 1.01 3.68 -4.23 -0.63 0.02 115.64 118.31 1pud s THR 101 Ca 0.06 -0.79 -0.17 0.00 -1.18 0.00 0.00 61.69 59.61 1pud s THR 101 Cb -0.12 -2.16 0.23 0.00 1.34 0.00 0.00 72.50 71.79 1pud s THR 101 CO 0.02 0.57 1.32 1.51 -0.54 0.00 0.00 174.62 177.49 1pud s ASP 102 N -0.78 2.66 0.28 3.99 1.47 -1.05 -3.11 116.67 120.13 1pud s ASP 102 Ca 0.12 0.23 0.17 0.00 1.18 0.00 0.00 52.55 54.25 1pud s ASP 102 Cb -0.11 -0.23 0.09 0.00 -0.34 0.00 0.00 42.92 42.34 1pud s ASP 102 CO 0.01 -3.01 1.37 0.77 0.68 0.00 0.00 175.17 174.99 1pud h SER 103 N -1.84 0.00 0.00 2.11 4.64 -1.84 -3.39 113.55 113.23 1pud h SER 103 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1pud h SER 103 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1pud h SER 103 CO 0.33 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 1pud n GLY 104 N 1.22 2.89 0.25 -0.77 0.00 -1.26 -4.80 105.19 102.71 1pud n GLY 104 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1pud n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1pud h GLY 105 N 0.00 0.87 0.84 -0.02 0.00 -1.92 -2.19 103.07 100.66 1pud h GLY 105 Ca 0.00 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 46.93 1pud h GLY 105 CO 0.00 0.40 0.03 -0.97 0.00 0.00 0.00 176.54 176.00 1pud h TYR 106 N 0.77 0.05 0.00 5.60 -1.99 -1.92 -2.41 116.97 117.07 1pud h TYR 106 Ca 0.20 0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.87 1pud h TYR 106 Cb 0.09 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.81 1pud h TYR 106 CO -0.01 0.02 -0.31 1.96 -0.00 0.00 0.00 178.16 179.82 1pud h GLN 107 N 0.09 0.00 -0.07 4.88 4.20 -1.97 -2.82 115.11 119.42 1pud h GLN 107 Ca 0.06 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 1pud h GLN 107 Cb 0.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1pud h GLN 107 CO -0.08 0.31 0.02 0.28 -0.67 0.00 0.00 178.83 178.69 1pud h VAL 108 N 0.00 1.15 0.00 -0.54 2.07 -0.94 0.27 116.25 118.25 1pud h VAL 108 Ca -0.00 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1pud h VAL 108 Cb 0.78 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1pud h VAL 108 CO 0.04 0.12 0.00 0.80 0.02 0.00 0.00 177.57 178.55 1pud n MET 109 N -4.95 0.02 -0.04 1.57 0.00 -0.95 -1.61 117.12 111.17 1pud n MET 109 Ca -0.06 0.24 -0.04 0.00 -0.00 0.00 0.00 57.70 57.84 1pud n MET 109 Cb 0.11 -1.50 -0.07 0.00 0.00 0.00 0.00 33.22 31.76 1pud n MET 109 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1pud n SER 110 N -1.48 2.82 0.00 6.12 7.64 -0.94 -4.79 113.62 122.99 1pud n SER 110 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1pud n SER 110 Cb 0.16 0.78 0.00 0.00 -1.01 0.00 0.00 64.21 64.14 1pud n SER 110 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1pud n LEU 111 N -2.29 0.59 -4.90 -3.43 4.77 0.89 -5.06 117.00 107.57 1pud n LEU 111 Ca -0.13 -0.75 -0.30 0.00 -0.03 0.00 0.00 56.01 54.79 1pud n LEU 111 Cb 0.74 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.79 1pud n LEU 111 CO 0.19 0.15 0.14 -0.44 -1.33 0.00 0.00 177.39 176.10 1pud s SER 112 N -0.34 6.48 0.12 -1.43 0.01 -0.63 -4.30 113.70 113.62 1pud s SER 112 Ca 0.00 0.68 -0.11 0.00 1.31 0.00 0.00 55.95 57.83 1pud s SER 112 Cb 0.00 -2.13 -0.06 0.00 0.21 0.00 0.00 66.02 64.04 1pud s SER 112 CO 0.00 -0.09 0.47 -0.55 0.41 0.00 0.00 173.24 173.48 1pud s SER 113 N -2.83 6.70 -0.86 2.44 0.15 -0.68 -4.60 113.70 114.02 1pud s SER 113 Ca 0.43 0.90 -0.03 0.00 0.70 0.00 0.00 55.95 57.95 1pud s SER 113 Cb -0.11 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 1pud s SER 113 CO 0.27 0.11 0.61 0.18 1.20 0.00 0.00 173.24 175.61 1pud n LEU 114 N 0.71 -1.80 -4.77 3.45 4.77 -1.26 -0.77 117.00 117.34 1pud n LEU 114 Ca -0.06 -0.99 -0.39 0.00 -0.03 0.00 0.00 56.01 54.55 1pud n LEU 114 Cb 0.52 -1.64 -0.04 0.00 -2.33 0.00 0.00 43.42 39.93 1pud n LEU 114 CO 0.43 0.41 0.76 0.28 -1.33 0.00 0.00 177.39 177.93 1pud s THR 115 N -3.03 3.64 -0.23 -5.08 -1.32 -1.26 -4.30 115.64 104.04 1pud s THR 115 Ca 0.04 1.46 -0.00 0.00 -1.21 0.00 0.00 61.69 61.98 1pud s THR 115 Cb -0.02 -3.86 0.06 0.00 -1.51 0.00 0.00 72.50 67.17 1pud s THR 115 CO 0.90 0.21 -0.02 -0.75 -2.21 0.00 0.00 174.62 172.75 1pud s LYS 116 N -1.90 1.36 0.08 7.08 2.20 0.13 -4.96 119.74 123.72 1pud s LYS 116 Ca 0.50 -0.91 -0.22 0.00 -0.36 0.00 0.00 55.97 54.99 1pud s LYS 116 Cb -0.27 -2.47 -0.07 0.00 -1.51 0.00 0.00 37.83 33.51 1pud s LYS 116 CO 0.34 -0.64 0.65 -0.65 -0.36 0.00 0.00 175.35 174.69 1pud s GLN 117 N 1.49 4.35 0.24 4.03 -1.52 -1.26 -1.15 119.66 125.84 1pud s GLN 117 Ca -0.03 0.88 -0.19 0.00 -1.95 0.00 0.00 55.36 54.07 1pud s GLN 117 Cb -0.18 -3.28 0.02 0.00 -0.22 0.00 0.00 33.01 29.35 1pud s GLN 117 CO -0.08 0.53 0.63 -1.54 -0.25 0.00 0.00 175.29 174.58 1pud s SER 118 N -0.83 -0.27 0.48 5.90 1.04 -0.46 -5.02 113.70 114.55 1pud s SER 118 Ca 0.32 -0.57 0.22 0.00 0.48 0.00 0.00 55.95 56.40 1pud s SER 118 Cb -0.20 0.66 1.22 0.00 0.10 0.00 0.00 66.02 67.80 1pud s SER 118 CO 0.21 -1.21 2.01 -0.08 0.98 0.00 0.00 173.24 175.15 1pud h GLU 119 N 2.08 0.00 0.00 4.02 4.57 -2.02 -2.49 114.58 120.74 1pud h GLU 119 Ca -0.24 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 57.78 1pud h GLU 119 Cb 1.26 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 1pud h GLU 119 CO 0.30 0.17 -0.76 1.49 -1.18 0.00 0.00 179.01 179.03 1pud h GLU 120 N 0.00 0.00 0.00 1.92 4.81 -1.98 -3.50 114.58 115.84 1pud h GLU 120 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1pud h GLU 120 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1pud h GLU 120 CO 0.02 0.76 0.00 0.41 -0.73 0.00 0.00 179.01 179.47 1pud n GLY 121 N 0.85 -0.32 2.99 1.92 0.00 -0.94 -4.44 105.19 105.25 1pud n GLY 121 Ca -0.00 -0.85 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 1pud n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pud s VAL 122 N -4.00 0.75 -0.04 1.61 0.11 0.09 -1.36 120.40 117.57 1pud s VAL 122 Ca 0.00 -0.34 -0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1pud s VAL 122 Cb 0.00 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1pud s VAL 122 CO 0.00 0.24 0.01 -0.89 -3.33 0.00 0.00 175.10 171.13 1pud s THR 123 N 0.23 4.28 0.29 5.04 2.01 -0.30 -0.88 115.64 126.31 1pud s THR 123 Ca -0.04 -0.43 -0.16 0.00 0.31 0.00 0.00 61.69 61.37 1pud s THR 123 Cb -0.09 -2.87 0.02 0.00 0.01 0.00 0.00 72.50 69.57 1pud s THR 123 CO 0.00 0.47 0.64 0.72 -0.69 0.00 0.00 174.62 175.77 1pud s PHE 124 N -1.01 0.11 -0.18 4.92 -0.71 -0.54 0.18 117.98 120.74 1pud s PHE 124 Ca 0.17 -0.56 -0.03 0.00 -1.04 0.00 0.00 56.93 55.46 1pud s PHE 124 Cb -0.11 0.53 -0.02 0.00 -1.21 0.00 0.00 43.02 42.20 1pud s PHE 124 CO 0.07 -1.22 -0.04 0.15 -1.34 0.00 0.00 175.22 172.84 1pud s LYS 125 N -3.61 3.53 0.40 1.99 1.02 0.05 -4.19 119.74 118.93 1pud s LYS 125 Ca 0.16 -0.58 -0.27 0.00 0.02 0.00 0.00 55.97 55.31 1pud s LYS 125 Cb -0.04 -2.94 -0.10 0.00 -0.52 0.00 0.00 37.83 34.23 1pud s LYS 125 CO 0.09 0.05 1.39 0.45 -0.92 0.00 0.00 175.35 176.42 1pud n SER 126 N 4.08 3.24 -0.47 2.83 2.88 -1.20 -1.68 113.62 123.30 1pud n SER 126 Ca -0.18 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 1pud n SER 126 Cb 0.52 -1.57 0.00 0.00 -0.75 0.00 0.00 64.21 62.41 1pud n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pud n HIS 127 N 0.10 0.00 -0.01 0.66 1.44 -1.26 -3.76 115.22 112.39 1pud n HIS 127 Ca 0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.75 1pud n HIS 127 Cb 0.39 -0.09 0.00 0.00 0.12 0.00 0.00 29.99 30.42 1pud n HIS 127 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1pud n LEU 128 N 0.01 0.00 0.00 2.39 -0.00 -1.26 -5.06 117.00 113.08 1pud n LEU 128 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1pud n LEU 128 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.63 1pud n LEU 128 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 177.39 176.72 1pud n ASP 129 N 0.00 0.00 0.00 1.45 2.03 -1.25 -5.11 116.55 113.68 1pud n ASP 129 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1pud n ASP 129 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1pud n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pud n GLY 130 N 0.00 0.97 2.67 0.27 0.00 -1.26 -4.82 105.19 103.02 1pud n GLY 130 Ca 0.00 -1.18 -0.05 0.00 0.00 0.00 0.00 46.02 44.79 1pud n GLY 130 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pud n SER 131 N 1.37 -1.46 -4.51 1.61 2.88 -1.26 -3.21 113.62 109.04 1pud n SER 131 Ca 0.00 -1.96 -0.49 0.00 -1.33 0.00 0.00 58.87 55.08 1pud n SER 131 Cb 0.00 0.88 -0.06 0.00 -0.75 0.00 0.00 64.21 64.28 1pud n SER 131 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1pud n ARG 132 N 1.41 1.37 -0.00 -1.46 3.00 -1.26 -4.29 116.66 115.42 1pud n ARG 132 Ca 0.01 0.40 0.07 0.00 -0.01 0.00 0.00 57.85 58.32 1pud n ARG 132 Cb 0.70 -2.62 -0.10 0.00 0.00 0.00 0.00 32.46 30.44 1pud n ARG 132 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.63 175.24 1pud n HIS 133 N 9.74 0.00 -4.61 -1.55 1.44 -1.26 -4.23 115.22 114.75 1pud n HIS 133 Ca 0.37 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.83 1pud n HIS 133 Cb 0.28 -0.14 -0.16 0.00 0.12 0.00 0.00 29.99 30.08 1pud n HIS 133 CO 0.00 0.00 0.00 1.41 -2.81 0.00 0.00 176.34 174.94 1pud s MET 134 N -2.67 1.70 -0.15 -1.40 0.00 -1.26 -1.46 119.30 114.05 1pud s MET 134 Ca 0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 55.69 55.23 1pud s MET 134 Cb 0.11 -1.41 0.05 0.00 0.00 0.00 0.00 34.83 33.58 1pud s MET 134 CO 0.62 0.06 0.06 -1.17 0.00 0.00 0.00 175.02 174.59 1pud s LEU 135 N 0.57 0.55 0.35 4.11 2.96 -0.06 -4.96 118.68 122.20 1pud s LEU 135 Ca -0.13 -0.51 0.06 0.00 -0.22 0.00 0.00 54.13 53.32 1pud s LEU 135 Cb -0.15 -0.33 -0.07 0.00 0.50 0.00 0.00 46.19 46.14 1pud s LEU 135 CO 0.04 -0.31 0.01 -0.94 -1.32 0.00 0.00 176.35 173.83 1pud s SER 136 N 2.06 3.09 0.21 3.68 1.04 -1.26 -0.73 113.70 121.79 1pud s SER 136 Ca 0.02 -1.33 -0.11 0.00 0.48 0.00 0.00 55.95 55.01 1pud s SER 136 Cb -0.15 -0.23 0.28 0.00 0.10 0.00 0.00 66.02 66.01 1pud s SER 136 CO -0.08 -0.48 1.68 -0.65 0.98 0.00 0.00 173.24 174.70 1pud h PRO 137 N 2.01 0.17 -0.02 4.02 0.11 -1.90 0.11 132.00 136.50 1pud h PRO 137 Ca -0.42 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.55 1pud h PRO 137 Cb 1.24 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1pud h PRO 137 CO 0.74 0.11 -0.62 1.05 -0.21 0.00 0.00 178.00 179.07 1pud h GLU 138 N 0.18 0.06 -0.15 1.05 9.09 -1.93 -2.14 114.58 120.73 1pud h GLU 138 Ca 0.31 -0.04 -0.18 0.00 0.05 0.00 0.00 59.36 59.49 1pud h GLU 138 Cb 0.48 0.01 -0.00 0.00 -1.65 0.00 0.00 28.75 27.58 1pud h GLU 138 CO -0.45 0.65 -0.65 -0.09 0.05 0.00 0.00 179.01 178.52 1pud h ARG 139 N 0.04 0.58 -0.14 1.06 9.65 -1.75 -1.71 114.38 122.10 1pud h ARG 139 Ca -0.01 -0.42 -0.00 0.00 -1.10 0.00 0.00 59.98 58.45 1pud h ARG 139 Cb 1.10 0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.74 1pud h ARG 139 CO 0.08 1.04 0.07 1.03 2.80 0.00 0.00 179.97 184.99 1pud h SER 140 N 0.42 0.18 -0.72 -3.80 0.87 -0.68 0.16 113.55 109.99 1pud h SER 140 Ca -0.02 -0.12 -0.04 0.00 -1.23 0.00 0.00 61.79 60.39 1pud h SER 140 Cb 1.23 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1pud h SER 140 CO 0.12 0.25 0.31 0.40 -0.53 0.00 0.00 176.83 177.38 1pud h ILE 141 N 0.10 1.24 -0.45 2.23 1.08 -1.36 -1.18 117.51 119.18 1pud h ILE 141 Ca 0.05 -0.75 -0.03 0.00 -0.39 0.00 0.00 64.86 63.74 1pud h ILE 141 Cb 0.11 0.35 -0.02 0.00 -3.07 0.00 0.00 36.82 34.20 1pud h ILE 141 CO -0.01 0.31 0.18 -0.08 -0.69 0.00 0.00 178.15 177.86 1pud h GLU 142 N 1.06 0.67 -0.20 2.37 4.81 -0.96 -0.19 114.58 122.14 1pud h GLU 142 Ca 0.25 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1pud h GLU 142 Cb 0.18 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1pud h GLU 142 CO -0.02 0.62 0.11 0.82 -0.73 0.00 0.00 179.01 179.80 1pud h ILE 143 N 0.58 1.11 -0.12 2.32 2.04 -0.65 0.46 117.51 123.24 1pud h ILE 143 Ca 0.15 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1pud h ILE 143 Cb 0.20 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1pud h ILE 143 CO -0.01 0.11 -0.01 1.56 0.00 0.00 0.00 178.15 179.79 1pud h GLN 144 N 0.22 0.17 -0.20 2.37 4.20 -1.00 -0.18 115.11 120.71 1pud h GLN 144 Ca 0.07 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 1pud h GLN 144 Cb 0.07 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 1pud h GLN 144 CO -0.01 0.21 -0.17 1.25 -0.67 0.00 0.00 178.83 179.44 1pud h HIS 145 N 0.17 0.55 -0.88 2.96 2.76 -0.39 -1.11 115.15 119.21 1pud h HIS 145 Ca 0.04 -0.16 0.05 0.00 -2.20 0.00 0.00 60.37 58.10 1pud h HIS 145 Cb 0.15 -0.12 -0.06 0.00 1.55 0.00 0.00 27.41 28.93 1pud h HIS 145 CO 0.00 0.81 0.56 -0.07 -1.30 0.00 0.00 177.93 177.92 1pud h LEU 146 N 0.13 0.90 -1.24 0.26 3.38 0.08 0.18 115.31 119.01 1pud h LEU 146 Ca 0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1pud h LEU 146 Cb 0.70 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1pud h LEU 146 CO 0.04 0.60 -0.36 -0.07 0.09 0.00 0.00 178.44 178.75 1pud h LEU 147 N 1.05 0.04 0.00 1.67 3.38 -0.96 -3.34 115.31 117.15 1pud h LEU 147 Ca 0.36 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1pud h LEU 147 Cb 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1pud h LEU 147 CO -0.14 0.40 0.00 0.61 0.09 0.00 0.00 178.44 179.40 1pud n GLY 148 N -0.47 0.62 3.73 0.83 0.00 0.05 -0.57 105.19 109.37 1pud n GLY 148 Ca -0.02 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 1pud n GLY 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pud s SER 149 N -2.84 4.20 -0.06 1.61 1.04 -1.03 -4.89 113.70 111.74 1pud s SER 149 Ca 0.00 2.12 -0.02 0.00 0.48 0.00 0.00 55.95 58.53 1pud s SER 149 Cb 0.00 -2.56 -0.27 0.00 0.10 0.00 0.00 66.02 63.29 1pud s SER 149 CO 0.00 -2.25 0.62 0.44 0.98 0.00 0.00 173.24 173.03 1pud h ASP 150 N -0.73 0.35 -3.10 7.02 3.32 -1.40 -3.45 116.42 118.43 1pud h ASP 150 Ca -0.46 -0.63 -0.67 0.00 0.02 0.00 0.00 57.03 55.29 1pud h ASP 150 Cb 1.26 -0.11 -0.35 0.00 0.22 0.00 0.00 39.33 40.35 1pud h ASP 150 CO 0.49 1.55 -0.86 -0.63 -1.72 0.00 0.00 179.24 178.07 1pud s ILE 151 N -2.59 2.06 -0.13 0.35 1.01 -0.90 -0.26 121.20 120.74 1pud s ILE 151 Ca -0.14 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.51 1pud s ILE 151 Cb 0.07 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 1pud s ILE 151 CO 0.82 0.54 0.05 -0.69 0.00 0.00 0.00 174.94 175.66 1pud s VAL 152 N 1.17 4.71 -0.15 2.92 1.01 0.81 -1.60 120.40 129.27 1pud s VAL 152 Ca 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.83 1pud s VAL 152 Cb -0.14 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1pud s VAL 152 CO -0.10 0.55 0.14 -0.04 0.00 0.00 0.00 175.10 175.65 1pud s MET 153 N -0.40 3.73 0.51 2.72 -1.94 -1.18 -0.96 119.30 121.79 1pud s MET 153 Ca 0.09 -0.15 -0.22 0.00 -1.71 0.00 0.00 55.69 53.70 1pud s MET 153 Cb -0.12 -3.28 -0.06 0.00 2.01 0.00 0.00 34.83 33.38 1pud s MET 153 CO 0.02 0.60 1.22 0.00 -0.01 0.00 0.00 175.02 176.85 1pud s ALA 154 N -0.50 2.86 -0.08 3.03 0.00 -0.70 -4.42 121.76 121.95 1pud s ALA 154 Ca 0.13 1.05 -0.27 0.00 0.00 0.00 0.00 51.96 52.87 1pud s ALA 154 Cb -0.12 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.54 1pud s ALA 154 CO 0.02 -0.94 0.88 0.12 0.00 0.00 0.00 175.76 175.85 1pud s PHE 155 N -1.49 3.55 0.22 0.00 5.36 -1.26 -4.70 117.98 119.66 1pud s PHE 155 Ca 0.68 1.46 0.04 0.00 -0.96 0.00 0.00 56.93 58.15 1pud s PHE 155 Cb -0.32 -3.04 -0.01 0.00 -0.34 0.00 0.00 43.02 39.31 1pud s PHE 155 CO 0.38 -0.09 0.13 -0.40 -1.46 0.00 0.00 175.22 173.78 1pud n ASP 156 N 4.44 0.33 -4.06 6.13 5.75 -1.26 -4.34 116.55 123.54 1pud n ASP 156 Ca 0.05 -2.32 -0.32 0.00 -0.01 0.00 0.00 54.79 52.19 1pud n ASP 156 Cb 0.50 0.82 -0.15 0.00 -1.03 0.00 0.00 41.12 41.26 1pud n ASP 156 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1pud s GLU 157 N -2.88 2.15 0.29 0.11 2.12 -1.26 -4.85 118.70 114.37 1pud s GLU 157 Ca 0.18 -1.42 -0.29 0.00 0.36 0.00 0.00 54.97 53.81 1pud s GLU 157 Cb 0.01 -2.94 -0.09 0.00 0.26 0.00 0.00 34.13 31.37 1pud s GLU 157 CO 0.13 -0.62 1.07 0.00 -0.54 0.00 0.00 175.26 175.30 1pud s THR 159 N -1.21 5.24 0.81 0.00 2.01 -1.26 -5.07 115.64 116.17 1pud s THR 159 Ca 0.45 0.65 -0.11 0.00 0.31 0.00 0.00 61.69 62.99 1pud s THR 159 Cb -0.30 -3.69 0.08 0.00 0.01 0.00 0.00 72.50 68.60 1pud s THR 159 CO 0.38 0.31 1.10 -2.16 -0.69 0.00 0.00 174.62 173.56 1pud s PRO 160 N 0.93 1.90 -0.09 4.92 0.04 -1.26 -4.89 135.00 136.56 1pud s PRO 160 Ca 0.18 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.41 1pud s PRO 160 Cb -0.14 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1pud s PRO 160 CO 0.07 -1.89 -0.22 -0.47 0.04 0.00 0.00 177.00 174.53 1pud s TYR 161 N -2.87 2.58 0.78 0.56 5.04 -1.26 -3.39 117.35 118.79 1pud s TYR 161 Ca 0.62 -0.89 -0.12 0.00 -2.44 0.00 0.00 57.07 54.25 1pud s TYR 161 Cb -0.18 -1.71 0.06 0.00 0.35 0.00 0.00 41.96 40.48 1pud s TYR 161 CO 0.57 -0.33 1.11 -2.14 -1.34 0.00 0.00 175.55 173.42 1pud s PRO 162 N 0.21 2.23 0.01 4.97 0.02 -1.26 -4.93 135.00 136.24 1pud s PRO 162 Ca -0.14 0.50 0.01 0.00 0.02 0.00 0.00 61.00 61.40 1pud s PRO 162 Cb -0.17 -1.95 -0.01 0.00 0.02 0.00 0.00 34.50 32.40 1pud s PRO 162 CO 0.07 -1.49 -0.04 0.00 -0.33 0.00 0.00 177.00 175.21 1pud s ALA 163 N -3.27 0.35 0.44 -1.55 0.00 -1.22 -5.11 121.76 111.40 1pud s ALA 163 Ca 0.60 -0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.13 1pud s ALA 163 Cb -0.13 -0.04 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1pud s ALA 163 CO 0.53 0.04 0.84 0.95 0.00 0.00 0.00 175.76 178.12 1pud s THR 164 N -0.43 4.70 0.21 0.00 -4.23 -1.26 -4.83 115.64 109.80 1pud s THR 164 Ca -0.02 0.83 -0.12 0.00 -1.18 0.00 0.00 61.69 61.20 1pud s THR 164 Cb -0.04 -3.73 0.20 0.00 1.34 0.00 0.00 72.50 70.27 1pud s THR 164 CO -0.00 -0.57 1.66 -0.65 -0.54 0.00 0.00 174.62 174.52 1pud h PRO 165 N 1.16 0.09 -0.77 3.99 0.11 -2.00 0.23 132.00 134.81 1pud h PRO 165 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1pud h PRO 165 Cb 1.19 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 1pud h PRO 165 CO 0.63 0.06 0.31 0.66 -0.21 0.00 0.00 178.00 179.44 1pud h SER 166 N 0.09 1.05 0.05 -2.05 4.64 -1.98 0.13 113.55 115.47 1pud h SER 166 Ca 0.31 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1pud h SER 166 Cb 0.49 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1pud h SER 166 CO -0.54 0.93 -0.02 -0.09 -0.87 0.00 0.00 176.83 176.24 1pud h ARG 167 N 1.11 -0.06 -0.80 4.77 2.43 -1.62 -0.96 114.38 119.25 1pud h ARG 167 Ca 0.26 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.39 1pud h ARG 167 Cb 0.21 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.73 1pud h ARG 167 CO -0.02 0.14 0.35 0.00 -1.51 0.00 0.00 179.97 178.92 1pud h ALA 168 N 0.70 1.10 0.05 2.80 0.00 -0.40 -1.97 119.26 121.54 1pud h ALA 168 Ca -0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1pud h ALA 168 Cb 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1pud h ALA 168 CO 0.01 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.89 1pud h ALA 169 N 1.22 -0.07 -0.59 0.00 0.00 -0.58 0.36 119.26 119.60 1pud h ALA 169 Ca 0.27 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1pud h ALA 169 Cb 0.17 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1pud h ALA 169 CO -0.03 -0.47 0.22 0.77 0.00 0.00 0.00 179.25 179.74 1pud h SER 170 N -0.21 0.79 -0.30 0.00 0.02 -1.08 0.60 113.55 113.37 1pud h SER 170 Ca -0.01 -0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.74 1pud h SER 170 Cb 0.18 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1pud h SER 170 CO 0.01 0.73 -0.15 -1.28 -1.14 0.00 0.00 176.83 175.00 1pud h SER 171 N 0.85 0.66 -0.26 3.07 0.87 -1.20 -2.05 113.55 115.48 1pud h SER 171 Ca 0.20 -0.41 -0.01 0.00 -1.23 0.00 0.00 61.79 60.34 1pud h SER 171 Cb 0.20 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1pud h SER 171 CO -0.01 0.92 0.12 -0.03 -0.53 0.00 0.00 176.83 177.30 1pud h MET 172 N 0.40 0.38 -0.85 2.24 -1.53 -0.56 -1.35 114.93 113.65 1pud h MET 172 Ca 0.07 -0.06 0.04 0.00 -3.44 0.00 0.00 59.70 56.31 1pud h MET 172 Cb 0.67 -0.07 -0.05 0.00 -0.55 0.00 0.00 31.60 31.60 1pud h MET 172 CO 0.04 0.38 0.55 0.93 0.14 0.00 0.00 176.91 178.95 1pud h GLU 173 N 0.29 1.02 -0.46 0.39 5.08 -0.84 -0.40 114.58 119.66 1pud h GLU 173 Ca 0.09 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1pud h GLU 173 Cb 0.13 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1pud h GLU 173 CO -0.01 0.67 0.11 -0.09 -1.00 0.00 0.00 179.01 178.69 1pud h ARG 174 N 1.05 0.74 -1.00 2.33 9.65 -1.18 -2.42 114.38 123.54 1pud h ARG 174 Ca 0.35 -0.18 0.04 0.00 -1.10 0.00 0.00 59.98 59.09 1pud h ARG 174 Cb 0.04 -0.10 -0.06 0.00 -1.39 0.00 0.00 29.97 28.46 1pud h ARG 174 CO -0.13 0.73 0.66 0.77 2.80 0.00 0.00 179.97 184.80 1pud h SER 175 N 0.62 1.09 0.08 -3.80 0.02 -0.27 -0.11 113.55 111.17 1pud h SER 175 Ca 0.14 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.98 1pud h SER 175 Cb 0.33 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1pud h SER 175 CO 0.00 0.73 -0.34 0.24 -1.14 0.00 0.00 176.83 176.32 1pud h MET 176 N 1.25 0.37 -0.37 3.45 2.86 -0.85 0.36 114.93 122.00 1pud h MET 176 Ca 0.41 -0.16 -0.14 0.00 -2.06 0.00 0.00 59.70 57.75 1pud h MET 176 Cb 0.03 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1pud h MET 176 CO -0.13 0.67 -0.32 0.00 1.06 0.00 0.00 176.91 178.19 1pud h ARG 177 N 0.32 0.81 -0.00 1.72 3.08 -0.86 -2.23 114.38 117.21 1pud h ARG 177 Ca 0.04 -0.38 -0.12 0.00 0.07 0.00 0.00 59.98 59.59 1pud h ARG 177 Cb 0.76 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.79 1pud h ARG 177 CO 0.06 1.01 -0.55 -1.49 -1.07 0.00 0.00 179.97 177.93 1pud h TRP 178 N 0.68 0.01 -0.34 3.04 4.06 -0.51 -2.14 115.95 120.75 1pud h TRP 178 Ca 0.07 -0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.00 1pud h TRP 178 Cb 0.86 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.01 1pud h TRP 178 CO 0.05 0.56 0.13 0.00 -3.56 0.00 0.00 178.44 175.62 1pud h ALA 179 N 1.44 0.44 -0.70 1.49 0.00 0.07 0.25 119.26 122.24 1pud h ALA 179 Ca -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1pud h ALA 179 Cb 0.98 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1pud h ALA 179 CO 0.07 0.05 0.35 -0.22 0.00 0.00 0.00 179.25 179.50 1pud h LYS 180 N 0.40 0.99 -0.23 0.00 1.63 -1.22 -0.20 116.57 117.95 1pud h LYS 180 Ca 0.11 -0.14 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 1pud h LYS 180 Cb 0.20 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1pud h LYS 180 CO -0.01 0.77 -0.22 0.00 -3.45 0.00 0.00 179.45 176.55 1pud h ARG 181 N 0.97 0.41 -0.26 1.90 3.08 -0.99 -1.00 114.38 118.48 1pud h ARG 181 Ca 0.24 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 1pud h ARG 181 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1pud h ARG 181 CO -0.03 0.61 -0.08 0.77 -1.07 0.00 0.00 179.97 180.16 1pud h SER 182 N 0.37 0.53 -0.15 7.04 0.02 0.09 -1.61 113.55 119.83 1pud h SER 182 Ca 0.06 -0.38 0.01 0.00 -0.84 0.00 0.00 61.79 60.64 1pud h SER 182 Cb 0.59 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1pud h SER 182 CO 0.04 0.79 0.09 -0.09 -1.14 0.00 0.00 176.83 176.51 1pud h ARG 183 N 0.27 0.17 -0.49 3.45 9.65 -0.80 -0.60 114.38 126.03 1pud h ARG 183 Ca 0.06 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1pud h ARG 183 Cb 0.57 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.08 1pud h ARG 183 CO 0.03 0.12 0.31 -0.44 2.80 0.00 0.00 179.97 182.79 1pud h ASP 184 N 0.18 0.57 -0.48 -3.80 3.32 -1.14 -0.41 116.42 114.66 1pud h ASP 184 Ca 0.06 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1pud h ASP 184 Cb -0.00 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1pud h ASP 184 CO -0.03 0.43 0.23 0.00 -1.72 0.00 0.00 179.24 178.15 1pud h ALA 185 N 1.16 0.62 -0.04 3.45 0.00 -1.12 -1.71 119.26 121.63 1pud h ALA 185 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1pud h ALA 185 Cb -0.05 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1pud h ALA 185 CO -0.04 0.19 0.01 0.35 0.00 0.00 0.00 179.25 179.77 1pud h PHE 186 N 0.64 0.03 0.00 0.00 3.04 -0.83 -2.81 116.94 117.01 1pud h PHE 186 Ca 0.17 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.09 1pud h PHE 186 Cb 0.13 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 38.63 1pud h PHE 186 CO -0.01 0.02 -0.15 -0.44 -2.02 0.00 0.00 178.31 175.71 1pud h ASP 187 N 0.04 0.00 0.82 0.41 3.32 -0.88 -2.66 116.42 117.46 1pud h ASP 187 Ca 0.02 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1pud h ASP 187 Cb 0.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1pud h ASP 187 CO -0.01 0.15 -0.02 0.77 -1.72 0.00 0.00 179.24 178.40 1pud h SER 188 N 0.00 0.00 -3.40 6.45 4.64 -1.04 -3.37 113.55 116.83 1pud h SER 188 Ca -0.00 0.00 -0.77 0.00 -0.47 0.00 0.00 61.79 60.55 1pud h SER 188 Cb 0.27 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.11 1pud h SER 188 CO 0.02 0.02 -0.11 -0.60 -0.87 0.00 0.00 176.83 175.29 1pud s ARG 189 N -3.77 3.19 0.16 4.77 3.52 -1.00 -4.95 118.95 120.86 1pud s ARG 189 Ca -0.00 -2.01 -0.16 0.00 -0.13 0.00 0.00 55.73 53.42 1pud s ARG 189 Cb 0.10 -4.32 0.08 0.00 -1.56 0.00 0.00 34.95 29.25 1pud s ARG 189 CO 0.53 -1.30 1.72 1.57 -0.81 0.00 0.00 175.30 177.00 1pud h LYS 190 N 8.41 0.15 -0.90 5.12 2.10 -1.82 0.76 116.57 130.40 1pud h LYS 190 Ca -0.14 -0.01 0.13 0.00 -2.00 0.00 0.00 60.65 58.64 1pud h LYS 190 Cb 1.07 -0.03 -0.07 0.00 -0.90 0.00 0.00 32.23 32.30 1pud h LYS 190 CO 0.92 0.10 0.58 1.49 -2.00 0.00 0.00 179.45 180.53 1pud h GLU 191 N 0.15 0.72 0.00 0.07 4.81 -1.94 0.88 114.58 119.28 1pud h GLU 191 Ca 0.17 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1pud h GLU 191 Cb 0.22 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.44 1pud h GLU 191 CO -0.25 0.48 -0.27 0.37 -0.73 0.00 0.00 179.01 178.61 1pud h GLN 192 N 0.74 0.18 0.00 1.92 4.15 -1.67 -2.85 115.11 117.58 1pud h GLN 192 Ca 0.44 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.66 1pud h GLN 192 Cb 0.65 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.39 1pud h GLN 192 CO -0.20 0.94 -0.07 0.00 -1.93 0.00 0.00 178.83 177.56 1pud h ALA 193 N 0.24 1.62 0.00 3.38 0.00 -0.21 0.88 119.26 125.17 1pud h ALA 193 Ca -0.03 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1pud h ALA 193 Cb 1.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1pud h ALA 193 CO 0.05 0.09 -1.13 0.93 0.00 0.00 0.00 179.25 179.19 1pud h GLU 194 N 0.00 0.00 0.00 0.00 5.08 -0.91 -3.40 114.58 115.36 1pud h GLU 194 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pud h GLU 194 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1pud h GLU 194 CO 0.01 0.24 -1.11 0.09 -1.00 0.00 0.00 179.01 177.24 1pud n ASN 195 N -2.90 2.48 -4.76 1.42 4.13 -1.07 -4.77 115.26 109.78 1pud n ASN 195 Ca -0.05 -0.17 -0.25 0.00 1.68 0.00 0.00 54.58 55.78 1pud n ASN 195 Cb 0.75 1.27 -0.07 0.00 -1.54 0.00 0.00 39.78 40.19 1pud n ASN 195 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pud s ALA 196 N -2.34 3.73 0.15 5.41 0.00 0.28 -4.81 121.76 124.18 1pud s ALA 196 Ca -0.01 -1.88 0.11 0.00 0.00 0.00 0.00 51.96 50.17 1pud s ALA 196 Cb 0.05 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 1pud s ALA 196 CO 0.33 -0.19 -0.23 0.00 0.00 0.00 0.00 175.76 175.67 1pud s ALA 197 N -2.64 2.53 -0.11 0.00 0.00 0.64 -4.76 121.76 117.42 1pud s ALA 197 Ca 0.38 -1.50 0.03 0.00 0.00 0.00 0.00 51.96 50.86 1pud s ALA 197 Cb 0.03 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.71 1pud s ALA 197 CO 0.21 0.51 -0.19 -1.17 0.00 0.00 0.00 175.76 175.12 1pud s LEU 198 N -2.32 1.93 -0.09 0.00 2.96 -1.26 -0.13 118.68 119.76 1pud s LEU 198 Ca 0.18 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1pud s LEU 198 Cb -0.09 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.31 1pud s LEU 198 CO 0.09 0.07 0.01 -0.36 -1.32 0.00 0.00 176.35 174.84 1pud s PHE 199 N 0.74 3.19 0.23 5.38 0.40 -0.13 -0.83 117.98 126.96 1pud s PHE 199 Ca -0.11 0.21 0.05 0.00 -0.60 0.00 0.00 56.93 56.48 1pud s PHE 199 Cb -0.16 -1.81 -0.03 0.00 0.51 0.00 0.00 43.02 41.53 1pud s PHE 199 CO 0.01 0.47 0.34 0.20 0.70 0.00 0.00 175.22 176.95 1pud s GLY 200 N -0.85 1.27 -0.15 4.36 0.00 -0.66 -1.72 107.32 109.58 1pud s GLY 200 Ca 0.13 -1.22 0.02 0.00 0.00 0.00 0.00 44.72 43.64 1pud s GLY 200 CO 0.02 -1.24 -0.19 -0.42 0.00 0.00 0.00 173.10 171.27 1pud s ILE 201 N -1.97 1.93 0.13 0.90 1.01 -1.26 -0.41 121.20 121.53 1pud s ILE 201 Ca 0.34 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.81 1pud s ILE 201 Cb -0.09 -1.74 -0.06 0.00 0.01 0.00 0.00 42.46 40.58 1pud s ILE 201 CO 0.29 0.52 0.95 -1.58 0.00 0.00 0.00 174.94 175.12 1pud s GLN 202 N 1.12 4.71 0.10 2.79 0.74 0.58 -4.86 119.66 124.84 1pud s GLN 202 Ca -0.01 1.44 0.00 0.00 0.05 0.00 0.00 55.36 56.85 1pud s GLN 202 Cb -0.14 -3.36 -0.00 0.00 1.10 0.00 0.00 33.01 30.61 1pud s GLN 202 CO -0.07 0.26 0.01 1.04 -0.55 0.00 0.00 175.29 175.97 1pud n GLN 203 N 2.61 1.44 0.00 1.67 1.13 -1.26 -0.90 117.38 122.06 1pud n GLN 203 Ca 0.02 -0.78 0.00 0.00 -1.94 0.00 0.00 57.00 54.29 1pud n GLN 203 Cb 0.49 0.28 0.00 0.00 0.11 0.00 0.00 30.24 31.12 1pud n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1pud n GLY 204 N 3.00 0.57 7.00 1.08 0.00 -1.26 -4.03 105.19 111.55 1pud n GLY 204 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1pud n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pud n SER 205 N 0.00 0.00 -1.55 1.61 2.88 -1.26 -2.26 113.62 113.04 1pud n SER 205 Ca 0.00 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.63 1pud n SER 205 Cb 0.00 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 63.80 1pud n SER 205 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1pud n VAL 206 N 0.00 1.81 -3.55 2.46 0.24 -1.26 -4.90 118.33 113.14 1pud n VAL 206 Ca 0.00 -1.12 -0.40 0.00 -2.04 0.00 0.00 64.34 60.78 1pud n VAL 206 Cb 0.00 0.05 -0.11 0.00 -1.47 0.00 0.00 33.84 32.31 1pud n VAL 206 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1pud s PHE 207 N -1.93 3.23 0.43 6.34 0.08 -0.96 -4.97 117.98 120.21 1pud s PHE 207 Ca 0.48 -0.11 0.22 0.00 0.12 0.00 0.00 56.93 57.64 1pud s PHE 207 Cb 0.32 -2.45 1.28 0.00 -0.57 0.00 0.00 43.02 41.60 1pud s PHE 207 CO 0.22 -0.30 2.04 1.05 -0.10 0.00 0.00 175.22 178.13 1pud h GLU 208 N 8.46 0.00 -0.28 0.44 4.11 -1.90 -0.77 114.58 124.64 1pud h GLU 208 Ca -0.32 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 58.97 1pud h GLU 208 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1pud h GLU 208 CO 0.61 0.15 -0.40 -2.95 0.07 0.00 0.00 179.01 176.49 1pud h ASN 209 N 0.00 0.70 -0.23 3.06 -1.07 -1.93 0.64 115.58 116.74 1pud h ASN 209 Ca -0.00 -0.32 -0.19 0.00 0.07 0.00 0.00 56.30 55.86 1pud h ASN 209 Cb 0.33 -0.20 0.00 0.00 -2.07 0.00 0.00 38.32 36.39 1pud h ASN 209 CO 0.02 1.02 -0.60 -0.07 0.07 0.00 0.00 177.43 177.87 1pud h LEU 210 N 0.54 0.92 -0.64 6.14 4.07 -1.66 -1.70 115.31 122.97 1pud h LEU 210 Ca 0.05 -0.57 -0.01 0.00 0.08 0.00 0.00 57.88 57.43 1pud h LEU 210 Cb 0.93 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 42.37 1pud h LEU 210 CO 0.08 1.33 0.38 0.03 -1.08 0.00 0.00 178.44 179.18 1pud h ARG 211 N 0.56 0.88 -0.14 1.13 2.47 -1.01 -0.28 114.38 117.99 1pud h ARG 211 Ca -0.01 -0.09 -0.00 0.00 -1.26 0.00 0.00 59.98 58.62 1pud h ARG 211 Cb 1.22 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 29.35 1pud h ARG 211 CO 0.13 0.64 0.09 0.37 0.56 0.00 0.00 179.97 181.76 1pud h GLN 212 N 0.87 0.20 -0.57 0.04 5.75 -0.79 0.12 115.11 120.73 1pud h GLN 212 Ca 0.23 -0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.75 1pud h GLN 212 Cb -0.00 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.46 1pud h GLN 212 CO -0.04 0.18 0.32 1.96 -2.65 0.00 0.00 178.83 178.60 1pud h GLN 213 N 0.16 0.60 -0.13 1.69 4.20 -0.97 -0.99 115.11 119.67 1pud h GLN 213 Ca 0.05 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1pud h GLN 213 Cb 0.03 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1pud h GLN 213 CO -0.01 0.40 0.07 1.03 -0.67 0.00 0.00 178.83 179.65 1pud h SER 214 N 0.62 0.16 -0.59 1.46 0.87 -0.66 -1.27 113.55 114.13 1pud h SER 214 Ca 0.25 -0.08 0.05 0.00 -1.23 0.00 0.00 61.79 60.78 1pud h SER 214 Cb 0.11 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 61.98 1pud h SER 214 CO -0.14 0.19 0.31 0.00 -0.53 0.00 0.00 176.83 176.66 1pud h ALA 215 N 0.98 0.78 -0.29 6.23 0.00 -0.37 -0.62 119.26 125.97 1pud h ALA 215 Ca 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1pud h ALA 215 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1pud h ALA 215 CO -0.01 -0.02 0.09 -0.44 0.00 0.00 0.00 179.25 178.87 1pud h ASP 216 N 0.59 0.42 -0.73 0.00 3.32 -0.98 -0.32 116.42 118.72 1pud h ASP 216 Ca 0.26 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1pud h ASP 216 Cb 0.17 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1pud h ASP 216 CO -0.18 0.51 0.47 0.00 -1.72 0.00 0.00 179.24 178.33 1pud h ALA 217 N 0.92 0.92 -0.22 3.45 0.00 -0.92 -0.09 119.26 123.33 1pud h ALA 217 Ca 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1pud h ALA 217 Cb 0.25 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1pud h ALA 217 CO -0.00 0.36 0.12 -0.07 0.00 0.00 0.00 179.25 179.65 1pud h LEU 218 N 0.99 0.28 -1.22 0.00 4.07 -0.92 -1.98 115.31 116.53 1pud h LEU 218 Ca 0.26 -0.10 -0.04 0.00 0.08 0.00 0.00 57.88 58.09 1pud h LEU 218 Cb -0.09 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 1pud h LEU 218 CO -0.05 0.29 0.14 0.00 -1.08 0.00 0.00 178.44 177.73 1pud h ALA 219 N 0.99 1.37 -0.69 1.53 0.00 -0.65 0.13 119.26 121.95 1pud h ALA 219 Ca 0.08 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1pud h ALA 219 Cb 0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pud h ALA 219 CO -0.01 0.46 0.15 1.49 0.00 0.00 0.00 179.25 181.33 1pud h GLU 220 N 0.67 1.12 -0.07 0.00 4.81 -0.68 -3.03 114.58 117.40 1pud h GLU 220 Ca 0.16 -0.28 -0.06 0.00 -0.13 0.00 0.00 59.36 59.05 1pud h GLU 220 Cb 0.21 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1pud h GLU 220 CO -0.01 1.00 -0.19 0.82 -0.73 0.00 0.00 179.01 179.91 1pud h ILE 221 N 1.05 1.43 -0.51 2.32 2.04 -0.82 -3.50 117.51 119.51 1pud h ILE 221 Ca 0.21 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.53 1pud h ILE 221 Cb 0.40 2.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1pud h ILE 221 CO 0.01 0.44 0.00 0.61 0.00 0.00 0.00 178.15 179.20 1pud n GLY 222 N 0.54 -0.66 3.22 5.37 0.00 0.40 -5.11 105.19 108.95 1pud n GLY 222 Ca -0.08 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 1pud n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pud s PHE 223 N 0.00 1.10 0.12 1.61 0.08 -1.26 -5.03 117.98 114.60 1pud s PHE 223 Ca 0.00 -0.93 0.14 0.00 0.12 0.00 0.00 56.93 56.26 1pud s PHE 223 Cb 0.00 -0.62 0.33 0.00 -0.57 0.00 0.00 43.02 42.16 1pud s PHE 223 CO 0.00 -0.13 1.57 -0.44 -0.10 0.00 0.00 175.22 176.12 1pud h ASP 224 N 2.81 0.00 -5.09 1.36 3.32 -1.38 -3.46 116.42 113.97 1pud h ASP 224 Ca -0.36 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 1pud h ASP 224 Cb 1.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.62 1pud h ASP 224 CO 0.64 0.56 -0.02 -0.83 -1.72 0.00 0.00 179.24 177.86 1pud s GLY 225 N -4.46 -0.13 -0.08 2.75 0.00 -1.22 -4.30 107.32 99.88 1pud s GLY 225 Ca 0.01 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 44.55 1pud s GLY 225 CO 0.74 -0.31 -0.10 -0.19 0.00 0.00 0.00 173.10 173.24 1pud s TYR 226 N -3.85 1.40 -0.01 1.90 1.51 -0.21 -1.65 117.35 116.44 1pud s TYR 226 Ca 0.07 -0.58 -0.03 0.00 -1.01 0.00 0.00 57.07 55.53 1pud s TYR 226 Cb 0.00 -1.09 -0.04 0.00 -0.11 0.00 0.00 41.96 40.72 1pud s TYR 226 CO -0.06 -0.36 0.18 0.00 -1.11 0.00 0.00 175.55 174.20 1pud s ALA 227 N 1.06 3.93 -0.48 3.71 0.00 0.45 -0.67 121.76 129.77 1pud s ALA 227 Ca -0.07 -0.77 -0.15 0.00 0.00 0.00 0.00 51.96 50.98 1pud s ALA 227 Cb -0.14 -1.87 0.08 0.00 0.00 0.00 0.00 23.12 21.19 1pud s ALA 227 CO -0.01 0.74 0.39 0.08 0.00 0.00 0.00 175.76 176.97 1pud s VAL 228 N -1.31 5.07 0.57 0.00 1.01 0.21 -0.31 120.40 125.65 1pud s VAL 228 Ca 0.27 -1.20 0.04 0.00 0.00 0.00 0.00 61.98 61.09 1pud s VAL 228 Cb -0.13 -4.08 0.07 0.00 0.00 0.00 0.00 36.38 32.24 1pud s VAL 228 CO 0.18 -0.62 0.79 -0.83 0.00 0.00 0.00 175.10 174.62 1pud s GLY 229 N 2.71 1.81 0.00 4.51 0.00 -0.08 -3.86 107.32 112.40 1pud s GLY 229 Ca 0.04 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 43.04 1pud s GLY 229 CO 0.05 -1.34 0.00 0.61 0.00 0.00 0.00 173.10 172.42 1pud n GLY 230 N -2.34 0.52 3.83 0.20 0.00 -1.26 -4.66 105.19 101.49 1pud n GLY 230 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 1pud n GLY 230 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pud s LEU 231 N 0.00 3.06 -1.51 0.99 1.43 -1.26 -4.62 118.68 116.76 1pud s LEU 231 Ca 0.00 -1.04 -0.06 0.00 -1.03 0.00 0.00 54.13 52.00 1pud s LEU 231 Cb 0.00 -1.54 0.02 0.00 0.03 0.00 0.00 46.19 44.70 1pud s LEU 231 CO 0.00 -0.76 0.63 0.00 0.23 0.00 0.00 176.35 176.45 1pud n ALA 232 N -1.50 -1.01 -1.40 4.21 0.00 -1.26 -4.88 120.51 114.67 1pud n ALA 232 Ca -0.00 0.27 0.07 0.00 0.00 0.00 0.00 53.44 53.77 1pud n ALA 232 Cb 0.64 -3.85 0.19 0.00 0.00 0.00 0.00 19.45 16.43 1pud n ALA 232 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1pud n VAL 233 N -4.47 2.11 0.00 0.00 3.14 -1.26 -4.92 118.33 112.93 1pud n VAL 233 Ca -0.09 -2.86 0.00 0.00 -2.96 0.00 0.00 64.34 58.43 1pud n VAL 233 Cb 0.61 -0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.14 1pud n VAL 233 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pud n GLY 234 N -1.22 0.88 0.12 7.55 0.00 -1.26 -4.35 105.19 106.91 1pud n GLY 234 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 1pud n GLY 234 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1pud h GLU 235 N 1.64 0.00 0.00 1.61 9.09 -1.94 -3.50 114.58 121.48 1pud h GLU 235 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1pud h GLU 235 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1pud h GLU 235 CO 0.00 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.47 1pud n GLY 236 N 0.90 -1.14 0.31 1.06 0.00 -1.26 -4.18 105.19 100.87 1pud n GLY 236 Ca 0.04 -1.48 0.02 0.00 0.00 0.00 0.00 46.02 44.60 1pud n GLY 236 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1pud h GLN 237 N 0.00 0.82 -0.06 1.61 4.15 -1.98 -0.81 115.11 118.83 1pud h GLN 237 Ca 0.00 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.38 1pud h GLN 237 Cb 0.00 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 1pud h GLN 237 CO 0.00 0.54 -0.03 -0.44 -1.93 0.00 0.00 178.83 176.98 1pud h ASP 238 N 0.84 -0.08 -0.46 -0.69 5.19 -2.00 0.13 116.42 119.36 1pud h ASP 238 Ca 0.39 0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.79 1pud h ASP 238 Cb 0.30 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 1pud h ASP 238 CO -0.22 -0.04 0.18 -0.33 -3.12 0.00 0.00 179.24 175.71 1pud h GLU 239 N -0.02 0.69 -0.20 3.56 4.39 -1.64 -0.88 114.58 120.48 1pud h GLU 239 Ca 0.03 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.64 1pud h GLU 239 Cb 0.07 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 1pud h GLU 239 CO -0.07 0.63 -0.06 1.98 -1.16 0.00 0.00 179.01 180.33 1pud h MET 240 N 0.59 -0.01 -0.76 2.33 4.05 -0.89 -0.11 114.93 120.13 1pud h MET 240 Ca 0.15 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 1pud h MET 240 Cb 0.20 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.97 1pud h MET 240 CO -0.01 -0.01 0.38 0.74 0.23 0.00 0.00 176.91 178.24 1pud h PHE 241 N -0.01 1.09 -0.65 1.39 0.04 -0.80 0.32 116.94 118.32 1pud h PHE 241 Ca 0.10 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 1pud h PHE 241 Cb 0.16 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 37.94 1pud h PHE 241 CO -0.22 0.79 0.37 -0.09 -0.60 0.00 0.00 178.31 178.57 1pud h ARG 242 N 1.07 0.89 -0.46 1.51 2.43 -0.60 0.03 114.38 119.25 1pud h ARG 242 Ca 0.26 -0.09 -0.12 0.00 -0.81 0.00 0.00 59.98 59.22 1pud h ARG 242 Cb 0.10 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1pud h ARG 242 CO -0.03 0.65 -0.18 0.28 -1.51 0.00 0.00 179.97 179.17 1pud h VAL 243 N 0.88 1.27 -0.81 0.20 2.07 -0.64 -2.92 116.25 116.30 1pud h VAL 243 Ca 0.23 -1.32 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 1pud h VAL 243 Cb 0.00 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1pud h VAL 243 CO -0.04 0.45 0.34 -0.07 0.02 0.00 0.00 177.57 178.27 1pud h LEU 244 N 0.80 1.10 -0.62 2.57 3.38 -0.39 0.88 115.31 123.03 1pud h LEU 244 Ca 0.11 -0.16 0.13 0.00 0.09 0.00 0.00 57.88 58.05 1pud h LEU 244 Cb 0.73 -0.29 -0.10 0.00 0.09 0.00 0.00 40.66 41.10 1pud h LEU 244 CO 0.06 0.96 0.05 0.44 0.09 0.00 0.00 178.44 180.05 1pud h ASP 245 N 1.17 -0.17 0.40 -0.43 3.32 -0.80 -1.89 116.42 118.03 1pud h ASP 245 Ca 0.27 0.14 -0.15 0.00 0.02 0.00 0.00 57.03 57.31 1pud h ASP 245 Cb 0.19 0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 1pud h ASP 245 CO -0.03 -0.07 -1.73 2.22 -1.72 0.00 0.00 179.24 177.91 1pud n PHE 246 N -5.22 0.53 -0.02 4.55 1.16 -1.12 -4.48 117.46 112.85 1pud n PHE 246 Ca 0.09 0.17 -0.16 0.00 -1.87 0.00 0.00 57.45 55.69 1pud n PHE 246 Cb 0.36 -0.91 -0.11 0.00 -1.61 0.00 0.00 39.48 37.20 1pud n PHE 246 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1pud h SER 247 N 0.00 0.28 -0.67 5.98 0.02 -0.61 -3.35 113.55 115.21 1pud h SER 247 Ca -0.19 -0.77 0.05 0.00 -0.84 0.00 0.00 61.79 60.04 1pud h SER 247 Cb 1.53 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 63.93 1pud h SER 247 CO 0.03 1.01 0.39 0.58 -1.14 0.00 0.00 176.83 177.70 1pud h VAL 248 N -0.42 1.02 0.00 2.27 2.07 -1.56 -1.26 116.25 118.36 1pud h VAL 248 Ca -0.04 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1pud h VAL 248 Cb 1.05 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1pud h VAL 248 CO 0.06 0.14 0.01 -0.65 0.02 0.00 0.00 177.57 177.15 1pud h PRO 249 N 0.74 0.00 0.00 1.57 0.11 -1.79 -1.36 132.00 131.27 1pud h PRO 249 Ca 0.29 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.30 1pud h PRO 249 Cb 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 1pud h PRO 249 CO -0.15 0.00 -0.47 0.52 -0.21 0.00 0.00 178.00 177.69 1pud h MET 250 N 0.00 0.00 -7.00 1.05 2.86 -1.35 -3.46 114.93 107.03 1pud h MET 250 Ca 0.00 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.15 1pud h MET 250 Cb 0.02 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.69 1pud h MET 250 CO 0.00 0.47 0.22 -0.51 1.06 0.00 0.00 176.91 178.15 1pud s LEU 251 N -6.55 3.70 0.19 1.22 1.43 -0.51 -4.81 118.68 113.34 1pud s LEU 251 Ca 0.03 1.28 -0.33 0.00 -1.03 0.00 0.00 54.13 54.08 1pud s LEU 251 Cb 0.08 -4.20 -0.13 0.00 0.03 0.00 0.00 46.19 41.97 1pud s LEU 251 CO 0.73 -0.51 1.59 -2.65 0.23 0.00 0.00 176.35 175.74 1pud n PRO 252 N -1.59 2.31 0.05 1.29 -0.02 -1.26 -4.89 135.00 130.89 1pud n PRO 252 Ca 0.04 0.83 -0.03 0.00 -2.02 0.00 0.00 63.50 62.32 1pud n PRO 252 Cb 0.54 -2.61 0.21 0.00 -0.02 0.00 0.00 33.50 31.63 1pud n PRO 252 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1pud h ASP 253 N 5.88 0.40 -0.08 2.55 3.58 -1.92 -3.13 116.42 123.70 1pud h ASP 253 Ca -0.45 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 56.86 1pud h ASP 253 Cb 1.24 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.18 1pud h ASP 253 CO 0.89 0.70 0.00 -0.90 -2.88 0.00 0.00 179.24 177.04 1pud n ASP 254 N -4.09 0.69 -4.30 2.28 5.75 -1.26 -4.82 116.55 110.80 1pud n ASP 254 Ca -0.01 -2.02 -0.25 0.00 -0.01 0.00 0.00 54.79 52.50 1pud n ASP 254 Cb 0.43 -0.16 -0.13 0.00 -1.03 0.00 0.00 41.12 40.23 1pud n ASP 254 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1pud s LYS 255 N -1.73 1.20 0.47 0.11 -0.14 -1.19 -4.87 119.74 113.60 1pud s LYS 255 Ca 0.06 -1.16 -0.24 0.00 -1.36 0.00 0.00 55.97 53.26 1pud s LYS 255 Cb 0.03 -1.49 -0.07 0.00 -1.68 0.00 0.00 37.83 34.63 1pud s LYS 255 CO 0.03 0.35 1.31 -1.25 -0.76 0.00 0.00 175.35 175.04 1pud s PRO 256 N -1.84 3.60 -0.22 -1.68 0.04 -1.26 -4.82 135.00 128.82 1pud s PRO 256 Ca 0.08 2.15 -0.04 0.00 0.04 0.00 0.00 61.00 63.23 1pud s PRO 256 Cb -0.10 -2.50 -0.01 0.00 0.04 0.00 0.00 34.50 31.93 1pud s PRO 256 CO 0.04 -0.79 -0.04 -1.01 0.04 0.00 0.00 177.00 175.24 1pud s HIS 257 N -1.32 2.96 -0.20 0.56 3.76 -1.26 -1.04 115.29 118.75 1pud s HIS 257 Ca 0.64 -0.92 -0.02 0.00 -0.15 0.00 0.00 55.06 54.61 1pud s HIS 257 Cb -0.38 -2.11 -0.00 0.00 1.11 0.00 0.00 32.58 31.20 1pud s HIS 257 CO 0.47 -0.54 -0.10 -0.47 -0.85 0.00 0.00 174.74 173.24 1pud s TYR 258 N 1.48 2.88 -0.42 1.40 5.04 0.15 -0.26 117.35 127.62 1pud s TYR 258 Ca 0.06 -1.12 -0.16 0.00 -2.44 0.00 0.00 57.07 53.41 1pud s TYR 258 Cb -0.14 -2.01 0.02 0.00 0.35 0.00 0.00 41.96 40.18 1pud s TYR 258 CO -0.03 -0.59 0.37 -1.17 -1.34 0.00 0.00 175.55 172.79 1pud s LEU 259 N 1.27 5.01 0.25 6.97 2.96 -0.34 -0.62 118.68 134.18 1pud s LEU 259 Ca 0.03 -0.81 -0.30 0.00 -0.22 0.00 0.00 54.13 52.83 1pud s LEU 259 Cb -0.14 -2.27 -0.09 0.00 0.50 0.00 0.00 46.19 44.19 1pud s LEU 259 CO -0.05 -0.52 1.04 -0.04 -1.32 0.00 0.00 176.35 175.45 1pud s MET 260 N 1.90 4.72 -1.76 1.98 -1.94 -1.25 -4.00 119.30 118.95 1pud s MET 260 Ca 0.08 1.67 0.00 0.00 -1.71 0.00 0.00 55.69 55.74 1pud s MET 260 Cb -0.18 -3.23 0.00 0.00 2.01 0.00 0.00 34.83 33.42 1pud s MET 260 CO 0.12 0.32 0.00 0.41 -0.01 0.00 0.00 175.02 175.86 1pud n GLY 261 N 1.38 0.30 3.26 -0.03 0.00 -1.17 -4.84 105.19 104.10 1pud n GLY 261 Ca -0.01 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1pud n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pud s VAL 262 N -2.88 2.78 0.00 1.61 1.01 -0.94 -4.88 120.40 117.10 1pud s VAL 262 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1pud s VAL 262 Cb 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.18 1pud s VAL 262 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1pud n GLY 263 N 4.26 0.53 3.76 4.51 0.00 -1.26 -3.79 105.19 113.20 1pud n GLY 263 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 1pud n GLY 263 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pud n LYS 264 N 0.00 2.59 -0.28 1.61 5.02 -1.26 -4.77 118.16 121.07 1pud n LYS 264 Ca 0.00 0.91 0.09 0.00 -2.02 0.00 0.00 58.31 57.29 1pud n LYS 264 Cb 0.00 -2.63 0.22 0.00 -0.02 0.00 0.00 35.03 32.60 1pud n LYS 264 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1pud h PRO 265 N 3.30 0.13 -0.04 1.97 0.11 -2.00 0.80 132.00 136.27 1pud h PRO 265 Ca -0.49 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1pud h PRO 265 Cb 1.25 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1pud h PRO 265 CO 0.67 0.09 -0.45 0.38 -0.21 0.00 0.00 178.00 178.48 1pud h ASP 266 N 0.14 0.09 -0.25 -2.05 2.03 -2.00 -2.02 116.42 112.35 1pud h ASP 266 Ca 0.48 -0.04 -0.03 0.00 -0.73 0.00 0.00 57.03 56.72 1pud h ASP 266 Cb 0.92 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 39.38 1pud h ASP 266 CO -0.69 0.53 0.04 0.44 -1.03 0.00 0.00 179.24 178.53 1pud h ASP 267 N 0.07 0.40 -0.04 4.15 3.32 -1.23 -1.93 116.42 121.16 1pud h ASP 267 Ca 0.00 -0.26 0.01 0.00 0.02 0.00 0.00 57.03 56.80 1pud h ASP 267 Cb 0.83 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1pud h ASP 267 CO 0.06 0.56 -0.04 0.40 -1.72 0.00 0.00 179.24 178.50 1pud h ILE 268 N 0.22 0.87 -0.46 0.35 2.04 -1.09 0.12 117.51 119.55 1pud h ILE 268 Ca 0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.97 1pud h ILE 268 Cb 0.33 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1pud h ILE 268 CO 0.01 0.00 0.25 0.58 0.00 0.00 0.00 178.15 178.99 1pud h VAL 269 N -0.06 1.00 -0.41 1.67 2.07 -1.31 0.16 116.25 119.38 1pud h VAL 269 Ca 0.03 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.29 1pud h VAL 269 Cb 0.11 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1pud h VAL 269 CO -0.08 0.09 -0.11 1.23 0.02 0.00 0.00 177.57 178.73 1pud h GLY 270 N 0.50 0.78 1.20 2.17 0.00 -1.12 -2.50 103.07 104.09 1pud h GLY 270 Ca 0.19 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 46.82 1pud h GLY 270 CO -0.12 0.53 -0.23 0.00 0.00 0.00 0.00 176.54 176.72 1pud h ALA 271 N 1.23 0.75 -0.41 3.60 0.00 -0.15 -2.79 119.26 121.49 1pud h ALA 271 Ca 0.11 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1pud h ALA 271 Cb 0.56 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1pud h ALA 271 CO 0.03 0.66 -0.00 0.28 0.00 0.00 0.00 179.25 180.22 1pud h VAL 272 N 0.78 1.22 0.00 0.00 2.07 -0.83 -0.89 116.25 118.60 1pud h VAL 272 Ca 0.10 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1pud h VAL 272 Cb 0.79 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1pud h VAL 272 CO 0.07 0.32 -0.07 -0.33 0.02 0.00 0.00 177.57 177.58 1pud h GLU 273 N 0.63 0.00 -0.59 1.57 5.08 -1.19 -1.99 114.58 118.10 1pud h GLU 273 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1pud h GLU 273 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1pud h GLU 273 CO 0.02 0.07 0.00 0.54 -1.00 0.00 0.00 179.01 178.63 1pud n ARG 274 N -3.67 4.30 -0.50 2.33 1.74 -0.40 -3.95 116.66 116.51 1pud n ARG 274 Ca -0.02 -3.03 0.00 0.00 -0.77 0.00 0.00 57.85 54.03 1pud n ARG 274 Cb 0.17 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 29.53 1pud n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pud n GLY 275 N 0.77 0.73 3.77 -0.13 0.00 -0.75 -4.77 105.19 104.80 1pud n GLY 275 Ca 0.27 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1pud n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pud s ILE 276 N -2.00 4.65 -0.03 -0.61 -1.09 -0.82 -4.66 121.20 116.63 1pud s ILE 276 Ca 0.00 1.51 0.13 0.00 -2.23 0.00 0.00 60.65 60.05 1pud s ILE 276 Cb 0.00 -4.05 -0.20 0.00 -1.58 0.00 0.00 42.46 36.64 1pud s ILE 276 CO 0.00 0.46 0.25 0.47 -1.23 0.00 0.00 174.94 174.89 1pud n ASP 277 N 2.20 2.00 -3.97 3.58 8.00 0.65 -4.40 116.55 124.60 1pud n ASP 277 Ca -0.06 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.32 1pud n ASP 277 Cb 0.50 1.47 -0.12 0.00 -0.02 0.00 0.00 41.12 42.95 1pud n ASP 277 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1pud s MET 278 N -2.82 0.31 0.05 -1.24 -1.94 -0.75 -0.70 119.30 112.22 1pud s MET 278 Ca -0.05 -0.43 -0.03 0.00 -1.71 0.00 0.00 55.69 53.48 1pud s MET 278 Cb 0.08 -0.11 -0.03 0.00 2.01 0.00 0.00 34.83 36.78 1pud s MET 278 CO 0.54 0.02 0.02 -0.06 -0.01 0.00 0.00 175.02 175.52 1pud s PHE 279 N -0.85 0.42 -0.11 -0.03 0.40 -0.38 -1.20 117.98 116.22 1pud s PHE 279 Ca -0.07 -0.91 -0.24 0.00 -0.60 0.00 0.00 56.93 55.10 1pud s PHE 279 Cb -0.06 -0.30 0.06 0.00 0.51 0.00 0.00 43.02 43.22 1pud s PHE 279 CO -0.00 -0.40 0.58 0.16 0.70 0.00 0.00 175.22 176.26 1pud s ASP 280 N -2.78 -0.56 -0.23 1.36 -4.77 -1.25 -0.49 116.67 107.95 1pud s ASP 280 Ca 0.05 0.78 -0.31 0.00 -3.30 0.00 0.00 52.55 49.77 1pud s ASP 280 Cb 0.06 0.75 0.16 0.00 -1.09 0.00 0.00 42.92 42.81 1pud s ASP 280 CO -0.09 -0.43 1.24 0.00 0.70 0.00 0.00 175.17 176.59 1pud n VAL 282 N 0.40 0.07 -0.23 0.00 0.24 -1.26 -4.29 118.33 113.26 1pud n VAL 282 Ca -0.02 -0.05 -0.12 0.00 -2.04 0.00 0.00 64.34 62.11 1pud n VAL 282 Cb 0.58 -0.05 -0.10 0.00 -1.47 0.00 0.00 33.84 32.81 1pud n VAL 282 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1pud h LEU 283 N 0.00 -1.89 -0.64 1.34 5.85 -1.95 0.13 115.31 118.15 1pud h LEU 283 Ca 0.00 0.26 0.13 0.00 0.84 0.00 0.00 57.88 59.12 1pud h LEU 283 Cb 0.54 0.80 -0.10 0.00 0.37 0.00 0.00 40.66 42.27 1pud h LEU 283 CO 0.00 -0.32 0.04 1.55 -0.34 0.00 0.00 178.44 179.37 1pud h PRO 284 N -0.24 0.15 -0.20 5.25 0.13 -1.92 0.44 132.00 135.62 1pud h PRO 284 Ca 0.10 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 65.15 1pud h PRO 284 Cb 0.50 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.60 1pud h PRO 284 CO -0.69 0.10 -0.14 1.79 -0.23 0.00 0.00 178.00 178.83 1pud h THR 285 N 0.15 1.32 0.88 1.56 1.35 -1.77 -2.24 112.91 114.17 1pud h THR 285 Ca 0.34 -1.26 -0.04 0.00 -0.55 0.00 0.00 66.41 64.90 1pud h THR 285 Cb 0.55 1.71 0.01 0.00 -1.73 0.00 0.00 68.15 68.69 1pud h THR 285 CO -0.52 0.38 -0.43 -0.09 -0.25 0.00 0.00 175.52 174.61 1pud h ARG 286 N 0.12 -1.15 -0.56 4.72 2.43 -0.02 -2.72 114.38 117.20 1pud h ARG 286 Ca 0.04 0.08 0.08 0.00 -0.81 0.00 0.00 59.98 59.37 1pud h ARG 286 Cb 0.66 0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1pud h ARG 286 CO 0.04 -0.77 0.37 0.66 -1.51 0.00 0.00 179.97 178.76 1pud h SER 287 N -1.20 0.39 -0.51 -3.80 4.64 -0.24 -1.61 113.55 111.21 1pud h SER 287 Ca -0.12 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1pud h SER 287 Cb 0.92 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 62.88 1pud h SER 287 CO 0.19 0.24 0.22 1.23 -0.87 0.00 0.00 176.83 177.84 1pud h GLY 288 N 0.43 0.71 2.00 -0.77 0.00 -1.10 0.11 103.07 104.45 1pud h GLY 288 Ca 0.25 -0.14 -0.08 0.00 0.00 0.00 0.00 47.33 47.36 1pud h GLY 288 CO -0.07 0.06 -0.40 -0.09 0.00 0.00 0.00 176.54 176.04 1pud h ARG 289 N 0.43 0.00 0.00 4.80 2.43 -1.06 -2.93 114.38 118.05 1pud h ARG 289 Ca 0.24 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1pud h ARG 289 Cb 0.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1pud h ARG 289 CO -0.21 0.40 -0.07 0.09 -1.51 0.00 0.00 179.97 178.67 1pud n ASN 290 N -3.93 0.71 0.00 -3.80 5.03 -0.24 -4.92 115.26 108.10 1pud n ASN 290 Ca -0.02 0.51 0.00 0.00 0.87 0.00 0.00 54.58 55.95 1pud n ASN 290 Cb 0.45 -0.65 0.00 0.00 -1.02 0.00 0.00 39.78 38.55 1pud n ASN 290 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1pud n GLY 291 N 1.34 0.87 3.67 7.41 0.00 -0.15 -4.94 105.19 113.38 1pud n GLY 291 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1pud n GLY 291 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pud s GLN 292 N -1.00 4.13 -0.04 1.61 0.74 -0.17 -0.34 119.66 124.60 1pud s GLN 292 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 55.36 55.46 1pud s GLN 292 Cb 0.00 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.55 1pud s GLN 292 CO 0.00 0.01 -0.16 0.00 -0.55 0.00 0.00 175.29 174.59 1pud s ALA 293 N 1.17 2.60 -0.01 1.58 0.00 -0.12 -3.78 121.76 123.20 1pud s ALA 293 Ca 0.14 -1.01 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 1pud s ALA 293 Cb -0.14 -0.90 -0.06 0.00 0.00 0.00 0.00 23.12 22.03 1pud s ALA 293 CO 0.06 0.55 0.47 -0.06 0.00 0.00 0.00 175.76 176.79 1pud s PHE 294 N -0.73 3.70 0.12 0.00 0.08 -1.26 -1.03 117.98 118.86 1pud s PHE 294 Ca 0.12 1.05 -0.01 0.00 0.12 0.00 0.00 56.93 58.21 1pud s PHE 294 Cb -0.11 -2.41 -0.04 0.00 -0.57 0.00 0.00 43.02 39.89 1pud s PHE 294 CO 0.01 0.51 0.03 0.95 -0.10 0.00 0.00 175.22 176.62 1pud s THR 295 N -0.68 0.23 -0.22 0.64 -4.23 -1.05 -4.88 115.64 105.45 1pud s THR 295 Ca 0.26 -1.90 0.25 0.00 -1.18 0.00 0.00 61.69 59.11 1pud s THR 295 Cb -0.17 -1.94 0.25 0.00 1.34 0.00 0.00 72.50 71.98 1pud s THR 295 CO 0.14 -0.58 1.75 -0.50 -0.54 0.00 0.00 174.62 174.89 1pud h TRP 296 N 2.90 0.00 -0.56 3.99 4.06 -1.96 -1.27 115.95 123.11 1pud h TRP 296 Ca -0.35 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.47 1pud h TRP 296 Cb 1.19 0.00 -0.08 0.00 -1.00 0.00 0.00 29.16 29.27 1pud h TRP 296 CO 0.47 0.00 0.13 -0.25 -3.56 0.00 0.00 178.44 175.23 1pud n ASP 297 N -2.35 4.46 0.00 -3.49 8.00 -1.26 -3.12 116.55 118.79 1pud n ASP 297 Ca -0.00 -3.20 0.00 0.00 0.71 0.00 0.00 54.79 52.30 1pud n ASP 297 Cb 0.12 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 1pud n ASP 297 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pud n GLY 298 N -0.26 1.10 3.82 0.44 0.00 -0.48 -4.80 105.19 105.01 1pud n GLY 298 Ca 0.34 -2.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.03 1pud n GLY 298 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1pud s PRO 299 N -1.86 3.57 0.04 1.61 0.02 -1.26 -2.53 135.00 134.59 1pud s PRO 299 Ca 0.00 1.09 0.03 0.00 0.02 0.00 0.00 61.00 62.14 1pud s PRO 299 Cb 0.00 -2.07 -0.02 0.00 0.02 0.00 0.00 34.50 32.42 1pud s PRO 299 CO 0.00 -0.59 -0.09 0.96 -0.33 0.00 0.00 177.00 176.94 1pud s ILE 300 N -2.55 0.70 -0.38 2.83 -4.36 -0.20 -4.94 121.20 112.31 1pud s ILE 300 Ca 0.61 -1.03 -0.12 0.00 -0.26 0.00 0.00 60.65 59.85 1pud s ILE 300 Cb -0.13 -0.72 0.02 0.00 1.25 0.00 0.00 42.46 42.88 1pud s ILE 300 CO 0.35 -0.26 0.24 0.21 0.24 0.00 0.00 174.94 175.72 1pud s ASN 301 N -1.41 5.87 0.63 4.36 3.84 -1.26 -0.95 114.94 126.01 1pud s ASN 301 Ca -0.06 -0.89 0.42 0.00 0.21 0.00 0.00 52.86 52.54 1pud s ASN 301 Cb -0.09 -2.07 2.29 0.00 -0.55 0.00 0.00 41.25 40.83 1pud s ASN 301 CO 0.01 -0.38 2.29 -0.29 -2.79 0.00 0.00 177.10 175.94 1pud h ILE 302 N 5.75 0.00 0.00 -5.21 6.09 -1.06 -2.32 117.51 120.76 1pud h ILE 302 Ca -0.27 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 63.17 1pud h ILE 302 Cb 1.12 0.94 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 1pud h ILE 302 CO 0.68 0.00 -0.22 0.03 -3.07 0.00 0.00 178.15 175.57 1pud h ARG 303 N 0.00 0.00 -6.90 2.19 3.08 -1.88 -3.41 114.38 107.46 1pud h ARG 303 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 1pud h ARG 303 Cb 0.01 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.15 1pud h ARG 303 CO 0.00 0.22 0.77 1.21 -1.07 0.00 0.00 179.97 181.10 1pud s ASN 304 N -6.19 6.45 0.57 7.04 3.84 -0.88 -4.87 114.94 120.90 1pud s ASN 304 Ca 0.00 2.95 0.28 0.00 0.21 0.00 0.00 52.86 56.30 1pud s ASN 304 Cb 0.10 -2.66 1.48 0.00 -0.55 0.00 0.00 41.25 39.62 1pud s ASN 304 CO 0.63 -0.80 1.94 0.00 -2.79 0.00 0.00 177.10 176.08 1pud h ALA 305 N 3.44 2.33 0.00 1.71 0.00 -1.91 -1.70 119.26 123.13 1pud h ALA 305 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1pud h ALA 305 Cb 1.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1pud h ALA 305 CO 0.67 -0.72 0.00 2.89 0.00 0.00 0.00 179.25 182.09 1pud n ARG 306 N -3.97 0.09 -0.08 0.00 1.85 -1.26 -1.35 116.66 111.94 1pud n ARG 306 Ca 0.10 0.46 0.12 0.00 -1.00 0.00 0.00 57.85 57.52 1pud n ARG 306 Cb 0.67 -1.72 0.17 0.00 -1.05 0.00 0.00 32.46 30.53 1pud n ARG 306 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1pud n PHE 307 N -1.89 0.20 -0.00 2.89 3.72 -0.64 -4.52 117.46 117.22 1pud n PHE 307 Ca 0.01 -0.10 0.13 0.00 -0.05 0.00 0.00 57.45 57.43 1pud n PHE 307 Cb 0.11 0.00 0.56 0.00 -0.94 0.00 0.00 39.48 39.21 1pud n PHE 307 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1pud h SER 308 N 4.46 0.24 0.00 4.37 4.64 -1.38 -2.79 113.55 123.09 1pud h SER 308 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1pud h SER 308 Cb 0.96 -0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.94 1pud h SER 308 CO 0.00 0.15 -0.43 -0.62 -0.87 0.00 0.00 176.83 175.05 1pud n GLU 309 N -4.46 0.87 -2.77 4.77 1.02 -1.26 -4.65 120.64 114.16 1pud n GLU 309 Ca 0.07 -2.35 -0.43 0.00 -0.02 0.00 0.00 57.16 54.43 1pud n GLU 309 Cb 0.36 -1.06 -0.03 0.00 -0.02 0.00 0.00 31.44 30.69 1pud n GLU 309 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1pud s ASP 310 N -2.43 6.63 0.00 1.62 -1.08 -1.06 -4.90 116.67 115.45 1pud s ASP 310 Ca 0.27 0.45 0.29 0.00 -0.52 0.00 0.00 52.55 53.04 1pud s ASP 310 Cb 0.27 -2.48 1.24 0.00 -1.46 0.00 0.00 42.92 40.49 1pud s ASP 310 CO -0.04 -0.98 1.89 0.18 0.52 0.00 0.00 175.17 176.74 1pud n LEU 311 N 7.07 0.21 -4.79 -1.34 7.99 -1.26 -0.79 117.00 124.10 1pud n LEU 311 Ca 0.08 0.22 -0.33 0.00 -0.01 0.00 0.00 56.01 55.96 1pud n LEU 311 Cb 0.48 -0.30 0.02 0.00 -0.11 0.00 0.00 43.42 43.51 1pud n LEU 311 CO 0.62 0.04 0.74 -0.54 -1.51 0.00 0.00 177.39 176.74 1pud s LYS 312 N -2.70 3.18 0.92 3.23 1.02 -1.26 -4.56 119.74 119.57 1pud s LYS 312 Ca 0.23 1.34 -0.12 0.00 0.02 0.00 0.00 55.97 57.44 1pud s LYS 312 Cb 0.20 -2.00 0.14 0.00 -0.52 0.00 0.00 37.83 35.64 1pud s LYS 312 CO 0.51 -0.94 1.12 -1.25 -0.92 0.00 0.00 175.35 173.87 1pud s PRO 313 N -3.90 1.08 0.27 -1.68 0.04 -1.26 -0.45 135.00 129.11 1pud s PRO 313 Ca 0.66 0.37 -0.00 0.00 0.04 0.00 0.00 61.00 62.07 1pud s PRO 313 Cb -0.19 -1.83 0.63 0.00 0.04 0.00 0.00 34.50 33.16 1pud s PRO 313 CO 0.36 -2.26 1.66 -0.07 0.04 0.00 0.00 177.00 176.73 1pud h LEU 314 N -1.54 0.03 -7.33 -3.56 4.07 -1.89 -3.38 115.31 101.71 1pud h LEU 314 Ca -0.51 0.18 -0.23 0.00 0.08 0.00 0.00 57.88 57.40 1pud h LEU 314 Cb 1.33 0.24 -0.32 0.00 1.08 0.00 0.00 40.66 42.98 1pud h LEU 314 CO 0.61 -0.11 -0.55 -0.62 -1.08 0.00 0.00 178.44 176.69 1pud s ASP 315 N -5.15 0.08 0.07 -0.43 -1.08 -1.26 -4.91 116.67 104.00 1pud s ASP 315 Ca -0.12 0.44 0.18 0.00 -0.52 0.00 0.00 52.55 52.53 1pud s ASP 315 Cb 0.24 0.37 0.76 0.00 -1.46 0.00 0.00 42.92 42.83 1pud s ASP 315 CO 0.77 -0.19 1.56 -1.20 0.52 0.00 0.00 175.17 176.63 1pud n SER 316 N 4.64 0.20 -0.56 -0.34 7.64 -1.26 -2.60 113.62 121.33 1pud n SER 316 Ca -0.18 0.55 0.06 0.00 1.01 0.00 0.00 58.87 60.31 1pud n SER 316 Cb 0.51 -0.59 0.08 0.00 -1.01 0.00 0.00 64.21 63.21 1pud n SER 316 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pud n GLU 317 N -1.71 1.28 -3.06 1.43 1.02 -1.26 -4.98 120.64 113.35 1pud n GLU 317 Ca 0.03 -1.47 -0.39 0.00 -0.02 0.00 0.00 57.16 55.31 1pud n GLU 317 Cb 0.20 -1.26 -0.05 0.00 -0.02 0.00 0.00 31.44 30.31 1pud n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pud n HIS 319 N 2.46 1.89 -1.62 0.00 1.44 -1.26 -4.76 115.22 113.37 1pud n HIS 319 Ca -0.05 -0.73 -0.31 0.00 -2.01 0.00 0.00 57.72 54.62 1pud n HIS 319 Cb 0.50 -0.46 0.05 0.00 0.12 0.00 0.00 29.99 30.20 1pud n HIS 319 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1pud h ALA 321 N -0.58 1.51 -0.05 0.00 0.00 -1.95 -2.47 119.26 115.72 1pud h ALA 321 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1pud h ALA 321 Cb 1.21 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1pud h ALA 321 CO 0.57 0.33 0.04 0.28 0.00 0.00 0.00 179.25 180.46 1pud h VAL 322 N 1.04 1.01 0.00 0.00 2.07 -1.92 -2.19 116.25 116.27 1pud h VAL 322 Ca 0.42 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.91 1pud h VAL 322 Cb 0.26 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1pud h VAL 322 CO -0.17 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.43 1pud n GLN 324 N -1.39 0.56 0.00 0.00 1.13 -0.89 -4.59 117.38 112.19 1pud n GLN 324 Ca 0.09 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.25 1pud n GLN 324 Cb 0.23 -1.79 0.00 0.00 0.11 0.00 0.00 30.24 28.79 1pud n GLN 324 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1pud n LYS 325 N -2.56 3.43 -4.35 -1.09 4.81 -0.88 -5.08 118.16 112.43 1pud n LYS 325 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.17 1pud n LYS 325 Cb 0.53 -1.00 -0.11 0.00 0.02 0.00 0.00 35.03 34.48 1pud n LYS 325 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1pud s TRP 326 N -1.99 2.46 0.43 5.64 0.51 0.41 -5.10 118.94 121.30 1pud s TRP 326 Ca 0.00 -0.29 0.01 0.00 -2.12 0.00 0.00 56.10 53.70 1pud s TRP 326 Cb 0.00 -1.24 -0.01 0.00 -0.81 0.00 0.00 33.47 31.42 1pud s TRP 326 CO 0.00 0.47 0.64 -1.54 -0.51 0.00 0.00 176.95 176.01 1pud s SER 327 N -2.58 5.87 0.23 2.95 1.04 -1.26 -4.45 113.70 115.50 1pud s SER 327 Ca 0.21 0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.79 1pud s SER 327 Cb -0.09 -1.51 0.22 0.00 0.10 0.00 0.00 66.02 64.74 1pud s SER 327 CO 0.11 -0.65 1.91 0.03 0.98 0.00 0.00 173.24 175.62 1pud h ARG 328 N 0.48 1.20 -0.67 4.02 3.08 -0.65 -2.39 114.38 119.45 1pud h ARG 328 Ca -0.46 -0.08 0.09 0.00 0.07 0.00 0.00 59.98 59.60 1pud h ARG 328 Cb 1.25 -0.27 -0.07 0.00 0.08 0.00 0.00 29.97 30.96 1pud h ARG 328 CO 0.57 0.80 0.31 0.00 -1.07 0.00 0.00 179.97 180.58 1pud h ALA 329 N 1.33 0.91 -0.19 0.04 0.00 -0.91 0.39 119.26 120.83 1pud h ALA 329 Ca 0.33 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.26 1pud h ALA 329 Cb -0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1pud h ALA 329 CO -0.07 -0.09 -0.06 -0.92 0.00 0.00 0.00 179.25 178.10 1pud h TYR 330 N 0.54 0.43 -0.61 0.00 3.20 -1.74 -1.75 116.97 117.05 1pud h TYR 330 Ca 0.33 -0.10 -0.07 0.00 3.14 0.00 0.00 58.73 62.03 1pud h TYR 330 Cb 0.36 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1pud h TYR 330 CO -0.12 0.65 0.10 0.82 -1.64 0.00 0.00 178.16 177.97 1pud h ILE 331 N 0.09 1.25 -0.38 1.81 2.04 -0.99 -0.81 117.51 120.52 1pud h ILE 331 Ca 0.05 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 64.97 1pud h ILE 331 Cb 0.52 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1pud h ILE 331 CO 0.02 0.36 0.17 -0.74 0.00 0.00 0.00 178.15 177.96 1pud h HIS 332 N 0.92 0.30 -0.16 1.37 2.76 -0.16 -0.29 115.15 119.90 1pud h HIS 332 Ca 0.19 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.38 1pud h HIS 332 Cb 0.40 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 1pud h HIS 332 CO 0.03 0.14 0.10 1.25 -1.30 0.00 0.00 177.93 178.15 1pud h HIS 333 N 0.35 0.19 -0.37 5.26 -0.00 -0.73 -1.30 115.15 118.55 1pud h HIS 333 Ca 0.17 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.55 1pud h HIS 333 Cb 0.11 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 27.44 1pud h HIS 333 CO -0.12 0.12 0.23 -0.07 -0.00 0.00 0.00 177.93 178.09 1pud h LEU 334 N 0.21 0.39 -0.32 0.26 4.07 -0.76 -0.38 115.31 118.76 1pud h LEU 334 Ca 0.06 -0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.97 1pud h LEU 334 Cb -0.02 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 1pud h LEU 334 CO -0.02 0.28 0.02 0.40 -1.08 0.00 0.00 178.44 178.04 1pud h ILE 335 N 0.47 1.25 0.00 1.22 1.08 -0.97 0.07 117.51 120.62 1pud h ILE 335 Ca 0.14 -0.91 -0.02 0.00 -0.39 0.00 0.00 64.86 63.68 1pud h ILE 335 Cb -0.03 1.21 -0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1pud h ILE 335 CO -0.05 0.30 -0.11 0.03 -0.69 0.00 0.00 178.15 177.63 1pud h ARG 336 N 0.37 0.00 -0.01 2.37 3.08 -1.06 -1.35 114.38 117.78 1pud h ARG 336 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1pud h ARG 336 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1pud h ARG 336 CO 0.01 0.11 -0.25 0.00 -1.07 0.00 0.00 179.97 178.77 1pud n ALA 337 N -2.19 3.06 -2.73 0.04 0.00 -0.17 -4.94 120.51 113.59 1pud n ALA 337 Ca -0.01 -0.37 -0.16 0.00 0.00 0.00 0.00 53.44 52.91 1pud n ALA 337 Cb 0.30 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 18.60 1pud n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pud n GLY 338 N 1.35 -0.18 3.78 0.00 0.00 -0.51 -4.99 105.19 104.65 1pud n GLY 338 Ca 0.12 -0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1pud n GLY 338 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pud s GLU 339 N -5.28 4.47 0.32 1.61 0.41 -0.10 -4.97 118.70 115.16 1pud s GLU 339 Ca 0.19 1.05 0.03 0.00 -0.41 0.00 0.00 54.97 55.83 1pud s GLU 339 Cb -0.08 -3.26 0.63 0.00 -1.78 0.00 0.00 34.13 29.63 1pud s GLU 339 CO 0.23 0.57 1.89 0.82 -0.49 0.00 0.00 175.26 178.28 1pud h ILE 340 N 3.42 0.97 0.00 -1.63 2.04 -1.94 0.33 117.51 120.71 1pud h ILE 340 Ca -0.47 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1pud h ILE 340 Cb 1.21 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1pud h ILE 340 CO 0.66 0.17 -0.02 0.25 0.00 0.00 0.00 178.15 179.20 1pud h LEU 341 N 0.91 0.00 -0.24 1.44 5.85 -1.93 -0.98 115.31 120.36 1pud h LEU 341 Ca 0.42 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.14 1pud h LEU 341 Cb 0.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1pud h LEU 341 CO -0.19 0.02 0.13 1.23 -0.34 0.00 0.00 178.44 179.30 1pud h GLY 342 N 0.08 0.35 1.02 3.75 0.00 -1.19 0.26 103.07 107.35 1pud h GLY 342 Ca -0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1pud h GLY 342 CO 0.00 0.15 0.18 0.00 0.00 0.00 0.00 176.54 176.88 1pud h ALA 343 N 1.02 0.84 0.09 3.60 0.00 -1.27 -1.51 119.26 122.03 1pud h ALA 343 Ca 0.08 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pud h ALA 343 Cb 0.06 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1pud h ALA 343 CO -0.01 0.53 -0.06 0.52 0.00 0.00 0.00 179.25 180.23 1pud h MET 344 N 0.93 -0.14 -0.38 0.00 2.07 -0.93 -1.17 114.93 115.30 1pud h MET 344 Ca 0.20 0.01 -0.04 0.00 -2.07 0.00 0.00 59.70 57.80 1pud h MET 344 Cb 0.32 0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.07 1pud h MET 344 CO -0.00 -0.09 0.08 -0.07 1.07 0.00 0.00 176.91 177.90 1pud h LEU 345 N -0.15 0.59 -0.45 1.22 4.07 -0.87 -1.96 115.31 117.77 1pud h LEU 345 Ca -0.01 -0.24 -0.02 0.00 0.08 0.00 0.00 57.88 57.69 1pud h LEU 345 Cb 0.12 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 41.69 1pud h LEU 345 CO 0.01 0.68 0.18 0.24 -1.08 0.00 0.00 178.44 178.47 1pud h MET 346 N 0.47 0.66 -0.53 1.13 2.86 -1.22 -2.04 114.93 116.26 1pud h MET 346 Ca 0.12 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1pud h MET 346 Cb 0.33 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1pud h MET 346 CO 0.00 0.60 0.12 1.15 1.06 0.00 0.00 176.91 179.84 1pud h THR 347 N 0.58 1.25 -0.30 2.22 2.02 -1.17 -0.96 112.91 116.54 1pud h THR 347 Ca 0.15 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 1pud h THR 347 Cb 0.18 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1pud h THR 347 CO -0.01 0.32 0.18 -0.08 0.37 0.00 0.00 175.52 176.30 1pud h GLU 348 N 0.75 0.40 -0.40 6.66 4.81 -1.24 -0.93 114.58 124.64 1pud h GLU 348 Ca 0.17 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1pud h GLU 348 Cb 0.35 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1pud h GLU 348 CO 0.00 0.31 0.20 1.25 -0.73 0.00 0.00 179.01 180.05 1pud h HIS 349 N 0.38 0.56 -0.60 0.92 2.76 -1.23 -1.19 115.15 116.75 1pud h HIS 349 Ca 0.11 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 1pud h HIS 349 Cb 0.01 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.77 1pud h HIS 349 CO -0.04 0.46 0.39 -0.91 -1.30 0.00 0.00 177.93 176.52 1pud h ASN 350 N 0.50 0.71 -0.46 3.26 -0.26 -0.91 0.29 115.58 118.70 1pud h ASN 350 Ca 0.14 -0.03 -0.07 0.00 -0.56 0.00 0.00 56.30 55.77 1pud h ASN 350 Cb 0.10 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.17 1pud h ASN 350 CO -0.02 0.53 0.01 0.40 -1.06 0.00 0.00 177.43 177.29 1pud h ILE 351 N 0.82 1.26 -0.84 2.81 2.04 -1.12 -2.11 117.51 120.38 1pud h ILE 351 Ca 0.22 -1.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 1pud h ILE 351 Cb -0.07 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 1pud h ILE 351 CO -0.05 0.36 0.42 0.00 0.00 0.00 0.00 178.15 178.88 1pud h ALA 352 N 0.92 1.15 -0.36 1.87 0.00 -0.66 -1.18 119.26 121.00 1pud h ALA 352 Ca 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1pud h ALA 352 Cb 0.49 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1pud h ALA 352 CO 0.02 0.65 0.20 0.35 0.00 0.00 0.00 179.25 180.47 1pud h PHE 353 N 1.19 0.49 -0.55 0.00 3.57 -0.23 -0.07 116.94 121.35 1pud h PHE 353 Ca 0.29 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.78 1pud h PHE 353 Cb 0.09 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1pud h PHE 353 CO 0.01 0.38 0.34 1.88 -2.23 0.00 0.00 178.31 178.70 1pud h TYR 354 N 0.46 0.71 -0.43 0.41 -1.99 -0.98 -0.26 116.97 114.89 1pud h TYR 354 Ca 0.13 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.80 1pud h TYR 354 Cb 0.05 -0.23 -0.02 0.00 2.00 0.00 0.00 36.73 38.53 1pud h TYR 354 CO -0.03 0.48 0.02 1.96 -0.00 0.00 0.00 178.16 180.59 1pud h GLN 355 N 0.74 0.69 -0.30 4.88 1.08 -0.93 -1.15 115.11 120.12 1pud h GLN 355 Ca 0.20 -0.16 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 1pud h GLN 355 Cb -0.04 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 1pud h GLN 355 CO -0.04 0.69 -0.39 1.96 -0.95 0.00 0.00 178.83 180.10 1pud h GLN 356 N 0.65 0.70 -0.35 1.46 4.20 -0.60 -1.45 115.11 119.72 1pud h GLN 356 Ca 0.14 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.48 1pud h GLN 356 Cb 0.38 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 1pud h GLN 356 CO 0.01 0.97 0.19 1.25 -0.67 0.00 0.00 178.83 180.59 1pud h LEU 357 N 0.58 0.43 -0.82 1.46 5.85 -0.55 -0.72 115.31 121.53 1pud h LEU 357 Ca 0.05 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1pud h LEU 357 Cb 0.92 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1pud h LEU 357 CO 0.08 0.39 0.45 0.24 -0.34 0.00 0.00 178.44 179.26 1pud h MET 358 N 0.44 1.15 -0.61 1.25 2.86 -1.00 -0.99 114.93 118.03 1pud h MET 358 Ca 0.12 -0.14 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1pud h MET 358 Cb 0.05 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 1pud h MET 358 CO -0.02 0.85 0.25 0.37 1.06 0.00 0.00 176.91 179.42 1pud h GLN 359 N 1.15 0.90 -0.31 1.72 5.75 -0.91 0.69 115.11 124.10 1pud h GLN 359 Ca 0.29 -0.16 -0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1pud h GLN 359 Cb 0.04 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 1pud h GLN 359 CO -0.05 0.76 -0.09 0.87 -2.65 0.00 0.00 178.83 177.68 1pud h LYS 360 N 0.84 0.52 -0.13 1.69 1.57 -0.71 -0.28 116.57 120.06 1pud h LYS 360 Ca 0.20 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1pud h LYS 360 Cb 0.19 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1pud h LYS 360 CO -0.02 0.61 -0.03 0.82 -0.57 0.00 0.00 179.45 180.26 1pud h ILE 361 N 0.49 1.29 -0.51 1.86 2.04 -0.60 -1.17 117.51 120.90 1pud h ILE 361 Ca 0.09 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.00 1pud h ILE 361 Cb 0.45 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1pud h ILE 361 CO 0.02 0.28 0.33 0.03 0.00 0.00 0.00 178.15 178.81 1pud h ARG 362 N -0.06 0.65 -0.37 2.37 3.08 -0.52 -1.57 114.38 117.95 1pud h ARG 362 Ca 0.03 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1pud h ARG 362 Cb 0.45 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1pud h ARG 362 CO 0.01 0.43 0.05 -0.44 -1.07 0.00 0.00 179.97 178.96 1pud h ASP 363 N 0.67 0.60 -0.25 7.04 3.32 -1.05 -1.65 116.42 125.09 1pud h ASP 363 Ca 0.20 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 1pud h ASP 363 Cb -0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1pud h ASP 363 CO -0.06 0.71 0.01 0.77 -1.72 0.00 0.00 179.24 178.95 1pud h SER 364 N 0.46 0.52 -0.12 6.45 4.64 -0.97 -1.00 113.55 123.53 1pud h SER 364 Ca 0.11 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 1pud h SER 364 Cb 0.37 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1pud h SER 364 CO 0.01 0.58 -0.08 0.40 -0.87 0.00 0.00 176.83 176.87 1pud h ILE 365 N 0.53 1.33 -0.17 0.95 2.04 -1.16 0.26 117.51 121.30 1pud h ILE 365 Ca 0.11 -1.16 0.05 0.00 1.00 0.00 0.00 64.86 64.87 1pud h ILE 365 Cb 0.33 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1pud h ILE 365 CO 0.01 0.33 0.15 0.28 0.00 0.00 0.00 178.15 178.92 1pud h SER 366 N -0.11 0.00 -0.37 1.72 0.02 -0.93 -0.74 113.55 113.14 1pud h SER 366 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1pud h SER 366 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1pud h SER 366 CO 0.02 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.09 1pud n GLU 367 N -4.16 2.52 -2.43 3.45 1.02 -0.41 -4.97 120.64 115.65 1pud n GLU 367 Ca 0.01 -2.29 -0.16 0.00 -0.02 0.00 0.00 57.16 54.71 1pud n GLU 367 Cb 0.28 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1pud n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pud n GLY 368 N 1.51 -0.26 0.81 0.62 0.00 -0.29 -4.90 105.19 102.68 1pud n GLY 368 Ca 0.19 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.06 1pud n GLY 368 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pud n ARG 369 N -2.69 0.62 -0.09 1.61 1.85 0.80 -4.81 116.66 113.95 1pud n ARG 369 Ca -0.16 -2.21 -0.03 0.00 -1.00 0.00 0.00 57.85 54.45 1pud n ARG 369 Cb 0.63 -0.78 0.20 0.00 -1.05 0.00 0.00 32.46 31.46 1pud n ARG 369 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1pud h PHE 370 N 0.61 0.78 -0.54 2.89 3.57 -1.77 -1.06 116.94 121.42 1pud h PHE 370 Ca -0.08 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.33 1pud h PHE 370 Cb 1.41 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.90 1pud h PHE 370 CO 0.28 0.70 0.33 1.03 -2.23 0.00 0.00 178.31 178.43 1pud h SER 371 N 0.70 0.64 -0.45 0.41 0.87 -1.89 0.44 113.55 114.28 1pud h SER 371 Ca 0.15 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.53 1pud h SER 371 Cb 0.38 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1pud h SER 371 CO 0.01 0.50 -0.21 -0.61 -0.53 0.00 0.00 176.83 175.99 1pud h GLN 372 N 0.73 0.93 -0.29 2.24 5.75 -1.87 -2.43 115.11 120.17 1pud h GLN 372 Ca 0.19 -0.41 0.02 0.00 -0.15 0.00 0.00 58.65 58.30 1pud h GLN 372 Cb -0.03 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 1pud h GLN 372 CO -0.04 1.07 0.15 0.35 -2.65 0.00 0.00 178.83 177.71 1pud h PHE 373 N 0.77 0.28 -0.79 3.99 3.57 -0.72 0.71 116.94 124.75 1pud h PHE 373 Ca 0.10 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1pud h PHE 373 Cb 0.79 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.40 1pud h PHE 373 CO 0.06 0.16 0.52 0.00 -2.23 0.00 0.00 178.31 176.81 1pud h ALA 374 N 1.14 1.00 -0.24 2.41 0.00 -0.88 0.28 119.26 122.98 1pud h ALA 374 Ca 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1pud h ALA 374 Cb 0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1pud h ALA 374 CO -0.07 0.42 0.07 0.37 0.00 0.00 0.00 179.25 180.04 1pud h GLN 375 N 1.07 0.38 -0.43 0.00 4.15 -1.01 -1.54 115.11 117.73 1pud h GLN 375 Ca 0.29 -0.08 -0.13 0.00 0.77 0.00 0.00 58.65 59.50 1pud h GLN 375 Cb -0.12 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 1pud h GLN 375 CO -0.06 0.47 -0.23 -0.44 -1.93 0.00 0.00 178.83 176.63 1pud h ASP 376 N 0.22 0.91 0.16 -0.69 3.32 -0.61 -2.19 116.42 117.54 1pud h ASP 376 Ca 0.08 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1pud h ASP 376 Cb 0.25 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1pud h ASP 376 CO -0.00 1.10 -0.08 0.15 -1.72 0.00 0.00 179.24 178.69 1pud h PHE 377 N 0.77 -0.20 -0.80 4.55 3.57 -0.30 -1.96 116.94 122.57 1pud h PHE 377 Ca 0.10 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.62 1pud h PHE 377 Cb 0.78 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.54 1pud h PHE 377 CO 0.05 -0.09 0.52 0.00 -2.23 0.00 0.00 178.31 176.55 1pud h ARG 378 N -0.25 1.00 -0.66 1.11 3.08 -1.25 0.18 114.38 117.59 1pud h ARG 378 Ca -0.02 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 59.99 1pud h ARG 378 Cb 0.20 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.98 1pud h ARG 378 CO 0.04 0.66 0.42 0.00 -1.07 0.00 0.00 179.97 180.01 1pud h ALA 379 N 1.32 0.85 0.13 0.04 0.00 -1.19 -2.10 119.26 118.30 1pud h ALA 379 Ca 0.31 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.99 1pud h ALA 379 Cb -0.05 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 17.54 1pud h ALA 379 CO -0.09 0.19 -0.86 -0.09 0.00 0.00 0.00 179.25 178.40 1pud h ARG 380 N 0.82 0.36 -0.56 0.00 2.43 -1.04 -3.33 114.38 113.07 1pud h ARG 380 Ca 0.26 -0.56 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1pud h ARG 380 Cb -0.01 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 1pud h ARG 380 CO -0.09 1.25 0.35 -0.92 -1.51 0.00 0.00 179.97 179.05 1pud h TYR 381 N -0.24 0.71 -0.03 2.20 3.20 -0.58 -3.41 116.97 118.81 1pud h TYR 381 Ca -0.14 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.74 1pud h TYR 381 Cb 1.65 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.68 1pud h TYR 381 CO 0.18 0.46 0.00 1.19 -1.64 0.00 0.00 178.16 178.35