#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mfd s ILE 29 N 0.00 5.02 -0.11 0.00 1.01 -1.26 -5.04 121.20 120.82 3mfd s ILE 29 Ca 0.00 1.28 0.01 0.00 0.00 0.00 0.00 60.65 61.94 3mfd s ILE 29 Cb 0.00 -3.98 0.02 0.00 0.01 0.00 0.00 42.46 38.51 3mfd s ILE 29 CO 0.00 0.14 -0.11 -0.62 0.00 0.00 0.00 174.94 174.36 3mfd s ASP 30 N 1.07 2.22 0.25 3.58 2.15 -1.26 -5.14 116.67 119.54 3mfd s ASP 30 Ca 0.32 -0.35 0.07 0.00 0.43 0.00 0.00 52.55 53.01 3mfd s ASP 30 Cb -0.16 -0.93 -0.05 0.00 -0.30 0.00 0.00 42.92 41.47 3mfd s ASP 30 CO 0.12 -0.06 -0.09 0.68 -0.17 0.00 0.00 175.17 175.65 3mfd s VAL 31 N 1.36 1.68 -2.65 1.11 -7.23 -1.26 -5.03 120.40 108.39 3mfd s VAL 31 Ca -0.00 -2.16 0.25 0.00 -1.81 0.00 0.00 61.98 58.25 3mfd s VAL 31 Cb -0.14 -2.29 0.26 0.00 0.56 0.00 0.00 36.38 34.77 3mfd s VAL 31 CO -0.05 -0.41 1.39 -1.20 -0.31 0.00 0.00 175.10 174.51 3mfd n SER 32 N -0.50 2.33 -4.77 4.85 7.64 -1.26 -4.96 113.62 116.94 3mfd n SER 32 Ca -0.06 -1.72 -0.36 0.00 1.01 0.00 0.00 58.87 57.73 3mfd n SER 32 Cb 0.62 0.08 -0.01 0.00 -1.01 0.00 0.00 64.21 63.89 3mfd n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mfd s ALA 33 N -2.10 2.93 0.08 -0.43 0.00 -1.26 -4.63 121.76 116.35 3mfd s ALA 33 Ca 0.29 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 52.95 3mfd s ALA 33 Cb 0.20 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 3mfd s ALA 33 CO 0.36 -0.60 1.42 0.87 0.00 0.00 0.00 175.76 177.82 3mfd h LYS 34 N 1.91 0.59 -5.24 0.00 1.79 -1.06 -3.44 116.57 111.11 3mfd h LYS 34 Ca -0.49 -0.29 -0.45 0.00 -2.18 0.00 0.00 60.65 57.24 3mfd h LYS 34 Cb 1.24 -0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 31.63 3mfd h LYS 34 CO 0.60 0.87 -0.80 -1.12 -1.08 0.00 0.00 179.45 177.92 3mfd s SER 35 N -6.35 1.59 0.08 0.86 0.01 -1.09 -4.56 113.70 104.25 3mfd s SER 35 Ca -0.13 -0.36 -0.20 0.00 1.31 0.00 0.00 55.95 56.57 3mfd s SER 35 Cb 0.08 -0.13 0.05 0.00 0.21 0.00 0.00 66.02 66.22 3mfd s SER 35 CO 0.80 0.09 0.49 0.00 0.41 0.00 0.00 173.24 175.03 3mfd s ALA 36 N -0.61 -1.23 0.02 1.44 0.00 -0.12 -0.90 121.76 120.36 3mfd s ALA 36 Ca 0.03 0.39 -0.20 0.00 0.00 0.00 0.00 51.96 52.18 3mfd s ALA 36 Cb -0.07 0.53 0.04 0.00 0.00 0.00 0.00 23.12 23.62 3mfd s ALA 36 CO 0.00 -0.57 0.46 -1.50 0.00 0.00 0.00 175.76 174.15 3mfd s ILE 37 N -2.96 0.04 -0.03 0.00 2.07 -0.48 -0.64 121.20 119.19 3mfd s ILE 37 Ca -0.02 -0.34 0.01 0.00 -1.41 0.00 0.00 60.65 58.88 3mfd s ILE 37 Cb -0.00 -0.90 0.02 0.00 0.13 0.00 0.00 42.46 41.71 3mfd s ILE 37 CO -0.06 -0.19 -0.03 -0.51 -1.91 0.00 0.00 174.94 172.24 3mfd s ILE 38 N -2.07 0.42 0.15 2.00 2.07 -0.42 -1.10 121.20 122.25 3mfd s ILE 38 Ca -0.08 -0.08 0.07 0.00 -1.41 0.00 0.00 60.65 59.15 3mfd s ILE 38 Cb -0.01 -0.45 -0.04 0.00 0.13 0.00 0.00 42.46 42.09 3mfd s ILE 38 CO 0.01 0.19 -0.15 0.27 -1.91 0.00 0.00 174.94 173.34 3mfd s ILE 39 N 0.79 1.53 -0.07 2.00 -4.36 -0.04 -1.00 121.20 120.04 3mfd s ILE 39 Ca -0.10 -1.87 -0.30 0.00 -0.26 0.00 0.00 60.65 58.13 3mfd s ILE 39 Cb -0.13 -1.72 -0.04 0.00 1.25 0.00 0.00 42.46 41.82 3mfd s ILE 39 CO -0.00 -0.43 1.51 -0.62 0.24 0.00 0.00 174.94 175.64 3mfd s ASP 40 N -2.68 6.77 0.49 4.36 2.15 -0.17 -1.53 116.67 126.06 3mfd s ASP 40 Ca 0.13 2.07 0.15 0.00 0.43 0.00 0.00 52.55 55.33 3mfd s ASP 40 Cb -0.04 -2.54 1.17 0.00 -0.30 0.00 0.00 42.92 41.21 3mfd s ASP 40 CO 0.04 -0.85 2.11 1.23 -0.17 0.00 0.00 175.17 177.53 3mfd h GLY 41 N 9.78 0.06 0.12 2.66 0.00 -0.82 0.32 103.07 115.19 3mfd h GLY 41 Ca -0.36 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 3mfd h GLY 41 CO 0.95 0.03 -0.06 0.00 0.00 0.00 0.00 176.54 177.46 3mfd h ALA 42 N 1.93 -0.17 0.00 3.60 0.00 -1.92 -3.40 119.26 119.31 3mfd h ALA 42 Ca 0.02 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3mfd h ALA 42 Cb 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3mfd h ALA 42 CO 0.00 -0.16 -1.19 -1.13 0.00 0.00 0.00 179.25 176.78 3mfd n SER 43 N -4.76 0.86 0.00 0.00 3.41 -1.24 -4.96 113.62 106.94 3mfd n SER 43 Ca -0.02 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 3mfd n SER 43 Cb 0.06 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 3mfd n SER 43 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mfd n GLY 44 N 1.28 0.83 3.76 5.00 0.00 0.11 -5.01 105.19 111.15 3mfd n GLY 44 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 3mfd n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mfd s ARG 45 N -0.30 4.21 -0.19 1.61 3.52 -1.25 -4.56 118.95 122.00 3mfd s ARG 45 Ca 0.00 2.41 -0.29 0.00 -0.13 0.00 0.00 55.73 57.72 3mfd s ARG 45 Cb 0.00 -3.06 -0.00 0.00 -1.56 0.00 0.00 34.95 30.33 3mfd s ARG 45 CO 0.00 -0.47 1.14 0.08 -0.81 0.00 0.00 175.30 175.25 3mfd s VAL 46 N -0.34 4.49 -0.16 7.11 1.01 -1.26 -1.00 120.40 130.25 3mfd s VAL 46 Ca 0.58 1.80 0.14 0.00 0.00 0.00 0.00 61.98 64.50 3mfd s VAL 46 Cb -0.44 -4.16 -0.24 0.00 0.00 0.00 0.00 36.38 31.54 3mfd s VAL 46 CO 0.49 -0.14 0.22 0.18 0.00 0.00 0.00 175.10 175.85 3mfd n LEU 47 N 6.34 0.57 -3.65 3.92 4.77 -0.17 -4.97 117.00 123.80 3mfd n LEU 47 Ca 0.13 0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 56.07 3mfd n LEU 47 Cb 0.46 0.24 -0.08 0.00 -2.33 0.00 0.00 43.42 41.71 3mfd n LEU 47 CO 0.54 0.52 0.24 -0.47 -1.33 0.00 0.00 177.39 176.89 3mfd s TYR 48 N -2.52 -0.50 -0.11 -1.77 5.04 -1.16 -5.00 117.35 111.33 3mfd s TYR 48 Ca -0.11 1.02 -0.18 0.00 -2.44 0.00 0.00 57.07 55.36 3mfd s TYR 48 Cb 0.07 0.24 0.04 0.00 0.35 0.00 0.00 41.96 42.66 3mfd s TYR 48 CO 0.81 -0.42 0.45 0.00 -1.34 0.00 0.00 175.55 175.05 3mfd s ALA 49 N -0.66 -1.13 -0.14 3.97 0.00 -1.26 -1.30 121.76 121.24 3mfd s ALA 49 Ca -0.08 1.04 -0.04 0.00 0.00 0.00 0.00 51.96 52.88 3mfd s ALA 49 Cb -0.03 -0.42 0.05 0.00 0.00 0.00 0.00 23.12 22.72 3mfd s ALA 49 CO 0.05 -0.25 0.09 0.21 0.00 0.00 0.00 175.76 175.86 3mfd s LYS 50 N -0.40 0.03 -1.56 0.00 2.20 0.18 -4.87 119.74 115.32 3mfd s LYS 50 Ca -0.05 0.07 -0.06 0.00 -0.36 0.00 0.00 55.97 55.57 3mfd s LYS 50 Cb -0.03 -1.41 0.06 0.00 -1.51 0.00 0.00 37.83 34.94 3mfd s LYS 50 CO 0.03 -0.57 0.39 -3.47 -0.36 0.00 0.00 175.35 171.37 3mfd n ASP 51 N 5.29 -0.72 0.05 1.43 2.03 -1.26 -0.94 116.55 122.42 3mfd n ASP 51 Ca -0.06 -1.11 0.13 0.00 0.52 0.00 0.00 54.79 54.26 3mfd n ASP 51 Cb 0.49 -2.41 0.50 0.00 -0.72 0.00 0.00 41.12 38.98 3mfd n ASP 51 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3mfd n GLU 52 N -4.42 0.10 -0.18 -0.67 0.00 -1.26 -2.68 120.64 111.53 3mfd n GLU 52 Ca -0.19 0.15 0.07 0.00 0.00 0.00 0.00 57.16 57.19 3mfd n GLU 52 Cb 0.63 -1.64 0.17 0.00 0.00 0.00 0.00 31.44 30.60 3mfd n GLU 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3mfd n HIS 53 N -1.82 0.48 -2.48 -1.84 8.25 -1.26 -1.19 115.22 115.36 3mfd n HIS 53 Ca 0.06 -0.41 -0.43 0.00 -0.26 0.00 0.00 57.72 56.68 3mfd n HIS 53 Cb 0.33 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.40 3mfd n HIS 53 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3mfd s GLN 54 N -1.03 4.29 0.13 -0.41 2.00 -1.09 -4.94 119.66 118.61 3mfd s GLN 54 Ca 0.27 1.61 -0.31 0.00 -2.00 0.00 0.00 55.36 54.93 3mfd s GLN 54 Cb 0.15 -3.66 -0.10 0.00 0.80 0.00 0.00 33.01 30.19 3mfd s GLN 54 CO 0.20 -0.58 1.81 0.15 -0.50 0.00 0.00 175.29 176.37 3mfd s LYS 55 N 2.90 4.14 0.06 1.67 1.02 -1.26 -4.41 119.74 123.86 3mfd s LYS 55 Ca 0.53 2.58 -0.05 0.00 0.02 0.00 0.00 55.97 59.06 3mfd s LYS 55 Cb -0.22 -3.54 -0.02 0.00 -0.52 0.00 0.00 37.83 33.54 3mfd s LYS 55 CO 0.16 -0.83 0.09 1.03 -0.92 0.00 0.00 175.35 174.88 3mfd s ARG 56 N 2.56 0.69 0.37 1.68 0.52 -0.08 -4.96 118.95 119.72 3mfd s ARG 56 Ca 0.80 -0.99 -0.28 0.00 -0.52 0.00 0.00 55.73 54.74 3mfd s ARG 56 Cb -0.46 0.26 -0.10 0.00 0.52 0.00 0.00 34.95 35.17 3mfd s ARG 56 CO 0.36 -0.18 1.36 1.03 0.02 0.00 0.00 175.30 177.89 3mfd s ARG 57 N -3.52 4.16 0.00 3.54 0.52 -1.26 -1.94 118.95 120.45 3mfd s ARG 57 Ca 0.03 2.32 0.00 0.00 -0.52 0.00 0.00 55.73 57.56 3mfd s ARG 57 Cb 0.04 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.56 3mfd s ARG 57 CO -0.09 -0.39 0.08 0.44 0.02 0.00 0.00 175.30 175.37 3mfd n ILE 58 N 0.50 0.00 -3.24 1.52 -5.35 -1.26 -4.83 119.36 106.69 3mfd n ILE 58 Ca 0.01 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 3mfd n ILE 58 Cb 0.41 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.32 3mfd n ILE 58 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3mfd n ALA 59 N -0.79 0.00 1.39 -1.28 0.00 -1.26 -3.22 120.51 115.36 3mfd n ALA 59 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3mfd n ALA 59 Cb 0.00 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.14 3mfd n ALA 59 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3mfd n SER 60 N -0.75 0.00 0.20 0.00 7.64 -1.25 -2.21 113.62 117.25 3mfd n SER 60 Ca 0.00 -0.46 0.14 0.00 1.01 0.00 0.00 58.87 59.57 3mfd n SER 60 Cb 0.00 -0.13 0.71 0.00 -1.01 0.00 0.00 64.21 63.78 3mfd n SER 60 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 3mfd h ILE 61 N 0.00 0.00 -1.09 0.44 3.07 -1.66 -0.57 117.51 117.70 3mfd h ILE 61 Ca 0.00 -0.12 0.32 0.00 1.55 0.00 0.00 64.86 66.61 3mfd h ILE 61 Cb 0.10 0.83 -0.12 0.00 -0.27 0.00 0.00 36.82 37.36 3mfd h ILE 61 CO 0.00 0.00 0.67 0.74 -1.05 0.00 0.00 178.15 178.51 3mfd h THR 62 N 0.00 0.37 0.00 0.16 2.02 -1.66 -2.06 112.91 111.74 3mfd h THR 62 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 3mfd h THR 62 Cb 0.15 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 3mfd h THR 62 CO 0.00 0.06 0.00 0.11 0.37 0.00 0.00 175.52 176.06 3mfd h LYS 63 N 0.33 0.00 -1.31 6.66 1.57 -1.28 -3.23 116.57 119.31 3mfd h LYS 63 Ca 0.69 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.47 3mfd h LYS 63 Cb 1.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.08 3mfd h LYS 63 CO -0.44 0.00 0.00 -0.89 -0.57 0.00 0.00 179.45 177.55 3mfd n ILE 64 N -2.41 0.00 0.00 1.86 5.41 -0.78 -1.04 119.36 122.40 3mfd n ILE 64 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3mfd n ILE 64 Cb 0.16 -0.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.76 3mfd n ILE 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 3mfd n THR 66 N 0.83 0.00 -0.13 1.39 -1.04 -1.22 -1.44 114.28 112.67 3mfd n THR 66 Ca 0.00 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.92 3mfd n THR 66 Cb 0.00 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 3mfd n THR 66 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mfd h ALA 67 N 0.00 0.49 -0.45 2.41 0.00 -1.41 -1.72 119.26 118.58 3mfd h ALA 67 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.84 3mfd h ALA 67 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3mfd h ALA 67 CO 0.00 0.05 0.25 0.28 0.00 0.00 0.00 179.25 179.82 3mfd h VAL 68 N 0.48 1.00 -0.37 0.00 2.07 -1.51 -0.08 116.25 117.85 3mfd h VAL 68 Ca 0.13 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.38 3mfd h VAL 68 Cb 0.11 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3mfd h VAL 68 CO -0.02 0.09 -0.19 -0.07 0.02 0.00 0.00 177.57 177.40 3mfd h LEU 69 N 0.49 0.71 -0.27 2.57 3.38 -1.80 -1.04 115.31 119.35 3mfd h LEU 69 Ca 0.19 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3mfd h LEU 69 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3mfd h LEU 69 CO -0.11 0.90 0.06 0.00 0.09 0.00 0.00 178.44 179.38 3mfd h ALA 70 N 1.16 0.35 -0.66 1.53 0.00 -0.94 -2.05 119.26 118.65 3mfd h ALA 70 Ca 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3mfd h ALA 70 Cb 0.67 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3mfd h ALA 70 CO 0.05 0.01 0.29 0.82 0.00 0.00 0.00 179.25 180.42 3mfd h ILE 71 N 0.26 1.23 0.00 0.00 2.04 -0.82 -2.63 117.51 117.59 3mfd h ILE 71 Ca 0.08 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.26 3mfd h ILE 71 Cb 0.29 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 3mfd h ILE 71 CO 0.00 0.28 0.00 -0.62 0.00 0.00 0.00 178.15 177.81 3mfd n GLU 72 N -4.45 0.00 0.26 2.37 1.02 -0.41 -3.71 120.64 115.73 3mfd n GLU 72 Ca 0.05 0.06 0.16 0.00 -0.02 0.00 0.00 57.16 57.42 3mfd n GLU 72 Cb 0.15 -1.50 0.62 0.00 -0.02 0.00 0.00 31.44 30.69 3mfd n GLU 72 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3mfd h SER 73 N 0.00 0.00 0.00 1.62 4.64 -0.97 -3.46 113.55 115.37 3mfd h SER 73 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mfd h SER 73 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3mfd h SER 73 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3mfd n GLY 74 N 0.14 0.48 3.12 -0.77 0.00 -1.24 -5.12 105.19 101.79 3mfd n GLY 74 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3mfd n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mfd s LYS 75 N -0.17 2.63 0.00 1.61 1.02 -1.26 -4.90 119.74 118.67 3mfd s LYS 75 Ca 0.00 -2.48 0.00 0.00 0.02 0.00 0.00 55.97 53.51 3mfd s LYS 75 Cb 0.00 -3.79 0.00 0.00 -0.52 0.00 0.00 37.83 33.52 3mfd s LYS 75 CO 0.00 -1.18 0.00 -0.25 -0.92 0.00 0.00 175.35 173.00 3mfd n ASP 77 N 3.61 0.00 -4.84 2.83 8.00 -1.26 -4.56 116.55 120.33 3mfd n ASP 77 Ca 0.07 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.25 3mfd n ASP 77 Cb 0.39 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.42 3mfd n ASP 77 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3mfd s GLN 78 N 0.00 4.10 -0.18 -1.24 -0.21 -1.26 -4.87 119.66 116.00 3mfd s GLN 78 Ca 0.00 0.83 -0.26 0.00 0.02 0.00 0.00 55.36 55.95 3mfd s GLN 78 Cb 0.00 -2.38 -0.01 0.00 1.00 0.00 0.00 33.01 31.62 3mfd s GLN 78 CO 0.00 0.11 0.87 0.99 -2.12 0.00 0.00 175.29 175.14 3mfd s THR 79 N -2.02 4.84 -0.09 -0.19 2.01 -1.26 -1.13 115.64 117.80 3mfd s THR 79 Ca 0.56 1.71 -0.11 0.00 0.31 0.00 0.00 61.69 64.16 3mfd s THR 79 Cb -0.10 -4.17 -0.05 0.00 0.01 0.00 0.00 72.50 68.19 3mfd s THR 79 CO 0.16 -0.02 0.26 -0.69 -0.69 0.00 0.00 174.62 173.65 3mfd s VAL 80 N 2.36 5.29 -0.30 3.82 1.01 0.16 -4.89 120.40 127.86 3mfd s VAL 80 Ca 0.39 0.50 -0.10 0.00 0.00 0.00 0.00 61.98 62.77 3mfd s VAL 80 Cb -0.16 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 3mfd s VAL 80 CO 0.11 0.56 0.15 -0.89 0.00 0.00 0.00 175.10 175.03 3mfd s THR 81 N -0.73 4.70 0.07 3.92 2.01 -1.26 -1.12 115.64 123.23 3mfd s THR 81 Ca 0.18 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 3mfd s THR 81 Cb -0.14 -3.35 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 3mfd s THR 81 CO 0.07 0.12 1.10 -0.69 -0.69 0.00 0.00 174.62 174.54 3mfd s VAL 82 N 1.64 4.28 0.56 3.82 1.01 -0.04 -4.89 120.40 126.78 3mfd s VAL 82 Ca 0.05 1.71 -0.06 0.00 0.00 0.00 0.00 61.98 63.68 3mfd s VAL 82 Cb -0.17 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 3mfd s VAL 82 CO 0.07 0.17 0.88 -0.94 0.00 0.00 0.00 175.10 175.28 3mfd s SER 83 N 0.76 5.84 0.25 3.32 1.04 -1.26 -0.27 113.70 123.39 3mfd s SER 83 Ca 0.54 0.85 -0.05 0.00 0.48 0.00 0.00 55.95 57.77 3mfd s SER 83 Cb -0.27 -1.94 0.28 0.00 0.10 0.00 0.00 66.02 64.20 3mfd s SER 83 CO 0.30 -0.91 1.90 0.00 0.98 0.00 0.00 173.24 175.51 3mfd h ALA 84 N -0.09 1.26 -0.52 5.32 0.00 -1.95 -2.47 119.26 120.81 3mfd h ALA 84 Ca -0.46 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.43 3mfd h ALA 84 Cb 1.24 -0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 3mfd h ALA 84 CO 0.61 0.64 0.17 -0.97 0.00 0.00 0.00 179.25 179.70 3mfd h ASN 85 N 1.26 0.14 -0.73 0.00 -1.24 -2.01 -2.83 115.58 110.17 3mfd h ASN 85 Ca 0.33 0.07 0.02 0.00 0.71 0.00 0.00 56.30 57.43 3mfd h ASN 85 Cb -0.06 0.07 -0.04 0.00 0.73 0.00 0.00 38.32 39.01 3mfd h ASN 85 CO -0.06 0.10 0.47 0.00 -1.29 0.00 0.00 177.43 176.65 3mfd h ALA 86 N 1.37 0.95 -0.49 1.57 0.00 -1.78 -2.97 119.26 117.91 3mfd h ALA 86 Ca 0.26 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3mfd h ALA 86 Cb 0.30 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3mfd h ALA 86 CO -0.28 0.28 0.20 0.28 0.00 0.00 0.00 179.25 179.73 3mfd h VAL 87 N 0.93 1.18 0.00 0.00 2.07 -1.30 -3.01 116.25 116.12 3mfd h VAL 87 Ca 0.29 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.24 3mfd h VAL 87 Cb -0.02 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 3mfd h VAL 87 CO -0.09 0.22 0.00 0.03 0.02 0.00 0.00 177.57 177.75 3mfd h ARG 88 N 0.70 0.00 -6.79 1.57 3.08 -1.39 -3.46 114.38 108.08 3mfd h ARG 88 Ca 0.17 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.69 3mfd h ARG 88 Cb 0.14 0.00 0.08 0.00 0.08 0.00 0.00 29.97 30.27 3mfd h ARG 88 CO -0.02 0.00 0.89 0.99 -1.07 0.00 0.00 179.97 180.76 3mfd s THR 89 N -3.42 2.10 0.87 2.04 2.01 -1.14 -4.99 115.64 113.11 3mfd s THR 89 Ca 0.03 0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.98 3mfd s THR 89 Cb 0.09 -3.05 0.12 0.00 0.01 0.00 0.00 72.50 69.67 3mfd s THR 89 CO 0.43 0.01 1.21 -1.61 -0.69 0.00 0.00 174.62 173.98 3mfd s GLU 90 N -0.38 1.42 1.86 4.92 2.02 -1.26 -4.67 118.70 122.61 3mfd s GLU 90 Ca 0.64 -0.01 0.00 0.00 0.02 0.00 0.00 54.97 55.62 3mfd s GLU 90 Cb -0.48 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 31.86 3mfd s GLU 90 CO 0.47 -1.95 0.00 0.41 0.02 0.00 0.00 175.26 174.21 3mfd n GLY 91 N -3.23 -1.57 3.54 -1.39 0.00 -1.26 -4.73 105.19 96.53 3mfd n GLY 91 Ca 0.10 -1.33 -0.45 0.00 0.00 0.00 0.00 46.02 44.33 3mfd n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3mfd n SER 92 N 0.11 0.56 -3.96 1.61 7.64 -1.26 -4.84 113.62 113.47 3mfd n SER 92 Ca 0.00 1.15 -0.08 0.00 1.01 0.00 0.00 58.87 60.95 3mfd n SER 92 Cb 0.00 -1.20 -0.08 0.00 -1.01 0.00 0.00 64.21 61.92 3mfd n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mfd s ALA 93 N -1.06 0.10 -1.60 -0.43 0.00 -1.26 -0.96 121.76 116.55 3mfd s ALA 93 Ca 0.60 -0.88 0.14 0.00 0.00 0.00 0.00 51.96 51.83 3mfd s ALA 93 Cb -0.75 0.46 0.23 0.00 0.00 0.00 0.00 23.12 23.06 3mfd s ALA 93 CO 0.59 -0.47 1.11 0.44 0.00 0.00 0.00 175.76 177.43 3mfd n ILE 94 N -0.02 0.40 -2.98 0.00 -5.35 -1.26 -4.76 119.36 105.39 3mfd n ILE 94 Ca -0.14 -0.70 -0.12 0.00 -0.27 0.00 0.00 62.75 61.53 3mfd n ILE 94 Cb 0.62 0.98 0.05 0.00 -1.74 0.00 0.00 39.64 39.56 3mfd n ILE 94 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3mfd n TYR 95 N 0.83 -1.49 -1.79 4.28 4.01 -1.26 -5.02 117.16 116.73 3mfd n TYR 95 Ca 0.11 0.59 -0.35 0.00 -0.16 0.00 0.00 57.90 58.09 3mfd n TYR 95 Cb 0.41 -3.71 0.06 0.00 -0.31 0.00 0.00 39.34 35.79 3mfd n TYR 95 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3mfd s LEU 96 N -4.71 3.53 0.20 7.72 1.43 -1.26 -5.06 118.68 120.53 3mfd s LEU 96 Ca 0.13 2.37 0.09 0.00 -1.03 0.00 0.00 54.13 55.69 3mfd s LEU 96 Cb -0.06 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.53 3mfd s LEU 96 CO 0.44 -1.84 -0.07 0.42 0.23 0.00 0.00 176.35 175.53 3mfd s THR 97 N -1.76 3.27 0.23 5.49 -4.23 -1.26 -4.83 115.64 112.55 3mfd s THR 97 Ca 0.76 -1.70 -0.31 0.00 -1.18 0.00 0.00 61.69 59.26 3mfd s THR 97 Cb -0.30 -2.65 -0.11 0.00 1.34 0.00 0.00 72.50 70.79 3mfd s THR 97 CO 0.38 -0.16 1.59 -0.70 -0.54 0.00 0.00 174.62 175.19 3mfd s GLU 98 N -3.00 4.17 0.00 3.99 2.12 -1.26 -1.93 118.70 122.79 3mfd s GLU 98 Ca 0.26 2.49 0.00 0.00 0.36 0.00 0.00 54.97 58.08 3mfd s GLU 98 Cb -0.08 -3.08 0.00 0.00 0.26 0.00 0.00 34.13 31.23 3mfd s GLU 98 CO 0.16 -0.62 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 3mfd n GLY 99 N 2.99 1.38 3.78 -1.50 0.00 0.63 -4.98 105.19 107.50 3mfd n GLY 99 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3mfd n GLY 99 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3mfd s GLN 100 N -0.13 4.17 -0.29 1.61 0.74 -0.81 -4.53 119.66 120.42 3mfd s GLN 100 Ca 0.00 2.48 -0.10 0.00 0.05 0.00 0.00 55.36 57.79 3mfd s GLN 100 Cb 0.00 -2.99 -0.03 0.00 1.10 0.00 0.00 33.01 31.09 3mfd s GLN 100 CO 0.00 -0.45 0.16 0.15 -0.55 0.00 0.00 175.29 174.60 3mfd s LYS 101 N -2.02 3.62 -0.02 1.67 -0.14 -1.26 -0.86 119.74 120.73 3mfd s LYS 101 Ca 0.52 -0.53 -0.00 0.00 -1.36 0.00 0.00 55.97 54.59 3mfd s LYS 101 Cb -0.45 -3.57 0.02 0.00 -1.68 0.00 0.00 37.83 32.15 3mfd s LYS 101 CO 0.61 -0.29 0.03 0.08 -0.76 0.00 0.00 175.35 175.01 3mfd s VAL 102 N 1.67 -0.03 0.35 3.17 1.01 -0.28 -4.94 120.40 121.35 3mfd s VAL 102 Ca 0.06 0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.88 3mfd s VAL 102 Cb -0.16 -0.07 -0.10 0.00 0.00 0.00 0.00 36.38 36.04 3mfd s VAL 102 CO 0.08 0.05 1.36 -0.75 0.00 0.00 0.00 175.10 175.84 3mfd s LYS 103 N 0.64 4.27 0.21 2.72 2.20 -1.26 0.36 119.74 128.88 3mfd s LYS 103 Ca -0.05 2.32 -0.09 0.00 -0.36 0.00 0.00 55.97 57.79 3mfd s LYS 103 Cb -0.08 -3.03 0.24 0.00 -1.51 0.00 0.00 37.83 33.45 3mfd s LYS 103 CO -0.02 -0.30 1.82 1.25 -0.36 0.00 0.00 175.35 177.75 3mfd h LEU 104 N 3.25 0.62 -0.74 5.43 5.85 -1.37 -1.84 115.31 126.50 3mfd h LEU 104 Ca -0.49 0.02 0.16 0.00 0.84 0.00 0.00 57.88 58.41 3mfd h LEU 104 Cb 1.23 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.05 3mfd h LEU 104 CO 0.65 0.40 0.19 0.50 -0.34 0.00 0.00 178.44 179.85 3mfd h LYS 105 N 0.75 0.28 -0.69 1.25 3.64 -1.85 -0.65 116.57 119.30 3mfd h LYS 105 Ca 0.30 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3mfd h LYS 105 Cb 0.15 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 3mfd h LYS 105 CO -0.17 0.19 0.34 -0.44 -2.27 0.00 0.00 179.45 177.10 3mfd h ASP 106 N 0.29 0.89 -0.98 4.20 3.32 -1.72 -1.85 116.42 120.58 3mfd h ASP 106 Ca 0.42 -0.12 0.05 0.00 0.02 0.00 0.00 57.03 57.40 3mfd h ASP 106 Cb 0.71 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.97 3mfd h ASP 106 CO -0.50 0.76 0.63 -0.07 -1.72 0.00 0.00 179.24 178.34 3mfd h LEU 107 N 0.95 1.03 -0.53 1.55 3.38 -0.92 -1.15 115.31 119.62 3mfd h LEU 107 Ca 0.24 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 3mfd h LEU 107 Cb 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3mfd h LEU 107 CO -0.03 0.68 -0.21 0.58 0.09 0.00 0.00 178.44 179.55 3mfd h VAL 108 N 1.18 1.27 -0.79 1.22 2.07 -0.61 0.12 116.25 120.71 3mfd h VAL 108 Ca 0.41 -1.37 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 3mfd h VAL 108 Cb 0.09 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 3mfd h VAL 108 CO -0.15 0.47 0.44 1.88 0.02 0.00 0.00 177.57 180.23 3mfd h TYR 109 N 0.84 1.08 -0.39 1.57 0.05 -1.09 -2.93 116.97 116.11 3mfd h TYR 109 Ca 0.11 -0.02 -0.11 0.00 0.05 0.00 0.00 58.73 58.76 3mfd h TYR 109 Cb 0.78 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 3mfd h TYR 109 CO 0.05 0.75 -0.20 0.78 -1.05 0.00 0.00 178.16 178.49 3mfd h GLY 110 N 1.10 0.83 0.33 3.88 0.00 -0.76 0.17 103.07 108.61 3mfd h GLY 110 Ca 0.28 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.92 3mfd h GLY 110 CO -0.05 0.63 0.00 -0.10 0.00 0.00 0.00 176.54 177.03 3mfd n LEU 111 N -4.12 0.00 0.00 3.11 7.94 0.39 -1.69 117.00 122.63 3mfd n LEU 111 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3mfd n LEU 111 Cb 0.42 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.37 3mfd n LEU 111 CO 0.44 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.90 3mfd n LEU 113 N -0.64 0.00 -0.22 -1.96 4.32 0.59 -1.41 117.00 117.68 3mfd n LEU 113 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 56.01 56.05 3mfd n LEU 113 Cb 0.00 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.79 3mfd n LEU 113 CO 0.00 0.00 0.18 0.54 -1.22 0.00 0.00 177.39 176.89 3mfd n ARG 114 N 0.00 2.18 -2.95 3.23 5.12 -0.68 -1.55 116.66 122.02 3mfd n ARG 114 Ca 0.00 -0.55 -0.22 0.00 -1.93 0.00 0.00 57.85 55.15 3mfd n ARG 114 Cb 0.00 -1.12 0.03 0.00 -1.16 0.00 0.00 32.46 30.21 3mfd n ARG 114 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3mfd n SER 115 N -0.40 -6.11 -4.65 0.55 2.88 -0.50 -4.58 113.62 100.81 3mfd n SER 115 Ca 0.04 -0.26 -0.42 0.00 -1.33 0.00 0.00 58.87 56.90 3mfd n SER 115 Cb 0.24 -4.94 -0.03 0.00 -0.75 0.00 0.00 64.21 58.73 3mfd n SER 115 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3mfd s GLY 116 N -2.65 1.37 0.09 0.46 0.00 -1.08 -4.51 107.32 101.00 3mfd s GLY 116 Ca 0.27 1.05 0.01 0.00 0.00 0.00 0.00 44.72 46.05 3mfd s GLY 116 CO 0.34 3.31 1.19 3.43 0.00 0.00 0.00 173.10 181.37 3mfd h ASN 117 N 10.67 0.22 -0.50 1.64 2.35 -1.34 -1.91 115.58 126.72 3mfd h ASN 117 Ca -0.44 -0.24 0.03 0.00 -0.55 0.00 0.00 56.30 55.10 3mfd h ASN 117 Cb 1.21 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 39.47 3mfd h ASN 117 CO 0.95 1.19 0.29 -2.24 -1.65 0.00 0.00 177.43 175.98 3mfd h ASP 118 N 0.04 0.47 -0.43 5.81 2.03 -1.75 -1.48 116.42 121.11 3mfd h ASP 118 Ca -0.08 0.01 0.06 0.00 -0.73 0.00 0.00 57.03 56.29 3mfd h ASP 118 Cb 1.88 -0.09 -0.05 0.00 -0.83 0.00 0.00 39.33 40.24 3mfd h ASP 118 CO 0.17 0.33 0.14 0.00 -1.03 0.00 0.00 179.24 178.85 3mfd h ALA 119 N 1.23 0.51 -0.45 4.15 0.00 -1.85 -1.40 119.26 121.44 3mfd h ALA 119 Ca 0.20 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.21 3mfd h ALA 119 Cb 0.03 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3mfd h ALA 119 CO -0.10 -0.26 0.23 0.00 0.00 0.00 0.00 179.25 179.13 3mfd h ALA 120 N 1.30 0.57 -0.59 0.00 0.00 -0.94 0.09 119.26 119.68 3mfd h ALA 120 Ca 0.21 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 3mfd h ALA 120 Cb 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3mfd h ALA 120 CO -0.23 -0.11 0.03 0.28 0.00 0.00 0.00 179.25 179.22 3mfd h VAL 121 N 0.47 1.26 -0.69 0.00 2.07 -1.03 -0.92 116.25 117.41 3mfd h VAL 121 Ca 0.19 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.54 3mfd h VAL 121 Cb 0.09 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3mfd h VAL 121 CO -0.13 0.40 0.17 0.00 0.02 0.00 0.00 177.57 178.03 3mfd h ALA 122 N 0.99 0.98 -0.24 1.67 0.00 -0.84 -0.15 119.26 121.67 3mfd h ALA 122 Ca 0.17 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3mfd h ALA 122 Cb 0.52 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mfd h ALA 122 CO 0.03 0.66 0.12 0.82 0.00 0.00 0.00 179.25 180.87 3mfd h ILE 123 N 1.05 1.14 -0.54 0.00 2.04 -0.90 -1.87 117.51 118.44 3mfd h ILE 123 Ca 0.22 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.68 3mfd h ILE 123 Cb 0.37 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3mfd h ILE 123 CO 0.00 0.14 0.34 0.00 0.00 0.00 0.00 178.15 178.64 3mfd h ALA 124 N 0.98 0.68 -0.25 1.87 0.00 -0.72 0.24 119.26 122.05 3mfd h ALA 124 Ca 0.08 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3mfd h ALA 124 Cb 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3mfd h ALA 124 CO -0.01 0.14 -0.30 0.93 0.00 0.00 0.00 179.25 180.02 3mfd h GLU 125 N 0.73 0.51 -0.14 0.00 5.08 -0.96 0.60 114.58 120.40 3mfd h GLU 125 Ca 0.20 -0.21 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 3mfd h GLU 125 Cb -0.05 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3mfd h GLU 125 CO -0.04 0.76 -0.47 1.25 -1.00 0.00 0.00 179.01 179.51 3mfd h HIS 126 N 0.44 0.75 0.22 4.33 2.76 -0.87 -0.84 115.15 121.94 3mfd h HIS 126 Ca 0.06 -0.31 -0.34 0.00 -2.20 0.00 0.00 60.37 57.58 3mfd h HIS 126 Cb 0.74 -0.12 0.03 0.00 1.55 0.00 0.00 27.41 29.60 3mfd h HIS 126 CO 0.03 1.08 -1.55 0.28 -1.30 0.00 0.00 177.93 176.46 3mfd h VAL 127 N 0.20 1.18 -0.13 5.26 2.07 -0.90 -3.35 116.25 120.59 3mfd h VAL 127 Ca -0.02 -2.68 0.00 0.00 0.82 0.00 0.00 66.70 64.82 3mfd h VAL 127 Cb 1.10 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.81 3mfd h VAL 127 CO 0.10 0.83 0.00 0.61 0.02 0.00 0.00 177.57 179.13 3mfd n GLY 128 N 1.75 0.76 4.01 2.17 0.00 0.20 -4.97 105.19 109.10 3mfd n GLY 128 Ca -0.19 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3mfd n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mfd n GLY 129 N 0.97 2.74 3.63 -0.02 0.00 -0.32 -4.05 105.19 108.13 3mfd n GLY 129 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 3mfd n GLY 129 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mfd s SER 130 N -0.53 -0.40 0.11 1.61 1.04 -1.24 -4.86 113.70 109.43 3mfd s SER 130 Ca 0.00 -0.32 -0.21 0.00 0.48 0.00 0.00 55.95 55.90 3mfd s SER 130 Cb 0.00 0.66 -0.08 0.00 0.10 0.00 0.00 66.02 66.70 3mfd s SER 130 CO 0.00 -1.15 1.73 -0.07 0.98 0.00 0.00 173.24 174.73 3mfd h LEU 131 N 2.02 -0.07 -1.02 2.42 3.38 -1.89 -1.50 115.31 118.64 3mfd h LEU 131 Ca -0.27 0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.76 3mfd h LEU 131 Cb 1.28 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 3mfd h LEU 131 CO 0.31 -0.02 0.66 0.44 0.09 0.00 0.00 178.44 179.92 3mfd h ASP 132 N 0.02 1.10 -0.43 -0.43 3.32 -1.95 -0.15 116.42 117.91 3mfd h ASP 132 Ca 0.05 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3mfd h ASP 132 Cb 0.07 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3mfd h ASP 132 CO -0.10 0.76 0.20 1.23 -1.72 0.00 0.00 179.24 179.61 3mfd h GLY 133 N 1.28 0.66 1.12 2.75 0.00 -1.72 -0.96 103.07 106.20 3mfd h GLY 133 Ca 0.39 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 3mfd h GLY 133 CO -0.12 0.32 0.02 -2.75 0.00 0.00 0.00 176.54 174.01 3mfd h PHE 134 N 0.55 1.15 -0.50 5.60 3.57 -0.74 -2.68 116.94 123.88 3mfd h PHE 134 Ca 0.15 -0.19 -0.07 0.00 3.53 0.00 0.00 57.97 61.39 3mfd h PHE 134 Cb 0.13 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 3mfd h PHE 134 CO -0.01 1.00 0.02 0.28 -2.23 0.00 0.00 178.31 177.37 3mfd h VAL 135 N 0.97 1.24 -0.02 1.41 2.07 -0.70 -3.43 116.25 117.79 3mfd h VAL 135 Ca 0.18 -1.00 -0.29 0.00 0.82 0.00 0.00 66.70 66.41 3mfd h VAL 135 Cb 0.53 0.84 0.07 0.00 -1.52 0.00 0.00 31.29 31.21 3mfd h VAL 135 CO 0.03 0.36 0.81 -1.22 0.02 0.00 0.00 177.57 177.57 3mfd n TYR 136 N -4.22 0.28 0.00 1.57 4.01 -0.40 -4.64 117.16 113.77 3mfd n TYR 136 Ca 0.03 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 3mfd n TYR 136 Cb 0.30 -1.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.06 3mfd n TYR 136 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3mfd n ASN 139 N 11.40 0.00 -0.19 7.72 3.02 -1.26 -4.62 115.26 131.33 3mfd n ASN 139 Ca 0.36 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.83 3mfd n ASN 139 Cb 0.42 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.61 3mfd n ASN 139 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3mfd h GLN 140 N 0.00 0.80 -0.61 3.52 4.15 -1.95 -1.76 115.11 119.26 3mfd h GLN 140 Ca 0.00 -0.14 -0.08 0.00 0.77 0.00 0.00 58.65 59.20 3mfd h GLN 140 Cb 0.00 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 3mfd h GLN 140 CO 0.00 0.70 0.08 -0.22 -1.93 0.00 0.00 178.83 177.46 3mfd h LYS 141 N 0.72 1.02 -0.52 1.69 1.63 -1.96 -1.24 116.57 117.92 3mfd h LYS 141 Ca 0.18 -0.28 0.05 0.00 -0.85 0.00 0.00 60.65 59.74 3mfd h LYS 141 Cb 0.19 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 31.66 3mfd h LYS 141 CO -0.02 0.96 0.26 0.00 -3.45 0.00 0.00 179.45 177.21 3mfd h ALA 142 N 1.01 0.66 -0.00 5.00 0.00 -1.92 -0.70 119.26 123.32 3mfd h ALA 142 Ca 0.18 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3mfd h ALA 142 Cb 0.45 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3mfd h ALA 142 CO 0.01 -0.09 -0.20 0.93 0.00 0.00 0.00 179.25 179.90 3mfd h GLU 143 N 0.50 -0.31 -0.72 0.00 5.08 -0.97 -2.35 114.58 115.81 3mfd h GLU 143 Ca 0.23 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.69 3mfd h GLU 143 Cb 0.15 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 3mfd h GLU 143 CO -0.17 -0.21 0.47 1.96 -1.00 0.00 0.00 179.01 180.07 3mfd h GLN 144 N -0.32 0.67 -0.00 2.33 4.20 -0.62 -0.69 115.11 120.67 3mfd h GLN 144 Ca 0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3mfd h GLN 144 Cb 0.40 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.03 3mfd h GLN 144 CO -0.19 0.44 -0.18 1.28 -0.67 0.00 0.00 178.83 179.52 3mfd n LEU 145 N -4.49 0.40 -0.80 1.46 4.77 -0.33 -5.10 117.00 112.91 3mfd n LEU 145 Ca 0.11 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 3mfd n LEU 145 Cb 0.27 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3mfd n LEU 145 CO 0.33 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3mfd n GLY 146 N 1.38 -2.22 0.00 -0.72 0.00 -0.27 -4.97 105.19 98.39 3mfd n GLY 146 Ca 0.11 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.46 3mfd n GLY 146 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mfd n LYS 148 N 0.52 0.00 -1.11 1.61 5.02 -1.26 -5.04 118.16 117.90 3mfd n LYS 148 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 3mfd n LYS 148 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.16 3mfd n LYS 148 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3mfd n ASN 149 N 0.00 3.20 -4.14 4.39 3.02 -1.26 -5.01 115.26 115.47 3mfd n ASN 149 Ca 0.00 -3.82 -0.24 0.00 -0.03 0.00 0.00 54.58 50.49 3mfd n ASN 149 Cb 0.00 -0.54 -0.15 0.00 -0.61 0.00 0.00 39.78 38.48 3mfd n ASN 149 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3mfd s THR 150 N -3.72 1.28 -0.07 3.41 2.01 -1.26 -4.15 115.64 113.14 3mfd s THR 150 Ca 0.45 -0.68 -0.03 0.00 0.31 0.00 0.00 61.69 61.74 3mfd s THR 150 Cb 0.40 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.88 3mfd s THR 150 CO -0.02 0.37 0.15 -0.60 -0.69 0.00 0.00 174.62 173.83 3mfd s ARG 151 N -0.29 0.06 0.01 4.92 3.52 -0.15 -4.99 118.95 122.04 3mfd s ARG 151 Ca 0.04 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.09 3mfd s ARG 151 Cb -0.07 -0.22 -0.04 0.00 -1.56 0.00 0.00 34.95 33.06 3mfd s ARG 151 CO -0.00 -0.22 0.08 -0.06 -0.81 0.00 0.00 175.30 174.28 3mfd s PHE 152 N 1.63 3.26 0.00 5.12 0.08 -1.26 -0.72 117.98 126.09 3mfd s PHE 152 Ca -0.04 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.18 3mfd s PHE 152 Cb -0.12 -1.71 0.00 0.00 -0.57 0.00 0.00 43.02 40.62 3mfd s PHE 152 CO -0.06 0.54 0.04 1.04 -0.10 0.00 0.00 175.22 176.68 3mfd n GLN 153 N 1.06 4.42 -3.78 0.44 1.13 -1.26 -4.88 117.38 114.51 3mfd n GLN 153 Ca -0.12 -0.04 -0.06 0.00 -1.94 0.00 0.00 57.00 54.85 3mfd n GLN 153 Cb 0.52 -0.41 -0.02 0.00 0.11 0.00 0.00 30.24 30.45 3mfd n GLN 153 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3mfd s ASN 154 N -0.64 -0.24 0.00 1.08 2.20 -1.26 -5.00 114.94 111.08 3mfd s ASN 154 Ca 0.00 -0.46 0.23 0.00 -0.94 0.00 0.00 52.86 51.69 3mfd s ASN 154 Cb 0.00 0.60 0.47 0.00 -2.00 0.00 0.00 41.25 40.31 3mfd s ASN 154 CO 0.00 -1.09 1.42 -0.81 -2.94 0.00 0.00 177.10 173.68 3mfd n PRO 155 N -0.45 2.37 0.00 3.55 -0.04 -1.26 -4.55 135.00 134.61 3mfd n PRO 155 Ca -0.06 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.35 3mfd n PRO 155 Cb 0.60 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 3mfd n PRO 155 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3mfd n HIS 156 N 1.28 0.00 -0.37 0.54 1.44 -1.26 -4.30 115.22 112.55 3mfd n HIS 156 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 3mfd n HIS 156 Cb 0.56 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.67 3mfd n HIS 156 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3mfd n GLY 157 N 2.18 0.77 3.73 -1.39 0.00 -1.26 -3.97 105.19 105.25 3mfd n GLY 157 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3mfd n GLY 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mfd n LEU 158 N 0.00 6.01 -3.70 0.99 4.77 -1.26 -4.07 117.00 119.75 3mfd n LEU 158 Ca 0.00 0.83 -0.42 0.00 -0.03 0.00 0.00 56.01 56.40 3mfd n LEU 158 Cb 0.00 -1.56 -0.00 0.00 -2.33 0.00 0.00 43.42 39.53 3mfd n LEU 158 CO 0.00 -0.99 2.35 0.47 -1.33 0.00 0.00 177.39 177.89 3mfd n ASP 159 N -1.86 5.86 -0.58 -1.43 8.00 -1.26 -4.47 116.55 120.82 3mfd n ASP 159 Ca 0.16 -3.01 0.07 0.00 0.71 0.00 0.00 54.79 52.72 3mfd n ASP 159 Cb 0.48 -1.50 0.06 0.00 -0.02 0.00 0.00 41.12 40.14 3mfd n ASP 159 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3mfd n ASP 160 N 3.81 2.19 -4.01 -2.24 5.68 -1.26 -4.98 116.55 115.74 3mfd n ASP 160 Ca 0.51 -1.60 -0.08 0.00 -0.50 0.00 0.00 54.79 53.12 3mfd n ASP 160 Cb 0.33 0.02 -0.09 0.00 -1.14 0.00 0.00 41.12 40.24 3mfd n ASP 160 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 3mfd s HIS 161 N -1.25 0.42 0.54 2.11 3.76 -1.26 -5.15 115.29 114.46 3mfd s HIS 161 Ca 0.17 -0.90 -0.14 0.00 -0.15 0.00 0.00 55.06 54.04 3mfd s HIS 161 Cb 0.12 -0.26 -0.06 0.00 1.11 0.00 0.00 32.58 33.49 3mfd s HIS 161 CO 0.19 -0.47 0.98 -1.21 -0.85 0.00 0.00 174.74 173.38 3mfd s GLU 162 N -3.92 3.80 -1.00 1.40 0.41 -1.26 -4.40 118.70 113.74 3mfd s GLU 162 Ca 0.09 0.82 -0.06 0.00 -0.41 0.00 0.00 54.97 55.41 3mfd s GLU 162 Cb 0.07 -2.14 0.01 0.00 -1.78 0.00 0.00 34.13 30.28 3mfd s GLU 162 CO -0.08 -0.36 0.87 0.09 -0.49 0.00 0.00 175.26 175.28 3mfd n ASN 163 N -2.00 -4.86 -4.26 -0.19 3.02 -1.26 -4.93 115.26 100.78 3mfd n ASN 163 Ca 0.06 -0.41 -0.36 0.00 -0.03 0.00 0.00 54.58 53.83 3mfd n ASN 163 Cb 0.54 -3.89 -0.13 0.00 -0.61 0.00 0.00 39.78 35.69 3mfd n ASN 163 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3mfd s HIS 164 N -3.24 3.20 0.14 3.10 2.46 -1.26 -4.47 115.29 115.22 3mfd s HIS 164 Ca 0.38 -1.43 -0.24 0.00 0.47 0.00 0.00 55.06 54.24 3mfd s HIS 164 Cb -0.17 -2.20 0.07 0.00 -0.13 0.00 0.00 32.58 30.15 3mfd s HIS 164 CO 0.54 -0.71 0.74 1.52 -2.47 0.00 0.00 174.74 174.37 3mfd s TYR 165 N 1.38 -0.36 0.00 3.88 -0.85 0.10 -4.56 117.35 116.94 3mfd s TYR 165 Ca -0.01 0.11 0.00 0.00 -0.52 0.00 0.00 57.07 56.64 3mfd s TYR 165 Cb -0.19 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.75 3mfd s TYR 165 CO 0.01 -0.86 0.00 0.45 -1.52 0.00 0.00 175.55 173.63 3mfd n SER 166 N -0.38 0.00 -4.24 -0.18 2.88 -0.82 -0.98 113.62 109.91 3mfd n SER 166 Ca -0.11 -0.75 -0.13 0.00 -1.33 0.00 0.00 58.87 56.55 3mfd n SER 166 Cb 0.62 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.98 3mfd n SER 166 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3mfd s THR 167 N -2.65 0.57 0.17 2.46 -4.23 -1.26 -0.91 115.64 109.79 3mfd s THR 167 Ca 0.00 -1.97 -0.14 0.00 -1.18 0.00 0.00 61.69 58.40 3mfd s THR 167 Cb 0.00 -2.18 0.06 0.00 1.34 0.00 0.00 72.50 71.71 3mfd s THR 167 CO 0.00 -0.40 1.78 0.00 -0.54 0.00 0.00 174.62 175.46 3mfd h ALA 168 N 2.68 0.67 -0.47 3.99 0.00 -1.76 -2.83 119.26 121.53 3mfd h ALA 168 Ca -0.37 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 3mfd h ALA 168 Cb 1.21 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3mfd h ALA 168 CO 0.62 0.18 0.28 -0.92 0.00 0.00 0.00 179.25 179.41 3mfd h TYR 169 N 0.70 0.62 0.00 0.00 5.03 -1.51 -0.96 116.97 120.86 3mfd h TYR 169 Ca 0.19 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.49 3mfd h TYR 169 Cb 0.03 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.11 3mfd h TYR 169 CO -0.02 0.43 0.00 -0.25 -1.32 0.00 0.00 178.16 177.00 3mfd n ASP 170 N -4.72 1.35 0.00 -2.11 9.92 -1.07 -1.65 116.55 118.28 3mfd n ASP 170 Ca 0.02 -0.93 0.00 0.00 -0.53 0.00 0.00 54.79 53.34 3mfd n ASP 170 Cb 0.05 -0.23 0.00 0.00 -0.64 0.00 0.00 41.12 40.30 3mfd n ASP 170 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3mfd n ALA 172 N 0.74 0.00 -0.11 2.24 0.00 -0.36 -1.15 120.51 121.86 3mfd n ALA 172 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3mfd n ALA 172 Cb 0.23 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.69 3mfd n ALA 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3mfd h ILE 173 N 0.00 0.98 -0.63 0.00 2.04 -1.59 -0.35 117.51 117.95 3mfd h ILE 173 Ca 0.00 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.75 3mfd h ILE 173 Cb 0.00 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 3mfd h ILE 173 CO 0.00 0.07 0.40 0.25 0.00 0.00 0.00 178.15 178.87 3mfd h LEU 174 N 0.38 0.67 -0.52 1.44 5.85 -1.42 -1.56 115.31 120.16 3mfd h LEU 174 Ca 0.16 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.73 3mfd h LEU 174 Cb 0.07 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3mfd h LEU 174 CO -0.11 0.47 -0.32 0.74 -0.34 0.00 0.00 178.44 178.88 3mfd h THR 175 N 0.80 1.28 -0.78 1.05 2.02 -1.75 0.13 112.91 115.65 3mfd h THR 175 Ca 0.25 -1.48 0.01 0.00 0.77 0.00 0.00 66.41 65.95 3mfd h THR 175 Cb -0.02 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 3mfd h THR 175 CO -0.09 0.49 0.52 0.50 0.37 0.00 0.00 175.52 177.31 3mfd h LYS 176 N 0.72 1.03 -0.07 6.66 3.64 -0.90 -2.79 116.57 124.86 3mfd h LYS 176 Ca 0.08 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3mfd h LYS 176 Cb 0.88 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 3mfd h LYS 176 CO 0.08 0.68 0.01 -0.92 -2.27 0.00 0.00 179.45 177.03 3mfd h TYR 177 N 1.06 0.13 0.00 1.91 3.20 -0.87 -3.21 116.97 119.18 3mfd h TYR 177 Ca 0.29 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.14 3mfd h TYR 177 Cb -0.12 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.11 3mfd h TYR 177 CO -0.02 0.35 0.00 0.00 -1.64 0.00 0.00 178.16 176.85 3mfd n ALA 178 N -2.26 1.17 0.00 1.82 0.00 0.43 -4.01 120.51 117.66 3mfd n ALA 178 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3mfd n ALA 178 Cb 0.17 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3mfd n ALA 178 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3mfd n LYS 180 N 1.48 0.00 -3.05 0.00 5.02 -1.22 -4.54 118.16 115.86 3mfd n LYS 180 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 3mfd n LYS 180 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 3mfd n LYS 180 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mfd s LEU 181 N 0.00 4.14 0.23 -0.35 1.43 -1.26 -4.95 118.68 117.93 3mfd s LEU 181 Ca 0.00 0.44 -0.09 0.00 -1.03 0.00 0.00 54.13 53.46 3mfd s LEU 181 Cb 0.00 -2.91 0.38 0.00 0.03 0.00 0.00 46.19 43.69 3mfd s LEU 181 CO 0.00 -0.57 1.65 0.11 0.23 0.00 0.00 176.35 177.77 3mfd h LYS 182 N 8.24 0.10 -0.51 1.70 6.56 -1.98 -0.98 116.57 129.71 3mfd h LYS 182 Ca -0.26 -0.01 -0.05 0.00 -1.06 0.00 0.00 60.65 59.28 3mfd h LYS 182 Cb 1.11 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.72 3mfd h LYS 182 CO 0.84 0.07 0.11 -0.44 -2.06 0.00 0.00 179.45 177.97 3mfd h ASP 183 N 0.11 0.72 -0.30 0.86 3.32 -1.93 -1.53 116.42 117.66 3mfd h ASP 183 Ca 0.38 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 57.21 3mfd h ASP 183 Cb 0.64 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 3mfd h ASP 183 CO -0.61 0.72 -0.18 0.22 -1.72 0.00 0.00 179.24 177.67 3mfd h TYR 184 N 0.75 0.76 -0.77 4.55 3.20 -1.48 -1.12 116.97 122.86 3mfd h TYR 184 Ca 0.16 -0.20 0.10 0.00 3.14 0.00 0.00 58.73 61.94 3mfd h TYR 184 Cb 0.29 -0.17 -0.08 0.00 1.54 0.00 0.00 36.73 38.31 3mfd h TYR 184 CO 0.02 0.90 0.41 1.96 -1.64 0.00 0.00 178.16 179.80 3mfd h GLN 185 N 0.41 0.66 0.04 1.82 4.20 -0.80 -0.02 115.11 121.43 3mfd h GLN 185 Ca 0.06 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 3mfd h GLN 185 Cb 0.71 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3mfd h GLN 185 CO 0.05 0.44 -0.02 -0.22 -0.67 0.00 0.00 178.83 178.40 3mfd h LYS 186 N 0.68 -0.06 -0.13 1.46 3.64 -1.10 -2.47 116.57 118.59 3mfd h LYS 186 Ca 0.38 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.76 3mfd h LYS 186 Cb 0.41 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3mfd h LYS 186 CO -0.27 0.34 0.03 0.82 -2.27 0.00 0.00 179.45 178.09 3mfd h ILE 187 N -0.47 1.20 0.00 2.00 2.04 -1.06 -2.83 117.51 118.40 3mfd h ILE 187 Ca -0.01 -0.63 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 3mfd h ILE 187 Cb 0.42 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3mfd h ILE 187 CO 0.01 0.19 -0.13 0.77 0.00 0.00 0.00 178.15 178.99 3mfd h SER 188 N -0.00 0.00 -0.03 1.72 4.64 -1.07 -1.87 113.55 116.94 3mfd h SER 188 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3mfd h SER 188 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3mfd h SER 188 CO 0.00 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 3mfd n GLY 189 N -1.02 -0.48 3.62 -0.77 0.00 -0.93 -3.54 105.19 102.06 3mfd n GLY 189 Ca -0.02 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 3mfd n GLY 189 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mfd s THR 190 N -1.97 4.92 0.05 2.61 2.01 -0.71 -4.91 115.64 117.65 3mfd s THR 190 Ca 0.39 1.16 -0.15 0.00 0.31 0.00 0.00 61.69 63.40 3mfd s THR 190 Cb 0.19 -4.01 -0.31 0.00 0.01 0.00 0.00 72.50 68.38 3mfd s THR 190 CO 0.32 -0.06 1.07 0.11 -0.69 0.00 0.00 174.62 175.36 3mfd h LYS 191 N 7.95 0.60 -3.84 4.92 1.57 -1.90 -3.41 116.57 122.46 3mfd h LYS 191 Ca -0.26 -0.87 -0.30 0.00 -1.87 0.00 0.00 60.65 57.35 3mfd h LYS 191 Cb 1.11 0.30 -0.31 0.00 0.08 0.00 0.00 32.23 33.41 3mfd h LYS 191 CO 0.81 1.40 -0.74 0.42 -0.57 0.00 0.00 179.45 180.78 3mfd s ILE 192 N -2.85 0.16 -0.04 1.86 -1.09 -1.26 -0.93 121.20 117.06 3mfd s ILE 192 Ca -0.09 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.33 3mfd s ILE 192 Cb 0.05 -0.20 0.03 0.00 -1.58 0.00 0.00 42.46 40.76 3mfd s ILE 192 CO 0.94 0.09 -0.01 -0.47 -1.23 0.00 0.00 174.94 174.26 3mfd s TYR 193 N 0.47 0.47 -0.30 3.97 5.04 -0.46 -5.00 117.35 121.54 3mfd s TYR 193 Ca -0.04 -0.07 -0.10 0.00 -2.44 0.00 0.00 57.07 54.42 3mfd s TYR 193 Cb -0.07 -0.51 -0.02 0.00 0.35 0.00 0.00 41.96 41.71 3mfd s TYR 193 CO -0.01 -0.16 0.16 0.21 -1.34 0.00 0.00 175.55 174.41 3mfd s LYS 194 N 1.06 3.50 0.49 4.97 2.20 -1.26 -0.75 119.74 129.94 3mfd s LYS 194 Ca -0.09 -0.62 -0.22 0.00 -0.36 0.00 0.00 55.97 54.68 3mfd s LYS 194 Cb -0.14 -3.58 -0.06 0.00 -1.51 0.00 0.00 37.83 32.54 3mfd s LYS 194 CO -0.01 -0.35 1.20 0.00 -0.36 0.00 0.00 175.35 175.82 3mfd s ALA 195 N 1.65 2.88 -0.03 3.13 0.00 -0.08 -4.95 121.76 124.37 3mfd s ALA 195 Ca 0.05 0.99 -0.25 0.00 0.00 0.00 0.00 51.96 52.76 3mfd s ALA 195 Cb -0.17 -3.42 -0.21 0.00 0.00 0.00 0.00 23.12 19.33 3mfd s ALA 195 CO 0.07 -0.83 1.16 0.93 0.00 0.00 0.00 175.76 177.10 3mfd h GLU 196 N 1.76 0.12 -1.14 0.00 5.08 -1.97 -3.44 114.58 114.99 3mfd h GLU 196 Ca -0.50 -0.09 -0.63 0.00 -1.00 0.00 0.00 59.36 57.14 3mfd h GLU 196 Cb 1.26 0.02 -0.36 0.00 0.50 0.00 0.00 28.75 30.17 3mfd h GLU 196 CO 0.59 0.72 0.01 0.25 -1.00 0.00 0.00 179.01 179.58 3mfd n THR 197 N -4.67 3.01 -3.83 1.13 -2.24 -1.26 -5.11 114.28 101.32 3mfd n THR 197 Ca -0.09 -3.95 -0.29 0.00 -2.27 0.00 0.00 64.05 57.46 3mfd n THR 197 Cb 0.37 -1.18 -0.12 0.00 -2.10 0.00 0.00 70.33 67.29 3mfd n THR 197 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3mfd s GLU 199 N -3.73 2.01 -0.03 -0.78 0.41 -1.26 -4.80 118.70 110.52 3mfd s GLU 199 Ca 0.55 -2.86 -0.06 0.00 -0.41 0.00 0.00 54.97 52.20 3mfd s GLU 199 Cb 0.44 -3.02 0.01 0.00 -1.78 0.00 0.00 34.13 29.78 3mfd s GLU 199 CO -0.08 -1.24 0.13 -1.12 -0.49 0.00 0.00 175.26 172.46 3mfd s SER 200 N -0.77 -0.05 -0.16 -0.19 0.01 -1.26 -5.04 113.70 106.24 3mfd s SER 200 Ca 0.23 0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.53 3mfd s SER 200 Cb -0.11 0.24 0.01 0.00 0.21 0.00 0.00 66.02 66.38 3mfd s SER 200 CO -0.11 -0.20 -0.20 -0.69 0.41 0.00 0.00 173.24 172.45 3mfd s VAL 201 N -0.64 2.13 -0.06 3.43 1.01 -1.26 -0.90 120.40 124.10 3mfd s VAL 201 Ca -0.07 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.01 3mfd s VAL 201 Cb -0.04 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 3mfd s VAL 201 CO 0.01 0.54 -0.18 0.26 0.00 0.00 0.00 175.10 175.73 3mfd s TRP 202 N 1.02 2.61 -0.12 5.22 0.51 0.07 -4.98 118.94 123.26 3mfd s TRP 202 Ca -0.02 -0.42 -0.04 0.00 -2.12 0.00 0.00 56.10 53.50 3mfd s TRP 202 Cb -0.14 -1.64 -0.03 0.00 -0.81 0.00 0.00 33.47 30.84 3mfd s TRP 202 CO -0.06 -0.01 0.02 0.21 -0.51 0.00 0.00 176.95 176.60 3mfd s LYS 203 N -0.38 3.37 0.25 4.98 2.20 -1.26 -1.35 119.74 127.54 3mfd s LYS 203 Ca 0.04 -0.38 -0.31 0.00 -0.36 0.00 0.00 55.97 54.96 3mfd s LYS 203 Cb -0.12 -2.95 -0.11 0.00 -1.51 0.00 0.00 37.83 33.13 3mfd s LYS 203 CO 0.02 0.54 1.61 1.21 -0.36 0.00 0.00 175.35 178.38 3mfd s ASN 204 N -0.42 6.43 0.00 1.43 3.84 -0.11 -4.67 114.94 121.44 3mfd s ASN 204 Ca 0.08 2.85 0.23 0.00 0.21 0.00 0.00 52.86 56.24 3mfd s ASN 204 Cb -0.12 -2.62 1.11 0.00 -0.55 0.00 0.00 41.25 39.07 3mfd s ASN 204 CO 0.02 -0.90 1.75 0.29 -2.79 0.00 0.00 177.10 175.47 3mfd n LYS 205 N 2.98 0.23 -2.49 0.43 5.02 -0.59 -4.63 118.16 119.10 3mfd n LYS 205 Ca 0.11 0.08 -0.40 0.00 -2.02 0.00 0.00 58.31 56.08 3mfd n LYS 205 Cb 0.37 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 3mfd n LYS 205 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3mfd s ASN 206 N -2.71 6.13 0.50 4.39 2.47 -1.26 -4.86 114.94 119.60 3mfd s ASN 206 Ca 0.18 -0.62 0.29 0.00 0.42 0.00 0.00 52.86 53.13 3mfd s ASN 206 Cb 0.15 -2.56 1.17 0.00 -1.45 0.00 0.00 41.25 38.57 3mfd s ASN 206 CO 0.37 -1.84 1.92 0.11 -3.72 0.00 0.00 177.10 173.94 3mfd h LYS 207 N 10.46 0.00 -0.52 0.43 1.79 -1.98 -1.82 116.57 124.93 3mfd h LYS 207 Ca -0.15 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.34 3mfd h LYS 207 Cb 1.05 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.67 3mfd h LYS 207 CO 1.31 0.10 0.32 -0.07 -1.08 0.00 0.00 179.45 180.03 3mfd h LEU 208 N 0.00 0.53 0.04 2.94 3.38 -1.94 0.07 115.31 120.33 3mfd h LEU 208 Ca -0.00 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3mfd h LEU 208 Cb 0.61 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3mfd h LEU 208 CO 0.01 0.37 -0.02 0.25 0.09 0.00 0.00 178.44 179.15 3mfd h LEU 209 N 0.64 -0.05 -0.24 1.67 5.85 -1.66 -1.76 115.31 119.76 3mfd h LEU 209 Ca 0.20 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3mfd h LEU 209 Cb -0.01 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3mfd h LEU 209 CO -0.08 0.39 0.00 0.71 -0.34 0.00 0.00 178.44 179.12 3mfd h THR 210 N -0.50 0.00 0.00 1.05 1.35 -1.32 -3.46 112.91 110.04 3mfd h THR 210 Ca -0.01 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 3mfd h THR 210 Cb 0.45 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 3mfd h THR 210 CO 0.01 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.46 3mfd n LEU 212 N -2.36 0.00 -3.77 3.87 4.77 0.00 -5.08 117.00 114.45 3mfd n LEU 212 Ca 0.04 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.75 3mfd n LEU 212 Cb 0.38 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.31 3mfd n LEU 212 CO 0.28 0.00 -0.38 -0.47 -1.33 0.00 0.00 177.39 175.49 3mfd s TYR 213 N -2.30 1.15 0.47 -1.77 5.04 -0.66 -5.01 117.35 114.27 3mfd s TYR 213 Ca 0.00 -0.89 0.38 0.00 -2.44 0.00 0.00 57.07 54.12 3mfd s TYR 213 Cb 0.00 -1.07 1.94 0.00 0.35 0.00 0.00 41.96 43.18 3mfd s TYR 213 CO 0.00 -0.60 2.21 -1.35 -1.34 0.00 0.00 175.55 174.47 3mfd h PRO 214 N 8.22 0.00 -0.02 4.97 0.10 -1.94 -1.90 132.00 141.42 3mfd h PRO 214 Ca -0.17 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.93 3mfd h PRO 214 Cb 1.12 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.22 3mfd h PRO 214 CO 0.34 0.02 -0.02 0.66 0.10 0.00 0.00 178.00 179.10 3mfd n TYR 215 N -3.24 0.00 -2.06 0.65 4.01 -1.26 -4.94 117.16 110.32 3mfd n TYR 215 Ca -0.02 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.31 3mfd n TYR 215 Cb 0.16 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.17 3mfd n TYR 215 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3mfd s SER 216 N -2.03 6.70 0.00 7.72 0.15 -0.72 -1.30 113.70 124.23 3mfd s SER 216 Ca 0.33 2.74 0.00 0.00 0.70 0.00 0.00 55.95 59.72 3mfd s SER 216 Cb 0.20 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 3mfd s SER 216 CO 0.33 -0.60 0.77 0.35 1.20 0.00 0.00 173.24 175.29 3mfd n THR 217 N 0.84 0.54 -0.63 6.45 -2.24 -0.14 -4.88 114.28 114.22 3mfd n THR 217 Ca 0.01 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 3mfd n THR 217 Cb 0.41 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 3mfd n THR 217 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mfd n GLY 218 N -0.27 0.69 0.00 3.38 0.00 -1.23 -3.66 105.19 104.09 3mfd n GLY 218 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.24 3mfd n GLY 218 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mfd n GLY 219 N 0.00 -0.21 3.33 -0.02 0.00 -1.23 -1.74 105.19 105.31 3mfd n GLY 219 Ca 0.00 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.35 3mfd n GLY 219 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mfd s LYS 220 N -2.00 0.47 0.34 1.61 2.47 0.14 -4.90 119.74 117.87 3mfd s LYS 220 Ca 0.00 0.76 0.04 0.00 -1.56 0.00 0.00 55.97 55.22 3mfd s LYS 220 Cb 0.00 0.10 -0.01 0.00 -1.46 0.00 0.00 37.83 36.45 3mfd s LYS 220 CO 0.00 -0.12 0.49 0.95 0.16 0.00 0.00 175.35 176.83 3mfd s THR 221 N 0.97 4.40 0.02 3.43 -4.23 -1.26 -1.47 115.64 117.51 3mfd s THR 221 Ca -0.06 -0.85 -0.23 0.00 -1.18 0.00 0.00 61.69 59.37 3mfd s THR 221 Cb -0.06 -3.56 0.05 0.00 1.34 0.00 0.00 72.50 70.27 3mfd s THR 221 CO -0.08 -0.26 0.53 -0.83 -0.54 0.00 0.00 174.62 173.44 3mfd s GLY 222 N -4.13 -0.43 -0.23 3.99 0.00 -0.09 -3.90 107.32 102.53 3mfd s GLY 222 Ca 0.43 0.72 -0.14 0.00 0.00 0.00 0.00 44.72 45.72 3mfd s GLY 222 CO 0.32 0.41 0.57 -0.47 0.00 0.00 0.00 173.10 173.94 3mfd s TYR 223 N -2.09 -0.82 0.16 1.90 5.04 -1.26 -0.81 117.35 119.46 3mfd s TYR 223 Ca -0.07 1.73 0.03 0.00 -2.44 0.00 0.00 57.07 56.32 3mfd s TYR 223 Cb -0.01 0.43 -0.05 0.00 0.35 0.00 0.00 41.96 42.68 3mfd s TYR 223 CO 0.01 -0.42 -0.05 0.95 -1.34 0.00 0.00 175.55 174.70 3mfd s THR 224 N 1.31 0.92 0.36 4.34 -4.23 -1.21 -4.76 115.64 112.36 3mfd s THR 224 Ca -0.08 -2.01 0.09 0.00 -1.18 0.00 0.00 61.69 58.51 3mfd s THR 224 Cb -0.06 -1.98 0.32 0.00 1.34 0.00 0.00 72.50 72.13 3mfd s THR 224 CO -0.14 -0.62 1.87 0.07 -0.54 0.00 0.00 174.62 175.26 3mfd h LYS 225 N 2.74 0.66 0.09 3.99 -0.00 -2.01 0.15 116.57 122.19 3mfd h LYS 225 Ca -0.37 -0.04 -0.31 0.00 -0.00 0.00 0.00 60.65 59.93 3mfd h LYS 225 Cb 1.19 -0.15 -0.02 0.00 -0.00 0.00 0.00 32.23 33.26 3mfd h LYS 225 CO 0.64 0.44 -1.65 -0.07 -0.00 0.00 0.00 179.45 178.80 3mfd h LEU 226 N 0.68 0.30 0.00 7.07 3.38 -2.02 -3.36 115.31 121.37 3mfd h LEU 226 Ca 0.45 -0.50 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 3mfd h LEU 226 Cb 0.75 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3mfd h LEU 226 CO -0.21 1.43 -0.67 0.00 0.09 0.00 0.00 178.44 179.08 3mfd h ALA 227 N 0.52 0.61 -0.91 1.53 0.00 -1.84 -3.48 119.26 115.70 3mfd h ALA 227 Ca -0.28 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.05 3mfd h ALA 227 Cb 2.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.74 3mfd h ALA 227 CO 0.13 0.77 0.00 1.63 0.00 0.00 0.00 179.25 181.78 3mfd n LYS 228 N -3.22 0.00 -2.89 0.00 4.76 0.50 -4.12 118.16 113.18 3mfd n LYS 228 Ca 0.01 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.04 3mfd n LYS 228 Cb 0.78 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.93 3mfd n LYS 228 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3mfd s ARG 229 N 0.00 4.50 0.16 1.97 0.52 -1.26 -3.31 118.95 121.52 3mfd s ARG 229 Ca 0.00 1.13 0.09 0.00 -0.52 0.00 0.00 55.73 56.43 3mfd s ARG 229 Cb 0.00 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.99 3mfd s ARG 229 CO 0.00 0.04 -0.20 0.95 0.02 0.00 0.00 175.30 176.11 3mfd s THR 230 N 0.78 1.91 -0.28 0.02 -4.23 0.01 -0.31 115.64 113.55 3mfd s THR 230 Ca 0.44 -1.85 -0.15 0.00 -1.18 0.00 0.00 61.69 58.94 3mfd s THR 230 Cb -0.19 -1.84 0.08 0.00 1.34 0.00 0.00 72.50 71.89 3mfd s THR 230 CO 0.23 -0.21 0.68 -0.22 -0.54 0.00 0.00 174.62 174.56 3mfd s LEU 231 N -2.48 -0.94 -0.10 4.79 2.96 -0.38 -0.91 118.68 121.62 3mfd s LEU 231 Ca 0.15 1.50 -0.01 0.00 -0.22 0.00 0.00 54.13 55.55 3mfd s LEU 231 Cb -0.07 2.35 -0.03 0.00 0.50 0.00 0.00 46.19 48.94 3mfd s LEU 231 CO 0.07 -0.24 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.11 3mfd s VAL 232 N 1.75 3.74 0.14 1.68 1.01 -0.54 -0.91 120.40 127.28 3mfd s VAL 232 Ca -0.10 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 3mfd s VAL 232 Cb -0.06 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 3mfd s VAL 232 CO -0.20 0.56 0.26 -0.94 0.00 0.00 0.00 175.10 174.79 3mfd s SER 233 N -0.33 0.05 0.12 3.32 1.04 -0.19 -0.68 113.70 117.02 3mfd s SER 233 Ca 0.05 -0.80 0.06 0.00 0.48 0.00 0.00 55.95 55.74 3mfd s SER 233 Cb -0.12 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.37 3mfd s SER 233 CO 0.02 -0.85 -0.14 0.42 0.98 0.00 0.00 173.24 173.68 3mfd s THR 234 N -3.94 1.28 0.03 2.02 -4.23 -0.71 -0.90 115.64 109.19 3mfd s THR 234 Ca 0.14 -1.68 -0.18 0.00 -1.18 0.00 0.00 61.69 58.79 3mfd s THR 234 Cb 0.04 -1.48 0.04 0.00 1.34 0.00 0.00 72.50 72.43 3mfd s THR 234 CO -0.03 -0.41 0.41 0.00 -0.54 0.00 0.00 174.62 174.05 3mfd s ALA 235 N -2.09 -1.01 -0.02 3.99 0.00 -0.73 -0.97 121.76 120.92 3mfd s ALA 235 Ca 0.08 0.35 -0.02 0.00 0.00 0.00 0.00 51.96 52.37 3mfd s ALA 235 Cb -0.05 0.30 0.01 0.00 0.00 0.00 0.00 23.12 23.38 3mfd s ALA 235 CO 0.03 -0.43 0.06 -1.12 0.00 0.00 0.00 175.76 174.29 3mfd s SER 236 N -1.90 -0.05 -0.26 0.00 0.01 -0.42 -0.61 113.70 110.47 3mfd s SER 236 Ca -0.06 0.12 -0.22 0.00 1.31 0.00 0.00 55.95 57.09 3mfd s SER 236 Cb -0.01 0.10 0.07 0.00 0.21 0.00 0.00 66.02 66.38 3mfd s SER 236 CO -0.01 -0.04 0.68 -0.75 0.41 0.00 0.00 173.24 173.52 3mfd s LYS 237 N 0.22 0.77 -1.40 12.44 2.20 -0.45 -4.73 119.74 128.79 3mfd s LYS 237 Ca -0.02 0.97 -0.09 0.00 -0.36 0.00 0.00 55.97 56.48 3mfd s LYS 237 Cb -0.03 0.35 0.06 0.00 -1.51 0.00 0.00 37.83 36.70 3mfd s LYS 237 CO -0.01 -0.10 0.61 -0.25 -0.36 0.00 0.00 175.35 175.24 3mfd n ASP 238 N 2.93 -4.60 -0.14 1.43 8.00 -1.26 -0.66 116.55 122.24 3mfd n ASP 238 Ca -0.15 -0.43 -0.02 0.00 0.71 0.00 0.00 54.79 54.91 3mfd n ASP 238 Cb 0.56 -3.75 -0.01 0.00 -0.02 0.00 0.00 41.12 37.90 3mfd n ASP 238 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mfd n GLY 239 N -1.36 0.53 3.47 0.44 0.00 -1.26 -4.75 105.19 102.26 3mfd n GLY 239 Ca -0.03 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 3mfd n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mfd s ILE 240 N -1.94 3.83 -0.14 -0.61 1.01 0.16 -4.83 121.20 118.69 3mfd s ILE 240 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.28 3mfd s ILE 240 Cb 0.00 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 3mfd s ILE 240 CO 0.00 0.48 -0.15 -1.81 0.00 0.00 0.00 174.94 173.45 3mfd s ASP 241 N 0.56 3.74 0.10 3.58 1.01 -1.26 -1.35 116.67 123.06 3mfd s ASP 241 Ca -0.03 -0.42 0.05 0.00 0.71 0.00 0.00 52.55 52.86 3mfd s ASP 241 Cb -0.14 -1.57 -0.03 0.00 1.01 0.00 0.00 42.92 42.19 3mfd s ASP 241 CO 0.03 0.13 -0.13 -0.76 0.21 0.00 0.00 175.17 174.64 3mfd s LEU 242 N 0.57 2.37 -0.06 1.23 1.43 0.22 -0.11 118.68 124.32 3mfd s LEU 242 Ca -0.09 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.27 3mfd s LEU 242 Cb -0.16 -0.49 0.02 0.00 0.03 0.00 0.00 46.19 45.59 3mfd s LEU 242 CO 0.04 -0.15 -0.09 -0.63 0.23 0.00 0.00 176.35 175.75 3mfd s ILE 243 N -1.94 0.87 0.05 -0.59 1.01 -0.58 -1.78 121.20 118.23 3mfd s ILE 243 Ca 0.05 -0.31 0.06 0.00 0.00 0.00 0.00 60.65 60.45 3mfd s ILE 243 Cb -0.06 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.55 3mfd s ILE 243 CO 0.02 0.30 -0.18 0.00 0.00 0.00 0.00 174.94 175.09 3mfd s ALA 244 N 0.86 1.48 -0.02 9.38 0.00 -0.08 -0.86 121.76 132.52 3mfd s ALA 244 Ca -0.12 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.89 3mfd s ALA 244 Cb -0.15 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.73 3mfd s ALA 244 CO 0.01 0.31 -0.03 0.08 0.00 0.00 0.00 175.76 176.13 3mfd s VAL 245 N -0.87 0.34 -0.01 0.00 1.01 -0.26 -1.02 120.40 119.59 3mfd s VAL 245 Ca 0.04 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 61.97 3mfd s VAL 245 Cb -0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.94 3mfd s VAL 245 CO 0.02 0.14 -0.14 0.42 0.00 0.00 0.00 175.10 175.54 3mfd s THR 246 N 0.44 1.09 -0.14 3.92 -4.23 -0.09 -1.38 115.64 115.25 3mfd s THR 246 Ca -0.05 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.88 3mfd s THR 246 Cb -0.08 -0.91 0.02 0.00 1.34 0.00 0.00 72.50 72.87 3mfd s THR 246 CO -0.01 0.31 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.63 3mfd s ILE 247 N -0.30 1.43 -0.29 2.99 1.01 -0.08 -1.25 121.20 124.71 3mfd s ILE 247 Ca 0.05 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 3mfd s ILE 247 Cb -0.06 -1.37 0.01 0.00 0.01 0.00 0.00 42.46 41.05 3mfd s ILE 247 CO -0.00 0.42 0.22 -3.20 0.00 0.00 0.00 174.94 172.37 3mfd n ASN 248 N 4.81 -6.80 -3.36 3.58 2.85 0.58 -2.57 115.26 114.36 3mfd n ASN 248 Ca -0.16 0.82 -0.09 0.00 -0.11 0.00 0.00 54.58 55.05 3mfd n ASN 248 Cb 0.50 -4.49 -0.08 0.00 1.24 0.00 0.00 39.78 36.95 3mfd n ASN 248 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 3mfd s ASP 249 N -1.75 0.21 0.00 1.20 -1.08 -0.92 -1.73 116.67 112.60 3mfd s ASP 249 Ca 0.09 0.26 0.29 0.00 -0.52 0.00 0.00 52.55 52.67 3mfd s ASP 249 Cb -0.03 1.13 1.73 0.00 -1.46 0.00 0.00 42.92 44.30 3mfd s ASP 249 CO 0.62 -0.30 2.07 -0.81 0.52 0.00 0.00 175.17 177.27 3mfd n PRO 250 N 5.37 0.91 -2.25 4.34 -0.04 -1.26 -3.12 135.00 138.95 3mfd n PRO 250 Ca -0.04 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.29 3mfd n PRO 250 Cb 0.50 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 3mfd n PRO 250 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3mfd n ASN 251 N -1.00 3.42 -0.12 3.54 5.15 -1.26 -4.95 115.26 120.04 3mfd n ASN 251 Ca 0.22 -3.06 -0.09 0.00 -0.60 0.00 0.00 54.58 51.04 3mfd n ASN 251 Cb 0.10 -0.40 -0.01 0.00 -0.53 0.00 0.00 39.78 38.94 3mfd n ASN 251 CO 0.00 0.00 0.00 -2.24 1.40 0.00 0.00 177.26 176.42 3mfd h ASP 252 N 2.25 0.48 -0.19 1.20 3.04 -1.96 -0.19 116.42 121.06 3mfd h ASP 252 Ca 0.15 -0.15 0.01 0.00 -3.24 0.00 0.00 57.03 53.79 3mfd h ASP 252 Cb 1.43 -0.13 -0.01 0.00 -1.04 0.00 0.00 39.33 39.58 3mfd h ASP 252 CO 0.49 0.50 0.11 -0.50 -2.04 0.00 0.00 179.24 177.80 3mfd h TRP 253 N 0.44 0.21 -0.64 4.15 -0.00 -1.92 -0.31 115.95 117.88 3mfd h TRP 253 Ca 0.12 0.01 -0.09 0.00 -0.00 0.00 0.00 58.89 58.93 3mfd h TRP 253 Cb 0.16 -0.07 -0.02 0.00 -0.00 0.00 0.00 29.16 29.22 3mfd h TRP 253 CO -0.01 0.13 0.06 0.22 -0.00 0.00 0.00 178.44 178.84 3mfd h ASP 254 N 0.24 1.05 -0.71 -3.49 3.58 -1.95 -2.93 116.42 112.20 3mfd h ASP 254 Ca 0.07 -0.28 -0.03 0.00 0.42 0.00 0.00 57.03 57.21 3mfd h ASP 254 Cb -0.01 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.73 3mfd h ASP 254 CO -0.03 1.07 0.33 0.44 -2.88 0.00 0.00 179.24 178.16 3mfd h ASP 255 N 1.00 0.97 0.00 2.28 3.32 -0.56 0.69 116.42 124.11 3mfd h ASP 255 Ca 0.19 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3mfd h ASP 255 Cb 0.50 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3mfd h ASP 255 CO 0.02 0.84 0.00 1.41 -1.72 0.00 0.00 179.24 179.79 3mfd n HIS 256 N -4.31 0.00 -0.30 4.55 8.25 -0.17 -4.63 115.22 118.62 3mfd n HIS 256 Ca 0.07 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 3mfd n HIS 256 Cb 0.15 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.20 3mfd n HIS 256 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3mfd n LYS 258 N 0.61 -0.31 0.00 -0.41 4.81 0.23 -4.53 118.16 118.55 3mfd n LYS 258 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3mfd n LYS 258 Cb 0.07 -1.21 0.00 0.00 0.02 0.00 0.00 35.03 33.92 3mfd n LYS 258 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 3mfd n PHE 260 N -0.30 0.00 -0.36 5.64 3.72 -1.26 -1.44 117.46 123.45 3mfd n PHE 260 Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3mfd n PHE 260 Cb 0.00 0.00 0.15 0.00 -0.94 0.00 0.00 39.48 38.69 3mfd n PHE 260 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 3mfd h ASN 261 N 0.00 1.03 -0.25 4.37 2.35 -1.96 0.32 115.58 121.44 3mfd h ASN 261 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 3mfd h ASN 261 Cb 0.00 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 3mfd h ASN 261 CO 0.00 0.68 0.07 0.22 -1.65 0.00 0.00 177.43 176.74 3mfd h TYR 262 N 1.18 0.11 -0.38 1.19 5.03 -1.64 -0.67 116.97 121.80 3mfd h TYR 262 Ca 0.41 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.66 3mfd h TYR 262 Cb 0.09 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.35 3mfd h TYR 262 CO -0.01 0.04 -0.05 0.28 -1.32 0.00 0.00 178.16 177.11 3mfd h VAL 263 N 0.17 1.27 -0.40 1.81 2.07 -1.62 -1.21 116.25 118.33 3mfd h VAL 263 Ca 0.11 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 3mfd h VAL 263 Cb 0.10 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 3mfd h VAL 263 CO -0.14 0.36 0.18 -0.26 0.02 0.00 0.00 177.57 177.74 3mfd h PHE 264 N 0.52 0.55 0.01 1.57 0.04 -0.80 0.48 116.94 119.30 3mfd h PHE 264 Ca 0.10 -0.01 -0.19 0.00 2.80 0.00 0.00 57.97 60.67 3mfd h PHE 264 Cb 0.54 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.49 3mfd h PHE 264 CO 0.04 0.42 -0.88 1.49 -0.60 0.00 0.00 178.31 178.78 3mfd h GLU 265 N 0.56 0.04 0.00 1.51 4.57 -0.80 -3.37 114.58 117.09 3mfd h GLU 265 Ca 0.14 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3mfd h GLU 265 Cb 0.08 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3mfd h GLU 265 CO -0.02 0.89 -1.09 0.72 -1.18 0.00 0.00 179.01 178.34 3mfd n HIS 266 N -3.53 0.00 -4.42 0.92 8.25 -0.48 -5.00 115.22 110.95 3mfd n HIS 266 Ca -0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.20 3mfd n HIS 266 Cb 0.83 -0.13 -0.11 0.00 1.12 0.00 0.00 29.99 31.71 3mfd n HIS 266 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3mfd s TYR 267 N -2.71 2.19 0.04 4.41 1.51 0.12 -4.25 117.35 118.66 3mfd s TYR 267 Ca 0.02 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 3mfd s TYR 267 Cb 0.11 -1.02 -0.03 0.00 -0.11 0.00 0.00 41.96 40.91 3mfd s TYR 267 CO 0.66 0.56 -0.05 -0.65 -1.11 0.00 0.00 175.55 174.95 3mfd s GLN 268 N -3.09 0.50 -0.16 -0.62 -0.21 -0.50 -4.73 119.66 110.85 3mfd s GLN 268 Ca 0.24 -0.82 -0.24 0.00 0.02 0.00 0.00 55.36 54.56 3mfd s GLN 268 Cb -0.06 -0.09 -0.02 0.00 1.00 0.00 0.00 33.01 33.84 3mfd s GLN 268 CO 0.11 -0.01 0.76 0.99 -2.12 0.00 0.00 175.29 175.02 3mfd s THR 269 N -1.94 4.94 -0.09 -0.19 2.01 -1.26 -1.18 115.64 117.93 3mfd s THR 269 Ca -0.08 1.49 -0.00 0.00 0.31 0.00 0.00 61.69 63.41 3mfd s THR 269 Cb -0.06 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 3mfd s THR 269 CO -0.02 0.08 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.61 3mfd s TYR 270 N 1.87 2.91 -0.68 4.92 2.02 0.61 -4.91 117.35 124.08 3mfd s TYR 270 Ca 0.36 -0.17 -0.27 0.00 -0.37 0.00 0.00 57.07 56.62 3mfd s TYR 270 Cb -0.17 -1.78 0.02 0.00 -0.40 0.00 0.00 41.96 39.64 3mfd s TYR 270 CO 0.13 0.15 1.39 -1.17 -1.57 0.00 0.00 175.55 174.48 3mfd s LEU 271 N -0.37 3.24 -0.10 -1.29 2.96 -1.26 -0.74 118.68 121.12 3mfd s LEU 271 Ca 0.05 -0.16 -0.23 0.00 -0.22 0.00 0.00 54.13 53.56 3mfd s LEU 271 Cb -0.12 -2.68 -0.28 0.00 0.50 0.00 0.00 46.19 43.61 3mfd s LEU 271 CO 0.02 -1.88 0.75 0.40 -1.32 0.00 0.00 176.35 174.32 3mfd h ILE 272 N 6.23 1.50 -3.07 6.68 2.04 -1.41 -3.46 117.51 126.02 3mfd h ILE 272 Ca -0.27 -2.43 -0.27 0.00 1.00 0.00 0.00 64.86 62.89 3mfd h ILE 272 Cb 1.08 3.13 -0.35 0.00 -0.74 0.00 0.00 36.82 39.94 3mfd h ILE 272 CO 1.25 0.65 -0.61 0.00 0.00 0.00 0.00 178.15 179.43 3mfd s ALA 273 N -2.36 -0.24 0.00 1.87 0.00 -1.00 -5.01 121.76 115.02 3mfd s ALA 273 Ca -0.17 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.42 3mfd s ALA 273 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 23.12 22.33 3mfd s ALA 273 CO 0.76 -0.51 0.00 1.63 0.00 0.00 0.00 175.76 177.63 3mfd n LYS 274 N 5.16 0.00 -1.43 0.00 5.02 -1.26 -0.06 118.16 125.59 3mfd n LYS 274 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 3mfd n LYS 274 Cb 0.50 -0.31 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 3mfd n LYS 274 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3mfd n ASP 277 N 0.00 0.00 -4.13 4.39 2.03 -1.26 -4.75 116.55 112.82 3mfd n ASP 277 Ca 0.00 0.95 -0.35 0.00 0.52 0.00 0.00 54.79 55.91 3mfd n ASP 277 Cb 0.00 -1.43 -0.13 0.00 -0.72 0.00 0.00 41.12 38.85 3mfd n ASP 277 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3mfd s ILE 278 N -0.69 3.12 0.45 5.18 1.01 -1.26 -4.86 121.20 124.14 3mfd s ILE 278 Ca 0.00 -1.83 0.16 0.00 0.00 0.00 0.00 60.65 58.99 3mfd s ILE 278 Cb 0.00 -3.02 0.34 0.00 0.01 0.00 0.00 42.46 39.79 3mfd s ILE 278 CO 0.00 -0.47 1.97 -0.65 0.00 0.00 0.00 174.94 175.79 3mfd h PRO 279 N 8.00 0.32 0.00 2.79 0.11 -1.98 -2.18 132.00 139.06 3mfd h PRO 279 Ca -0.15 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3mfd h PRO 279 Cb 1.05 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3mfd h PRO 279 CO 0.62 0.21 0.00 0.36 -0.21 0.00 0.00 178.00 178.99 3mfd n LYS 280 N -4.46 0.11 -0.15 1.05 2.85 -1.26 -2.43 118.16 113.87 3mfd n LYS 280 Ca 0.11 0.10 0.11 0.00 -1.05 0.00 0.00 58.31 57.57 3mfd n LYS 280 Cb 0.44 -1.50 0.27 0.00 -0.65 0.00 0.00 35.03 33.59 3mfd n LYS 280 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3mfd n LEU 281 N -1.43 2.76 -4.66 -5.58 4.77 -0.82 -4.99 117.00 107.04 3mfd n LEU 281 Ca 0.07 -1.18 -0.44 0.00 -0.03 0.00 0.00 56.01 54.43 3mfd n LEU 281 Cb 0.24 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 3mfd n LEU 281 CO 0.20 0.59 0.88 1.17 -1.33 0.00 0.00 177.39 178.90 3mfd n LYS 282 N 1.04 1.92 -0.08 3.23 4.81 -1.02 -1.98 118.16 126.08 3mfd n LYS 282 Ca 0.18 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.30 3mfd n LYS 282 Cb 0.50 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.30 3mfd n LYS 282 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3mfd n GLY 283 N 1.42 2.25 4.03 3.14 0.00 -1.26 -5.03 105.19 109.74 3mfd n GLY 283 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 3mfd n GLY 283 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mfd s THR 284 N -2.88 2.22 0.28 2.61 -4.23 -0.84 -5.01 115.64 107.79 3mfd s THR 284 Ca 0.00 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.57 3mfd s THR 284 Cb 0.00 -2.27 0.27 0.00 1.34 0.00 0.00 72.50 71.85 3mfd s THR 284 CO 0.00 0.00 1.81 0.15 -0.54 0.00 0.00 174.62 176.04 3mfd h PHE 285 N 0.13 1.05 -0.75 3.99 3.04 -1.96 -2.94 116.94 119.52 3mfd h PHE 285 Ca -0.31 0.03 -0.45 0.00 3.98 0.00 0.00 57.97 61.22 3mfd h PHE 285 Cb 1.29 -0.33 -0.22 0.00 2.56 0.00 0.00 35.95 39.25 3mfd h PHE 285 CO 0.35 0.36 0.58 0.66 -2.02 0.00 0.00 178.31 178.24 3mfd n TYR 286 N -4.70 2.36 0.10 0.41 4.01 -1.26 -4.75 117.16 113.34 3mfd n TYR 286 Ca 0.19 -2.03 -0.04 0.00 -0.16 0.00 0.00 57.90 55.86 3mfd n TYR 286 Cb 0.40 -1.00 -0.02 0.00 -0.31 0.00 0.00 39.34 38.41 3mfd n TYR 286 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3mfd h GLU 287 N 1.26 -0.25 0.00 -0.72 4.81 -1.66 -3.21 114.58 114.81 3mfd h GLU 287 Ca 0.47 0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.48 3mfd h GLU 287 Cb 1.60 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 31.00 3mfd h GLU 287 CO 1.02 -0.17 -1.62 0.43 -0.73 0.00 0.00 179.01 177.94 3mfd n SER 288 N -2.92 0.80 0.11 1.04 7.64 -1.26 -4.43 113.62 114.60 3mfd n SER 288 Ca -0.03 0.37 -0.02 0.00 1.01 0.00 0.00 58.87 60.19 3mfd n SER 288 Cb 0.10 0.14 0.07 0.00 -1.01 0.00 0.00 64.21 63.51 3mfd n SER 288 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 3mfd h LYS 289 N 0.00 0.00 -6.57 1.43 6.56 -1.86 -3.46 116.57 112.67 3mfd h LYS 289 Ca -0.24 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 58.83 3mfd h LYS 289 Cb 1.81 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 33.44 3mfd h LYS 289 CO 0.06 0.73 -0.02 0.00 -2.06 0.00 0.00 179.45 178.16 3mfd s ALA 290 N -3.22 3.45 -0.06 3.86 0.00 -1.21 -1.93 121.76 122.65 3mfd s ALA 290 Ca 0.00 -0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.54 3mfd s ALA 290 Cb 0.11 -2.59 0.09 0.00 0.00 0.00 0.00 23.12 20.73 3mfd s ALA 290 CO 0.78 0.43 0.79 -0.59 0.00 0.00 0.00 175.76 177.16 3mfd s PHE 291 N -1.89 -0.53 0.23 0.00 -0.71 -0.12 -4.19 117.98 110.77 3mfd s PHE 291 Ca 0.50 0.82 -0.02 0.00 -1.04 0.00 0.00 56.93 57.19 3mfd s PHE 291 Cb -0.11 0.45 -0.05 0.00 -1.21 0.00 0.00 43.02 42.10 3mfd s PHE 291 CO 0.19 -0.54 0.45 0.96 -1.34 0.00 0.00 175.22 174.94 3mfd s ILE 292 N -1.57 5.14 -0.27 -4.49 -4.36 -1.26 -0.18 121.20 114.21 3mfd s ILE 292 Ca -0.06 -0.21 0.19 0.00 -0.26 0.00 0.00 60.65 60.31 3mfd s ILE 292 Cb -0.00 -3.73 0.14 0.00 1.25 0.00 0.00 42.46 40.11 3mfd s ILE 292 CO 0.04 -0.23 1.41 0.07 0.24 0.00 0.00 174.94 176.46 3mfd h LYS 293 N 1.87 0.00 -4.23 0.37 5.09 -1.95 -3.44 116.57 114.28 3mfd h LYS 293 Ca -0.48 0.00 -0.17 0.00 0.09 0.00 0.00 60.65 60.09 3mfd h LYS 293 Cb 1.19 0.00 -0.13 0.00 0.10 0.00 0.00 32.23 33.39 3mfd h LYS 293 CO 0.67 0.25 -0.46 0.50 -2.09 0.00 0.00 179.45 178.32 3mfd s ARG 294 N -3.09 1.23 0.40 0.07 6.06 -1.26 -5.15 118.95 117.22 3mfd s ARG 294 Ca 0.04 -1.44 -0.26 0.00 -2.50 0.00 0.00 55.73 51.57 3mfd s ARG 294 Cb 0.07 0.33 -0.09 0.00 0.06 0.00 0.00 34.95 35.32 3mfd s ARG 294 CO 0.73 -0.43 1.28 -0.51 -2.50 0.00 0.00 175.30 173.87 3mfd s ASP 295 N -3.08 6.37 -0.34 -2.12 1.11 -1.26 -4.80 116.67 112.54 3mfd s ASP 295 Ca 0.29 2.61 -0.05 0.00 0.18 0.00 0.00 52.55 55.59 3mfd s ASP 295 Cb 0.05 -2.64 0.05 0.00 1.07 0.00 0.00 42.92 41.45 3mfd s ASP 295 CO 0.08 -0.80 0.10 -0.63 1.18 0.00 0.00 175.17 175.10 3mfd s ILE 296 N -1.27 3.60 0.22 0.77 -1.09 0.91 -5.01 121.20 119.34 3mfd s ILE 296 Ca 0.56 -1.29 0.09 0.00 -2.23 0.00 0.00 60.65 57.78 3mfd s ILE 296 Cb -0.37 -3.10 -0.04 0.00 -1.58 0.00 0.00 42.46 37.37 3mfd s ILE 296 CO 0.48 -0.23 -0.04 0.42 -1.23 0.00 0.00 174.94 174.33 3mfd s THR 297 N 1.35 3.38 -0.08 2.92 -4.23 -1.26 -0.96 115.64 116.76 3mfd s THR 297 Ca -0.01 -1.77 -0.29 0.00 -1.18 0.00 0.00 61.69 58.43 3mfd s THR 297 Cb -0.20 -2.75 0.07 0.00 1.34 0.00 0.00 72.50 70.96 3mfd s THR 297 CO 0.01 -0.25 0.67 -0.47 -0.54 0.00 0.00 174.62 174.04 3mfd s TYR 298 N -2.04 -0.65 -0.25 3.99 5.04 0.08 -4.93 117.35 118.59 3mfd s TYR 298 Ca 0.29 1.20 -0.17 0.00 -2.44 0.00 0.00 57.07 55.94 3mfd s TYR 298 Cb -0.08 0.37 -0.03 0.00 0.35 0.00 0.00 41.96 42.58 3mfd s TYR 298 CO 0.18 -0.56 0.48 -1.17 -1.34 0.00 0.00 175.55 173.14 3mfd s LEU 299 N -0.97 4.07 0.03 6.97 2.96 -1.26 -0.28 118.68 130.20 3mfd s LEU 299 Ca -0.09 0.50 -0.12 0.00 -0.22 0.00 0.00 54.13 54.19 3mfd s LEU 299 Cb -0.01 -2.62 0.01 0.00 0.50 0.00 0.00 46.19 44.08 3mfd s LEU 299 CO 0.08 -0.24 0.26 -0.76 -1.32 0.00 0.00 176.35 174.38 3mfd s LEU 300 N 2.10 1.07 0.81 -0.68 1.43 -0.32 -4.94 118.68 118.15 3mfd s LEU 300 Ca 0.20 -0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 3mfd s LEU 300 Cb -0.16 1.17 0.08 0.00 0.03 0.00 0.00 46.19 47.31 3mfd s LEU 300 CO 0.09 -0.55 1.15 0.42 0.23 0.00 0.00 176.35 177.69 3mfd s THR 301 N -2.22 2.37 0.16 5.49 -4.23 -1.26 -1.42 115.64 114.54 3mfd s THR 301 Ca -0.07 0.12 -0.15 0.00 -1.18 0.00 0.00 61.69 60.40 3mfd s THR 301 Cb -0.02 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.81 3mfd s THR 301 CO -0.02 -0.16 1.81 -0.33 -0.54 0.00 0.00 174.62 175.39 3mfd h GLU 302 N -1.08 0.53 -0.82 3.99 5.08 -1.98 0.36 114.58 120.65 3mfd h GLU 302 Ca -0.47 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 3mfd h GLU 302 Cb 1.31 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 3mfd h GLU 302 CO 0.64 0.35 0.50 1.49 -1.00 0.00 0.00 179.01 181.00 3mfd h GLU 303 N 0.54 1.11 -0.66 2.33 4.81 -1.94 -1.76 114.58 119.01 3mfd h GLU 303 Ca 0.17 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3mfd h GLU 303 Cb -0.02 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.10 3mfd h GLU 303 CO -0.06 0.77 0.21 0.93 -0.73 0.00 0.00 179.01 180.13 3mfd h GLU 304 N 1.12 1.01 -0.66 1.92 5.08 -1.85 -2.95 114.58 118.25 3mfd h GLU 304 Ca 0.30 -0.21 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 3mfd h GLU 304 Cb -0.06 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 28.99 3mfd h GLU 304 CO -0.06 0.88 0.38 -0.22 -1.00 0.00 0.00 179.01 178.99 3mfd h LYS 305 N 0.95 0.69 0.00 2.33 1.63 -0.44 -1.23 116.57 120.51 3mfd h LYS 305 Ca 0.21 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.97 3mfd h LYS 305 Cb 0.28 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.76 3mfd h LYS 305 CO -0.01 0.46 -0.00 0.93 -3.45 0.00 0.00 179.45 177.38 3mfd h GLU 306 N 0.71 0.00 -0.31 1.90 5.08 -1.17 -2.33 114.58 118.46 3mfd h GLU 306 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 3mfd h GLU 306 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3mfd h GLU 306 CO -0.16 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 177.94 3mfd n ASN 307 N -4.07 3.11 -4.72 1.42 3.02 -0.50 -4.93 115.26 108.59 3mfd n ASN 307 Ca -0.03 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 3mfd n ASN 307 Cb 0.09 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 3mfd n ASN 307 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3mfd s VAL 308 N -1.61 2.91 -0.09 2.41 1.01 -0.88 -3.86 120.40 120.29 3mfd s VAL 308 Ca 0.37 0.66 0.03 0.00 0.00 0.00 0.00 61.98 63.03 3mfd s VAL 308 Cb 0.22 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 33.18 3mfd s VAL 308 CO 0.31 0.05 -0.19 -0.54 0.00 0.00 0.00 175.10 174.73 3mfd s LYS 309 N 1.12 2.52 -0.47 2.72 3.01 -1.26 -5.00 119.74 122.37 3mfd s LYS 309 Ca 0.68 -0.69 -0.13 0.00 -1.01 0.00 0.00 55.97 54.81 3mfd s LYS 309 Cb -0.41 -1.95 0.09 0.00 -1.01 0.00 0.00 37.83 34.55 3mfd s LYS 309 CO 0.31 0.11 0.37 0.42 0.51 0.00 0.00 175.35 177.07 3mfd s ILE 310 N 0.49 4.80 -0.14 2.17 1.01 -1.26 -4.35 121.20 123.91 3mfd s ILE 310 Ca -0.17 -1.34 -0.07 0.00 0.00 0.00 0.00 60.65 59.07 3mfd s ILE 310 Cb -0.17 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 3mfd s ILE 310 CO 0.07 -0.64 0.11 0.20 0.00 0.00 0.00 174.94 174.68 3mfd s ASN 311 N 2.65 6.10 0.01 3.58 0.01 -0.73 -4.99 114.94 121.57 3mfd s ASN 311 Ca 0.04 0.33 0.03 0.00 -0.71 0.00 0.00 52.86 52.55 3mfd s ASN 311 Cb -0.25 -1.97 -0.01 0.00 0.41 0.00 0.00 41.25 39.42 3mfd s ASN 311 CO 0.04 0.34 -0.10 0.42 -1.51 0.00 0.00 177.10 176.28 3mfd s THR 312 N -0.60 0.79 -0.06 1.60 -4.23 -1.26 -0.38 115.64 111.50 3mfd s THR 312 Ca 0.12 -0.62 0.03 0.00 -1.18 0.00 0.00 61.69 60.04 3mfd s THR 312 Cb -0.12 -0.70 0.01 0.00 1.34 0.00 0.00 72.50 73.03 3mfd s THR 312 CO 0.02 0.09 -0.14 -0.89 -0.54 0.00 0.00 174.62 173.15 3mfd s THR 313 N -0.50 1.28 0.01 3.99 2.01 -0.42 -5.02 115.64 116.99 3mfd s THR 313 Ca 0.01 -0.59 0.02 0.00 0.31 0.00 0.00 61.69 61.45 3mfd s THR 313 Cb -0.05 -1.14 -0.01 0.00 0.01 0.00 0.00 72.50 71.30 3mfd s THR 313 CO 0.00 0.38 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.50 3mfd s LEU 314 N 0.45 2.08 0.05 4.42 1.02 -1.26 -1.48 118.68 123.96 3mfd s LEU 314 Ca -0.12 -0.23 0.04 0.00 0.02 0.00 0.00 54.13 53.84 3mfd s LEU 314 Cb -0.15 -0.23 0.17 0.00 0.02 0.00 0.00 46.19 46.01 3mfd s LEU 314 CO 0.04 -0.02 0.17 0.52 0.02 0.00 0.00 176.35 177.08 3mfd n VAL 332 N 2.51 -0.03 0.00 -1.59 0.31 -1.15 -5.05 118.33 113.34 3mfd n VAL 332 Ca -0.16 0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3mfd n VAL 332 Cb 0.57 -0.32 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 3mfd n VAL 332 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mfd n GLY 333 N -1.06 -0.81 0.00 2.92 0.00 -1.20 -5.00 105.19 100.04 3mfd n GLY 333 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3mfd n GLY 333 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3mfd n HIS 334 N 0.75 -0.07 0.00 1.61 8.25 -0.55 -2.26 115.22 122.96 3mfd n HIS 334 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3mfd n HIS 334 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3mfd n HIS 334 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3mfd n GLU 336 N 0.00 0.00 -3.58 -0.41 1.02 0.49 -1.30 120.64 116.86 3mfd n GLU 336 Ca 0.00 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.87 3mfd n GLU 336 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 3mfd n GLU 336 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3mfd s ILE 337 N 0.00 5.15 -0.28 -3.67 1.01 -1.00 -1.77 121.20 120.64 3mfd s ILE 337 Ca 0.00 -0.28 -0.16 0.00 0.00 0.00 0.00 60.65 60.20 3mfd s ILE 337 Cb 0.00 -3.75 0.08 0.00 0.01 0.00 0.00 42.46 38.80 3mfd s ILE 337 CO 0.00 -0.25 0.69 0.72 0.00 0.00 0.00 174.94 176.10 3mfd s PHE 339 N -1.97 -1.06 0.00 3.97 -0.71 0.45 -0.07 117.98 118.60 3mfd s PHE 339 Ca 0.40 2.13 0.00 0.00 -1.04 0.00 0.00 56.93 58.42 3mfd s PHE 339 Cb -0.11 0.63 0.00 0.00 -1.21 0.00 0.00 43.02 42.33 3mfd s PHE 339 CO 0.30 -0.52 0.00 0.09 -1.34 0.00 0.00 175.22 173.74 3mfd n ASN 340 N 4.26 0.00 0.20 1.98 3.02 -1.25 -0.86 115.26 122.61 3mfd n ASN 340 Ca -0.20 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.40 3mfd n ASN 340 Cb 0.59 0.00 0.41 0.00 -0.61 0.00 0.00 39.78 40.17 3mfd n ASN 340 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 3mfd h ASP 341 N 1.25 0.00 -3.92 6.41 2.03 -2.05 -3.47 116.42 116.68 3mfd h ASP 341 Ca 0.00 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.84 3mfd h ASP 341 Cb 0.00 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.48 3mfd h ASP 341 CO 0.00 0.34 0.28 0.00 -1.03 0.00 0.00 179.24 178.83 3mfd s ALA 342 N -3.98 3.16 -0.19 4.15 0.00 -0.04 -5.06 121.76 119.81 3mfd s ALA 342 Ca -0.02 0.34 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 3mfd s ALA 342 Cb 0.13 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 3mfd s ALA 342 CO 0.69 0.19 0.07 0.99 0.00 0.00 0.00 175.76 177.70 3mfd s THR 343 N -1.96 4.79 -0.18 0.00 2.01 -1.26 -0.41 115.64 118.63 3mfd s THR 343 Ca 0.56 -0.03 -0.20 0.00 0.31 0.00 0.00 61.69 62.33 3mfd s THR 343 Cb -0.12 -3.16 -0.17 0.00 0.01 0.00 0.00 72.50 69.06 3mfd s THR 343 CO 0.17 0.45 0.24 0.40 -0.69 0.00 0.00 174.62 175.19 3mfd h ILE 344 N 4.90 0.88 -4.19 1.82 2.04 -0.88 -3.48 117.51 118.61 3mfd h ILE 344 Ca -0.37 -1.97 -0.16 0.00 1.00 0.00 0.00 64.86 63.36 3mfd h ILE 344 Cb 1.17 1.98 -0.13 0.00 -0.74 0.00 0.00 36.82 39.09 3mfd h ILE 344 CO 0.70 0.30 -0.44 0.00 0.00 0.00 0.00 178.15 178.71 3mfd s ALA 345 N -2.40 0.53 -0.45 1.87 0.00 -1.08 -4.99 121.76 115.22 3mfd s ALA 345 Ca -0.24 -1.28 0.06 0.00 0.00 0.00 0.00 51.96 50.50 3mfd s ALA 345 Cb 0.03 1.10 0.18 0.00 0.00 0.00 0.00 23.12 24.44 3mfd s ALA 345 CO 0.52 -0.64 0.61 0.15 0.00 0.00 0.00 175.76 176.40 3mfd s LYS 346 N -4.06 0.92 0.16 0.00 -0.14 -1.26 -2.38 119.74 112.98 3mfd s LYS 346 Ca 0.28 -0.89 0.05 0.00 -1.36 0.00 0.00 55.97 54.04 3mfd s LYS 346 Cb 0.04 -0.23 -0.04 0.00 -1.68 0.00 0.00 37.83 35.92 3mfd s LYS 346 CO 0.07 -1.27 0.14 0.14 -0.76 0.00 0.00 175.35 173.66 3mfd s VAL 347 N 1.17 4.51 0.37 3.17 -7.23 -1.26 -5.01 120.40 116.11 3mfd s VAL 347 Ca 0.24 -1.06 -0.25 0.00 -1.81 0.00 0.00 61.98 59.10 3mfd s VAL 347 Cb -0.03 -3.30 -0.09 0.00 0.56 0.00 0.00 36.38 33.52 3mfd s VAL 347 CO -0.07 -0.10 1.02 -2.16 -0.31 0.00 0.00 175.10 173.48 3mfd s PRO 348 N -3.09 4.34 -0.17 4.82 0.04 -1.26 -4.51 135.00 135.17 3mfd s PRO 348 Ca 0.31 1.46 -0.15 0.00 0.04 0.00 0.00 61.00 62.66 3mfd s PRO 348 Cb -0.10 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 3mfd s PRO 348 CO 0.23 0.02 0.34 0.42 0.04 0.00 0.00 177.00 178.05 3mfd s ILE 349 N -1.63 5.27 0.01 0.56 1.01 -0.96 -4.59 121.20 120.87 3mfd s ILE 349 Ca 0.55 0.62 -0.00 0.00 0.00 0.00 0.00 60.65 61.82 3mfd s ILE 349 Cb -0.21 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 3mfd s ILE 349 CO 0.27 0.34 0.10 -0.31 0.00 0.00 0.00 174.94 175.33 3mfd s TYR 350 N 0.76 3.31 -0.10 3.97 2.02 0.74 -2.92 117.35 125.12 3mfd s TYR 350 Ca 0.18 0.20 -0.04 0.00 -0.37 0.00 0.00 57.07 57.04 3mfd s TYR 350 Cb -0.14 -1.73 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 3mfd s TYR 350 CO 0.06 0.56 0.06 -0.47 -1.57 0.00 0.00 175.55 174.19 3mfd s TYR 351 N -1.25 3.35 -2.00 2.71 5.04 -1.26 -0.95 117.35 122.99 3mfd s TYR 351 Ca 0.25 0.33 0.30 0.00 -2.44 0.00 0.00 57.07 55.51 3mfd s TYR 351 Cb -0.12 -1.86 1.79 0.00 0.35 0.00 0.00 41.96 42.11 3mfd s TYR 351 CO 0.16 0.57 2.12 -1.91 -1.34 0.00 0.00 175.55 175.16