#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urb s PRO 5 N 0.00 4.26 -0.09 0.03 0.04 -1.26 -4.98 135.00 133.00 1urb s PRO 5 Ca 0.00 2.33 -0.02 0.00 0.04 0.00 0.00 61.00 63.35 1urb s PRO 5 Cb 0.00 -3.08 -0.03 0.00 0.04 0.00 0.00 34.50 31.42 1urb s PRO 5 CO 0.00 -0.41 0.02 0.08 0.04 0.00 0.00 177.00 176.73 1urb s VAL 6 N -0.31 4.45 -0.49 -0.36 1.01 -1.26 -4.83 120.40 118.60 1urb s VAL 6 Ca 0.57 -0.20 -0.26 0.00 0.00 0.00 0.00 61.98 62.09 1urb s VAL 6 Cb -0.42 -2.88 -0.07 0.00 0.00 0.00 0.00 36.38 33.01 1urb s VAL 6 CO 0.47 0.61 2.42 0.18 0.00 0.00 0.00 175.10 178.78 1urb n LEU 7 N 2.12 2.32 -0.21 3.92 4.32 -0.76 -4.81 117.00 123.90 1urb n LEU 7 Ca -0.19 -0.47 -0.09 0.00 -0.02 0.00 0.00 56.01 55.24 1urb n LEU 7 Cb 0.54 -1.58 0.03 0.00 -1.62 0.00 0.00 43.42 40.80 1urb n LEU 7 CO 0.29 -1.53 0.83 -0.33 -1.22 0.00 0.00 177.39 175.42 1urb h GLU 8 N 19.34 1.07 -1.77 3.23 4.39 -1.96 -3.43 114.58 135.46 1urb h GLU 8 Ca -0.24 -0.34 0.09 0.00 0.34 0.00 0.00 59.36 59.21 1urb h GLU 8 Cb 1.27 -0.10 -0.20 0.00 -0.10 0.00 0.00 28.75 29.62 1urb h GLU 8 CO 1.15 1.04 -0.12 1.21 -1.16 0.00 0.00 179.01 181.14 1urb s ASN 9 N -6.58 -1.13 -0.19 1.42 3.84 -1.26 -5.01 114.94 106.03 1urb s ASN 9 Ca -0.12 1.41 0.13 0.00 0.21 0.00 0.00 52.86 54.50 1urb s ASN 9 Cb 0.14 2.23 0.43 0.00 -0.55 0.00 0.00 41.25 43.50 1urb s ASN 9 CO 0.86 -0.22 1.20 0.54 -2.79 0.00 0.00 177.10 176.70 1urb n ARG 10 N 5.41 1.57 -1.82 0.43 1.74 -1.26 -4.95 116.66 117.78 1urb n ARG 10 Ca -0.10 -3.20 -0.31 0.00 -0.77 0.00 0.00 57.85 53.47 1urb n ARG 10 Cb 0.50 -1.43 0.02 0.00 -1.02 0.00 0.00 32.46 30.53 1urb n ARG 10 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1urb s ALA 11 N -2.76 3.01 0.21 7.54 0.00 -1.26 -4.73 121.76 123.78 1urb s ALA 11 Ca 0.39 -0.04 -0.32 0.00 0.00 0.00 0.00 51.96 51.98 1urb s ALA 11 Cb 0.38 -3.10 -0.13 0.00 0.00 0.00 0.00 23.12 20.27 1urb s ALA 11 CO -0.07 -0.79 1.61 0.00 0.00 0.00 0.00 175.76 176.52 1urb n ALA 12 N -2.79 2.09 0.29 0.00 0.00 0.64 -4.45 120.51 116.29 1urb n ALA 12 Ca 0.06 0.41 0.16 0.00 0.00 0.00 0.00 53.44 54.08 1urb n ALA 12 Cb 0.54 -2.43 0.62 0.00 0.00 0.00 0.00 19.45 18.18 1urb n ALA 12 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1urb h GLN 13 N 5.83 0.00 0.00 0.00 1.08 -1.02 -3.48 115.11 117.52 1urb h GLN 13 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1urb h GLN 13 Cb 1.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 1urb h GLN 13 CO 0.88 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 179.17 1urb n GLY 14 N 0.14 3.80 3.63 3.46 0.00 -0.01 -5.05 105.19 111.17 1urb n GLY 14 Ca 0.01 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1urb n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1urb s ASP 15 N 1.79 6.80 0.47 1.61 -1.08 -1.24 -4.78 116.67 120.23 1urb s ASP 15 Ca 0.00 1.16 0.26 0.00 -0.52 0.00 0.00 52.55 53.45 1urb s ASP 15 Cb 0.00 -2.54 1.30 0.00 -1.46 0.00 0.00 42.92 40.22 1urb s ASP 15 CO 0.00 -0.98 1.80 0.40 0.52 0.00 0.00 175.17 176.91 1urb h ILE 16 N 5.84 0.50 0.00 4.11 1.08 -1.98 -0.70 117.51 126.35 1urb h ILE 16 Ca -0.24 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 1urb h ILE 16 Cb 1.08 0.27 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 1urb h ILE 16 CO 1.03 0.04 -0.28 0.35 -0.69 0.00 0.00 178.15 178.60 1urb n THR 17 N -4.43 0.36 -3.95 -0.27 -2.24 -1.26 -4.43 114.28 98.07 1urb n THR 17 Ca 0.24 -0.21 -0.23 0.00 -2.27 0.00 0.00 64.05 61.58 1urb n THR 17 Cb 1.00 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.89 1urb n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1urb s ALA 18 N -3.10 3.94 0.15 6.98 0.00 -0.27 -5.01 121.76 124.44 1urb s ALA 18 Ca 0.10 -1.16 -0.34 0.00 0.00 0.00 0.00 51.96 50.55 1urb s ALA 18 Cb 0.14 -1.76 -0.14 0.00 0.00 0.00 0.00 23.12 21.37 1urb s ALA 18 CO 0.64 0.33 1.57 -2.30 0.00 0.00 0.00 175.76 175.99 1urb n PRO 19 N -1.15 2.07 -0.80 0.00 -0.02 -1.26 -0.34 135.00 133.49 1urb n PRO 19 Ca -0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1urb n PRO 19 Cb 0.56 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1urb n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1urb n GLY 20 N 3.37 0.46 0.24 -1.23 0.00 -1.26 -4.85 105.19 101.92 1urb n GLY 20 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1urb n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1urb h GLY 21 N 0.00 0.00 0.24 -0.02 0.00 -0.81 -3.06 103.07 99.42 1urb h GLY 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1urb h GLY 21 CO 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 176.54 176.00 1urb n ALA 22 N -2.11 3.70 -1.56 3.60 0.00 -1.26 -0.83 120.51 122.05 1urb n ALA 22 Ca 0.02 -0.47 -0.39 0.00 0.00 0.00 0.00 53.44 52.61 1urb n ALA 22 Cb 0.44 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 18.94 1urb n ALA 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1urb n ARG 23 N -1.02 0.86 -0.01 0.00 1.74 -1.16 -4.52 116.66 112.55 1urb n ARG 23 Ca 0.08 0.33 0.04 0.00 -0.77 0.00 0.00 57.85 57.52 1urb n ARG 23 Cb 0.36 -1.98 -0.07 0.00 -1.02 0.00 0.00 32.46 29.75 1urb n ARG 23 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1urb n ARG 24 N -0.44 0.39 -3.74 5.56 1.74 -1.26 -0.82 116.66 118.09 1urb n ARG 24 Ca 0.12 -0.08 -0.34 0.00 -0.77 0.00 0.00 57.85 56.79 1urb n ARG 24 Cb 0.45 -1.21 -0.05 0.00 -1.02 0.00 0.00 32.46 30.64 1urb n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1urb s LEU 25 N -3.66 4.35 0.00 0.55 1.43 -1.26 -4.59 118.68 115.51 1urb s LEU 25 Ca -0.03 0.57 0.12 0.00 -1.03 0.00 0.00 54.13 53.75 1urb s LEU 25 Cb 0.05 -2.81 -0.08 0.00 0.03 0.00 0.00 46.19 43.38 1urb s LEU 25 CO 0.36 0.21 0.58 0.35 0.23 0.00 0.00 176.35 178.08 1urb n THR 26 N 0.89 0.00 -3.86 5.49 -2.24 -1.26 -5.01 114.28 108.29 1urb n THR 26 Ca -0.09 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1urb n THR 26 Cb 0.52 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 69.82 1urb n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1urb n GLY 27 N 1.15 0.57 3.76 3.38 0.00 -1.26 -5.15 105.19 107.65 1urb n GLY 27 Ca 0.03 -0.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.67 1urb n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1urb s ASP 28 N -2.58 5.94 0.00 1.61 2.15 -1.26 -4.96 116.67 117.58 1urb s ASP 28 Ca 0.16 2.65 0.18 0.00 0.43 0.00 0.00 52.55 55.97 1urb s ASP 28 Cb -0.01 -2.63 0.04 0.00 -0.30 0.00 0.00 42.92 40.02 1urb s ASP 28 CO 0.01 -1.10 0.95 0.00 -0.17 0.00 0.00 175.17 174.86 1urb n GLN 29 N -0.35 1.58 -0.11 4.34 1.13 -1.26 -4.64 117.38 118.07 1urb n GLN 29 Ca 0.06 -1.07 -0.06 0.00 -1.94 0.00 0.00 57.00 53.99 1urb n GLN 29 Cb 0.45 -1.32 0.00 0.00 0.11 0.00 0.00 30.24 29.47 1urb n GLN 29 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1urb h THR 30 N 2.42 0.34 -0.74 5.09 2.02 -1.99 -0.06 112.91 119.98 1urb h THR 30 Ca 0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 1urb h THR 30 Cb 0.64 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1urb h THR 30 CO 0.00 0.00 0.27 0.00 0.37 0.00 0.00 175.52 176.16 1urb h ALA 31 N 0.98 1.08 -0.65 6.16 0.00 -2.00 -1.28 119.26 123.55 1urb h ALA 31 Ca 0.19 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1urb h ALA 31 Cb 0.48 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1urb h ALA 31 CO -0.50 0.64 0.08 0.00 0.00 0.00 0.00 179.25 179.47 1urb h ALA 32 N 1.20 0.90 -0.62 0.00 0.00 -1.66 -2.16 119.26 116.93 1urb h ALA 32 Ca 0.24 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1urb h ALA 32 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1urb h ALA 32 CO -0.02 0.67 0.02 1.25 0.00 0.00 0.00 179.25 181.17 1urb h LEU 33 N 1.01 1.06 -0.39 0.00 5.85 -0.65 -2.67 115.31 119.52 1urb h LEU 33 Ca 0.19 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.63 1urb h LEU 33 Cb 0.47 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1urb h LEU 33 CO 0.02 1.09 0.25 0.03 -0.34 0.00 0.00 178.44 179.49 1urb h ARG 34 N 0.99 0.49 0.00 1.25 3.08 -1.01 -0.94 114.38 118.23 1urb h ARG 34 Ca 0.18 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1urb h ARG 34 Cb 0.54 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1urb h ARG 34 CO 0.03 0.32 0.00 -0.25 -1.07 0.00 0.00 179.97 179.00 1urb n ASP 35 N -4.84 0.27 0.02 7.04 8.00 -0.83 -1.60 116.55 124.61 1urb n ASP 35 Ca 0.01 0.58 0.12 0.00 0.71 0.00 0.00 54.79 56.21 1urb n ASP 35 Cb 0.04 -0.63 0.22 0.00 -0.02 0.00 0.00 41.12 40.72 1urb n ASP 35 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1urb n SER 36 N -1.82 0.55 -4.64 -2.24 7.64 -0.37 -4.55 113.62 108.20 1urb n SER 36 Ca 0.02 -0.13 -0.39 0.00 1.01 0.00 0.00 58.87 59.37 1urb n SER 36 Cb 0.13 0.26 -0.08 0.00 -1.01 0.00 0.00 64.21 63.52 1urb n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1urb s LEU 37 N -3.41 4.10 -0.11 -3.43 1.43 -0.63 -4.71 118.68 111.92 1urb s LEU 37 Ca 0.09 0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 53.58 1urb s LEU 37 Cb 0.16 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.87 1urb s LEU 37 CO 0.71 -0.17 0.29 -0.55 0.23 0.00 0.00 176.35 176.86 1urb s SER 38 N 1.33 -0.31 0.00 2.29 0.15 -1.26 -5.03 113.70 110.87 1urb s SER 38 Ca 0.19 0.59 0.18 0.00 0.70 0.00 0.00 55.95 57.61 1urb s SER 38 Cb -0.15 0.55 0.27 0.00 -1.71 0.00 0.00 66.02 64.97 1urb s SER 38 CO 0.09 -0.13 1.19 -0.90 1.20 0.00 0.00 173.24 174.69 1urb n ASP 39 N 3.47 2.85 -4.66 5.45 5.68 -1.26 -1.13 116.55 126.95 1urb n ASP 39 Ca -0.18 -1.84 -0.31 0.00 -0.50 0.00 0.00 54.79 51.97 1urb n ASP 39 Cb 0.56 -0.13 0.17 0.00 -1.14 0.00 0.00 41.12 40.58 1urb n ASP 39 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1urb s LYS 40 N -1.33 0.92 0.60 0.11 -2.85 -1.26 -4.86 119.74 111.07 1urb s LYS 40 Ca 0.27 1.39 -0.18 0.00 -1.00 0.00 0.00 55.97 56.44 1urb s LYS 40 Cb 0.17 -1.73 -0.03 0.00 -2.06 0.00 0.00 37.83 34.18 1urb s LYS 40 CO 0.24 -2.64 1.21 -2.14 0.10 0.00 0.00 175.35 172.12 1urb s PRO 41 N -4.67 2.90 -0.12 1.78 0.02 -1.26 -4.53 135.00 129.12 1urb s PRO 41 Ca 0.66 1.83 -0.12 0.00 0.02 0.00 0.00 61.00 63.40 1urb s PRO 41 Cb -0.22 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.33 1urb s PRO 41 CO 0.59 -1.26 0.25 0.00 -0.33 0.00 0.00 177.00 176.25 1urb s ALA 42 N -1.61 3.70 -0.06 -1.55 0.00 -0.45 -4.93 121.76 116.87 1urb s ALA 42 Ca 0.78 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.25 1urb s ALA 42 Cb -0.31 -2.25 -0.26 0.00 0.00 0.00 0.00 23.12 20.30 1urb s ALA 42 CO 0.34 0.31 0.60 -0.22 0.00 0.00 0.00 175.76 176.80 1urb h LYS 43 N 5.86 0.17 -4.93 0.00 3.64 -0.90 -3.39 116.57 117.03 1urb h LYS 43 Ca -0.47 -0.29 -0.31 0.00 -1.27 0.00 0.00 60.65 58.31 1urb h LYS 43 Cb 1.19 0.11 -0.15 0.00 -0.41 0.00 0.00 32.23 32.97 1urb h LYS 43 CO 0.68 0.95 -0.68 -0.80 -2.27 0.00 0.00 179.45 177.33 1urb s ASN 44 N -6.71 1.52 -0.05 4.20 0.01 -1.04 -3.15 114.94 109.72 1urb s ASN 44 Ca -0.13 -1.11 -0.02 0.00 -0.71 0.00 0.00 52.86 50.89 1urb s ASN 44 Cb 0.07 0.05 0.03 0.00 0.41 0.00 0.00 41.25 41.81 1urb s ASN 44 CO 0.81 -0.47 0.12 -0.63 -1.51 0.00 0.00 177.10 175.42 1urb s ILE 45 N -3.50 -0.04 -0.19 0.60 1.01 -0.52 -1.43 121.20 117.13 1urb s ILE 45 Ca 0.21 0.16 0.01 0.00 0.00 0.00 0.00 60.65 61.03 1urb s ILE 45 Cb 0.05 -0.20 0.04 0.00 0.01 0.00 0.00 42.46 42.36 1urb s ILE 45 CO 0.03 0.07 -0.12 -0.63 0.00 0.00 0.00 174.94 174.29 1urb s ILE 46 N 0.99 1.65 -0.25 2.92 1.01 -0.20 -1.25 121.20 126.07 1urb s ILE 46 Ca -0.08 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.60 1urb s ILE 46 Cb -0.10 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.69 1urb s ILE 46 CO -0.04 0.26 0.01 -0.22 0.00 0.00 0.00 174.94 174.95 1urb s LEU 47 N 1.41 3.26 -0.20 2.97 0.20 0.07 -1.16 118.68 125.23 1urb s LEU 47 Ca 0.01 -0.42 -0.04 0.00 0.69 0.00 0.00 54.13 54.36 1urb s LEU 47 Cb -0.15 -1.82 -0.02 0.00 -0.43 0.00 0.00 46.19 43.77 1urb s LEU 47 CO -0.09 -0.06 -0.02 -0.76 -0.29 0.00 0.00 176.35 175.13 1urb s LEU 48 N 1.52 3.14 -0.15 -0.68 2.01 0.52 -0.20 118.68 124.83 1urb s LEU 48 Ca 0.05 -0.25 -0.01 0.00 0.01 0.00 0.00 54.13 53.92 1urb s LEU 48 Cb -0.15 -1.79 -0.01 0.00 0.01 0.00 0.00 46.19 44.24 1urb s LEU 48 CO -0.00 0.05 -0.11 -0.63 1.01 0.00 0.00 176.35 176.67 1urb s ILE 49 N 1.07 3.19 -0.45 -0.59 -1.09 -0.04 -1.40 121.20 121.89 1urb s ILE 49 Ca 0.02 -0.60 -0.12 0.00 -2.23 0.00 0.00 60.65 57.71 1urb s ILE 49 Cb -0.14 -2.37 0.08 0.00 -1.58 0.00 0.00 42.46 38.45 1urb s ILE 49 CO 0.01 0.51 0.34 -0.83 -1.23 0.00 0.00 174.94 173.74 1urb s GLY 50 N 0.52 2.02 -0.08 6.18 0.00 0.82 -0.90 107.32 115.87 1urb s GLY 50 Ca -0.07 -2.20 -0.29 0.00 0.00 0.00 0.00 44.72 42.16 1urb s GLY 50 CO 0.04 1.03 2.09 -2.01 0.00 0.00 0.00 173.10 174.25 1urb n ASN 51 N 5.06 3.76 -0.25 1.64 2.85 -0.79 -1.46 115.26 126.07 1urb n ASN 51 Ca -0.11 0.58 -0.03 0.00 -0.11 0.00 0.00 54.58 54.90 1urb n ASN 51 Cb 0.43 -1.54 -0.01 0.00 1.24 0.00 0.00 39.78 39.89 1urb n ASN 51 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1urb n GLY 52 N 5.11 0.62 3.07 8.20 0.00 -1.23 -0.76 105.19 120.21 1urb n GLY 52 Ca 0.25 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1urb n GLY 52 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1urb n MET 53 N -2.35 3.33 -1.41 1.61 1.56 -0.54 -4.02 117.12 115.31 1urb n MET 53 Ca -0.03 -3.36 -0.22 0.00 -0.27 0.00 0.00 57.70 53.82 1urb n MET 53 Cb 0.18 -3.12 0.16 0.00 2.15 0.00 0.00 33.22 32.59 1urb n MET 53 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1urb n GLY 54 N 3.75 -1.47 0.36 -5.12 0.00 -1.26 -4.53 105.19 96.92 1urb n GLY 54 Ca 0.43 -1.69 0.09 0.00 0.00 0.00 0.00 46.02 44.85 1urb n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1urb h ASP 55 N -1.36 0.63 -0.53 1.61 3.32 -1.93 -1.93 116.42 116.23 1urb h ASP 55 Ca -0.32 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.72 1urb h ASP 55 Cb 0.90 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 1urb h ASP 55 CO 0.23 0.37 0.23 -1.28 -1.72 0.00 0.00 179.24 177.07 1urb h SER 56 N 0.69 0.71 -0.60 6.45 0.87 -1.92 0.22 113.55 119.99 1urb h SER 56 Ca 0.36 -0.15 -0.08 0.00 -1.23 0.00 0.00 61.79 60.69 1urb h SER 56 Cb 0.48 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1urb h SER 56 CO -0.14 0.67 0.07 -0.33 -0.53 0.00 0.00 176.83 176.57 1urb h GLU 57 N 0.71 1.01 -0.27 2.24 3.07 -1.68 0.20 114.58 119.86 1urb h GLU 57 Ca 0.18 -0.28 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1urb h GLU 57 Cb 0.16 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1urb h GLU 57 CO -0.02 0.96 0.13 0.82 -1.40 0.00 0.00 179.01 179.50 1urb h ILE 58 N 0.91 1.15 -0.39 3.13 2.04 -1.12 -1.24 117.51 121.99 1urb h ILE 58 Ca 0.18 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1urb h ILE 58 Cb 0.46 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1urb h ILE 58 CO 0.02 0.15 0.19 0.74 0.00 0.00 0.00 178.15 179.25 1urb h THR 59 N 0.30 1.17 -0.52 -0.27 2.02 -0.54 -0.65 112.91 114.42 1urb h THR 59 Ca 0.09 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.81 1urb h THR 59 Cb 0.13 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.27 1urb h THR 59 CO -0.01 0.18 0.33 0.00 0.37 0.00 0.00 175.52 176.39 1urb h ALA 60 N 1.04 0.66 -0.46 6.16 0.00 -0.82 -0.66 119.26 125.19 1urb h ALA 60 Ca 0.13 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1urb h ALA 60 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1urb h ALA 60 CO -0.02 0.06 -0.04 0.00 0.00 0.00 0.00 179.25 179.25 1urb h ALA 61 N 1.21 1.05 0.01 0.00 0.00 -0.94 -2.13 119.26 118.46 1urb h ALA 61 Ca 0.20 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1urb h ALA 61 Cb -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1urb h ALA 61 CO -0.07 0.58 -0.01 -0.09 0.00 0.00 0.00 179.25 179.67 1urb h ARG 62 N 0.73 -0.01 -0.48 0.00 2.43 -0.76 -1.09 114.38 115.20 1urb h ARG 62 Ca 0.13 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.40 1urb h ARG 62 Cb 0.51 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.98 1urb h ARG 62 CO 0.03 0.40 -0.07 -0.91 -1.51 0.00 0.00 179.97 177.91 1urb h ASN 63 N -0.43 -0.35 0.22 -3.80 2.35 -1.07 0.60 115.58 113.10 1urb h ASN 63 Ca -0.00 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1urb h ASN 63 Cb 0.42 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.05 1urb h ASN 63 CO 0.00 -0.12 -0.11 0.22 -1.65 0.00 0.00 177.43 175.77 1urb h TYR 64 N 0.04 -0.27 0.00 1.19 5.03 -1.41 -2.44 116.97 119.12 1urb h TYR 64 Ca 0.24 -0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.45 1urb h TYR 64 Cb 0.36 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.72 1urb h TYR 64 CO -0.37 0.12 -0.46 0.00 -1.32 0.00 0.00 178.16 176.13 1urb h ALA 65 N -0.37 0.73 0.00 1.82 0.00 -1.08 -1.87 119.26 118.50 1urb h ALA 65 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1urb h ALA 65 Cb 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1urb h ALA 65 CO 0.05 0.51 0.00 0.39 0.00 0.00 0.00 179.25 180.19 1urb n GLU 66 N -3.17 2.15 0.00 0.00 -0.58 0.19 -4.86 120.64 114.37 1urb n GLU 66 Ca 0.02 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1urb n GLU 66 Cb 0.70 -0.59 0.00 0.00 -0.57 0.00 0.00 31.44 30.98 1urb n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1urb n GLY 67 N 0.36 -0.95 0.36 0.62 0.00 -0.17 -3.40 105.19 102.01 1urb n GLY 67 Ca 0.00 -1.55 0.07 0.00 0.00 0.00 0.00 46.02 44.53 1urb n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1urb h ALA 68 N 0.00 1.61 -0.42 4.61 0.00 -1.79 0.54 119.26 123.81 1urb h ALA 68 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1urb h ALA 68 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1urb h ALA 68 CO 0.00 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1urb n GLY 69 N -1.41 1.08 0.82 0.00 0.00 -1.26 -4.89 105.19 99.52 1urb n GLY 69 Ca 0.15 -0.46 -0.07 0.00 0.00 0.00 0.00 46.02 45.64 1urb n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1urb n GLY 70 N 1.12 -2.09 3.59 -0.02 0.00 0.18 -0.26 105.19 107.72 1urb n GLY 70 Ca 0.14 -1.53 -0.04 0.00 0.00 0.00 0.00 46.02 44.60 1urb n GLY 70 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1urb s PHE 71 N -1.52 -1.19 -0.22 1.61 5.36 -1.26 -4.62 117.98 116.14 1urb s PHE 71 Ca 0.16 2.17 -0.29 0.00 -0.96 0.00 0.00 56.93 58.01 1urb s PHE 71 Cb -0.01 0.69 0.00 0.00 -0.34 0.00 0.00 43.02 43.36 1urb s PHE 71 CO 0.12 -0.60 1.15 -0.06 -1.46 0.00 0.00 175.22 174.37 1urb s PHE 72 N 2.49 3.09 0.57 10.12 0.08 -1.26 -4.90 117.98 128.17 1urb s PHE 72 Ca -0.07 1.23 0.26 0.00 0.12 0.00 0.00 56.93 58.47 1urb s PHE 72 Cb -0.10 -3.44 1.63 0.00 -0.57 0.00 0.00 43.02 40.53 1urb s PHE 72 CO -0.18 -1.06 2.16 0.87 -0.10 0.00 0.00 175.22 176.90 1urb h LYS 73 N 7.92 0.00 0.00 0.44 1.79 -1.96 -2.56 116.57 122.20 1urb h LYS 73 Ca -0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.25 1urb h LYS 73 Cb 1.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 1urb h LYS 73 CO 0.98 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.76 1urb n GLY 74 N -1.42 -0.42 0.31 3.86 0.00 -1.26 -4.22 105.19 102.04 1urb n GLY 74 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1urb n GLY 74 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1urb h ILE 75 N 0.00 0.50 -0.00 -0.61 2.04 -1.80 -0.41 117.51 117.23 1urb h ILE 75 Ca 0.00 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1urb h ILE 75 Cb 0.00 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 1urb h ILE 75 CO 0.00 0.07 -0.38 0.47 0.00 0.00 0.00 178.15 178.32 1urb n ASP 76 N -5.04 0.49 0.03 1.72 8.00 -0.97 -4.20 116.55 116.58 1urb n ASP 76 Ca 0.21 -0.24 0.14 0.00 0.71 0.00 0.00 54.79 55.60 1urb n ASP 76 Cb 0.61 0.11 0.56 0.00 -0.02 0.00 0.00 41.12 42.38 1urb n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1urb n ALA 77 N -1.36 2.29 -2.41 2.24 0.00 -0.16 -4.81 120.51 116.29 1urb n ALA 77 Ca 0.07 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 1urb n ALA 77 Cb 0.33 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1urb n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1urb s LEU 78 N -3.40 4.28 0.17 0.00 1.02 -1.25 -1.83 118.68 117.67 1urb s LEU 78 Ca 0.13 1.86 -0.07 0.00 0.02 0.00 0.00 54.13 56.07 1urb s LEU 78 Cb 0.17 -3.56 0.05 0.00 0.02 0.00 0.00 46.19 42.87 1urb s LEU 78 CO 0.54 -0.62 1.50 1.55 0.02 0.00 0.00 176.35 179.34 1urb h PRO 79 N 7.57 0.75 -5.52 1.29 0.13 -1.88 -3.44 132.00 130.91 1urb h PRO 79 Ca -0.34 -0.42 -0.59 0.00 -0.87 0.00 0.00 66.00 63.77 1urb h PRO 79 Cb 1.16 0.03 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 1urb h PRO 79 CO 0.89 1.05 -0.20 -0.51 -0.23 0.00 0.00 178.00 178.99 1urb s LEU 80 N -8.65 4.20 0.07 1.56 2.01 -1.14 -4.99 118.68 111.74 1urb s LEU 80 Ca -0.09 0.59 0.01 0.00 0.01 0.00 0.00 54.13 54.65 1urb s LEU 80 Cb 0.11 -2.54 -0.03 0.00 0.01 0.00 0.00 46.19 43.74 1urb s LEU 80 CO 0.86 -0.03 -0.06 0.42 1.01 0.00 0.00 176.35 178.55 1urb s THR 81 N 0.99 0.51 0.00 5.49 -4.23 -1.26 -0.60 115.64 116.54 1urb s THR 81 Ca 0.20 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.15 1urb s THR 81 Cb -0.14 -1.20 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1urb s THR 81 CO 0.08 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1urb n GLY 82 N 0.59 1.77 3.08 3.99 0.00 0.40 -3.93 105.19 111.09 1urb n GLY 82 Ca -0.17 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 1urb n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1urb s GLN 83 N -1.96 1.47 0.06 1.61 1.11 -0.87 -1.67 119.66 119.39 1urb s GLN 83 Ca 0.00 -0.49 0.06 0.00 0.01 0.00 0.00 55.36 54.95 1urb s GLN 83 Cb 0.00 -1.30 -0.03 0.00 -1.01 0.00 0.00 33.01 30.67 1urb s GLN 83 CO 0.00 0.19 -0.18 1.52 0.01 0.00 0.00 175.29 176.83 1urb s TYR 84 N 0.12 1.57 0.21 0.91 -0.85 -0.16 -1.92 117.35 117.22 1urb s TYR 84 Ca -0.04 -0.38 -0.18 0.00 -0.52 0.00 0.00 57.07 55.94 1urb s TYR 84 Cb -0.11 -0.91 -0.08 0.00 0.38 0.00 0.00 41.96 41.24 1urb s TYR 84 CO 0.02 0.09 0.69 0.95 -1.52 0.00 0.00 175.55 175.78 1urb s THR 85 N -0.93 4.63 -0.13 -3.49 -4.23 -0.28 -2.14 115.64 109.08 1urb s THR 85 Ca 0.04 1.18 0.23 0.00 -1.18 0.00 0.00 61.69 61.96 1urb s THR 85 Cb -0.09 -3.83 0.46 0.00 1.34 0.00 0.00 72.50 70.38 1urb s THR 85 CO 0.02 0.21 1.15 0.00 -0.54 0.00 0.00 174.62 175.47 1urb n HIS 86 N 0.73 0.61 -1.36 3.99 1.44 -1.26 -1.01 115.22 118.36 1urb n HIS 86 Ca -0.03 -1.27 -0.33 0.00 -2.01 0.00 0.00 57.72 54.09 1urb n HIS 86 Cb 0.51 -0.20 0.09 0.00 0.12 0.00 0.00 29.99 30.52 1urb n HIS 86 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1urb s TYR 87 N -1.83 2.26 0.00 -1.40 1.13 -1.26 -4.39 117.35 111.86 1urb s TYR 87 Ca 0.33 1.61 0.00 0.00 -1.41 0.00 0.00 57.07 57.60 1urb s TYR 87 Cb 0.36 -3.27 0.00 0.00 -1.10 0.00 0.00 41.96 37.96 1urb s TYR 87 CO -0.10 -2.19 0.00 0.00 -2.51 0.00 0.00 175.55 170.74 1urb n ALA 88 N -3.08 0.00 -2.53 9.51 0.00 -0.41 -4.90 120.51 119.10 1urb n ALA 88 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.31 1urb n ALA 88 Cb 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.83 1urb n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1urb s LEU 89 N 0.00 2.23 -0.24 0.00 1.43 -0.03 -0.31 118.68 121.76 1urb s LEU 89 Ca 0.00 -0.59 -0.27 0.00 -1.03 0.00 0.00 54.13 52.24 1urb s LEU 89 Cb 0.00 -0.89 0.00 0.00 0.03 0.00 0.00 46.19 45.33 1urb s LEU 89 CO 0.00 0.10 0.94 0.21 0.23 0.00 0.00 176.35 177.83 1urb s ASN 90 N -1.50 6.97 0.24 2.29 3.84 0.26 -3.87 114.94 123.16 1urb s ASN 90 Ca 0.06 1.21 -0.06 0.00 0.21 0.00 0.00 52.86 54.28 1urb s ASN 90 Cb -0.09 -2.49 0.43 0.00 -0.55 0.00 0.00 41.25 38.55 1urb s ASN 90 CO 0.03 -0.60 1.71 0.50 -2.79 0.00 0.00 177.10 175.94 1urb h LYS 91 N 7.58 0.33 -0.05 0.43 3.64 -1.93 0.34 116.57 126.90 1urb h LYS 91 Ca -0.21 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.13 1urb h LYS 91 Cb 1.08 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1urb h LYS 91 CO 0.93 0.22 -0.06 0.87 -2.27 0.00 0.00 179.45 179.14 1urb h LYS 92 N 0.34 0.13 0.00 1.90 1.79 -1.93 -3.37 116.57 115.43 1urb h LYS 92 Ca 0.40 -0.07 -0.27 0.00 -2.18 0.00 0.00 60.65 58.52 1urb h LYS 92 Cb 0.63 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.24 1urb h LYS 92 CO -0.44 0.61 -1.54 1.79 -1.08 0.00 0.00 179.45 178.78 1urb h THR 93 N -0.33 1.05 0.00 -0.16 1.35 -1.94 -3.48 112.91 109.40 1urb h THR 93 Ca 0.01 -2.87 0.00 0.00 -0.55 0.00 0.00 66.41 63.00 1urb h THR 93 Cb 0.59 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1urb h THR 93 CO 0.02 0.60 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1urb n GLY 94 N 1.51 0.89 3.87 5.82 0.00 0.12 -5.01 105.19 112.39 1urb n GLY 94 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1urb n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1urb s LYS 95 N -0.15 2.74 0.46 1.61 1.02 -1.26 -4.67 119.74 119.49 1urb s LYS 95 Ca 0.00 0.51 -0.24 0.00 0.02 0.00 0.00 55.97 56.27 1urb s LYS 95 Cb 0.00 -2.00 -0.07 0.00 -0.52 0.00 0.00 37.83 35.24 1urb s LYS 95 CO 0.00 -1.13 1.26 -2.14 -0.92 0.00 0.00 175.35 172.41 1urb s PRO 96 N -5.31 3.68 -0.34 -1.68 0.02 -1.26 -0.58 135.00 129.53 1urb s PRO 96 Ca 0.59 2.02 0.02 0.00 0.02 0.00 0.00 61.00 63.64 1urb s PRO 96 Cb -0.12 -2.49 0.09 0.00 0.02 0.00 0.00 34.50 32.01 1urb s PRO 96 CO 0.52 -0.69 0.06 0.34 -0.33 0.00 0.00 177.00 176.91 1urb s ASP 97 N -1.05 4.86 0.65 2.53 -1.08 0.58 -4.60 116.67 118.56 1urb s ASP 97 Ca 0.63 -1.95 0.32 0.00 -0.52 0.00 0.00 52.55 51.03 1urb s ASP 97 Cb -0.35 -1.68 1.75 0.00 -1.46 0.00 0.00 42.92 41.19 1urb s ASP 97 CO 0.43 -0.38 2.02 1.88 0.52 0.00 0.00 175.17 179.63 1urb h TYR 98 N 7.77 0.00 -3.73 -5.34 0.05 -1.94 -1.08 116.97 112.69 1urb h TYR 98 Ca -0.10 0.00 -0.64 0.00 0.05 0.00 0.00 58.73 58.04 1urb h TYR 98 Cb 1.03 0.00 -0.38 0.00 1.01 0.00 0.00 36.73 38.39 1urb h TYR 98 CO 0.52 0.00 -0.78 0.08 -1.05 0.00 0.00 178.16 176.93 1urb s VAL 99 N -4.24 1.86 0.72 -2.88 1.01 -1.26 -4.30 120.40 111.32 1urb s VAL 99 Ca -0.04 -1.52 -0.10 0.00 0.00 0.00 0.00 61.98 60.32 1urb s VAL 99 Cb 0.11 -2.09 0.04 0.00 0.00 0.00 0.00 36.38 34.44 1urb s VAL 99 CO 0.36 -0.14 1.09 0.28 0.00 0.00 0.00 175.10 176.70 1urb s THR 100 N 1.22 2.91 0.47 3.92 -1.32 -1.26 -4.82 115.64 116.76 1urb s THR 100 Ca -0.05 0.19 0.03 0.00 -1.21 0.00 0.00 61.69 60.65 1urb s THR 100 Cb -0.19 -3.27 0.03 0.00 -1.51 0.00 0.00 72.50 67.56 1urb s THR 100 CO -0.06 -0.34 0.26 -0.90 -2.21 0.00 0.00 174.62 171.36 1urb n ASP 101 N -3.05 2.70 0.20 8.08 5.75 -1.26 -4.90 116.55 124.08 1urb n ASP 101 Ca 0.07 -2.71 0.07 0.00 -0.01 0.00 0.00 54.79 52.21 1urb n ASP 101 Cb 0.59 0.06 0.35 0.00 -1.03 0.00 0.00 41.12 41.09 1urb n ASP 101 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1urb h SER 102 N 0.70 0.00 0.16 -1.12 0.02 -1.99 -2.99 113.55 108.32 1urb h SER 102 Ca -0.32 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.62 1urb h SER 102 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1urb h SER 102 CO 0.51 0.32 -0.07 0.00 -1.14 0.00 0.00 176.83 176.44 1urb h ALA 103 N 1.68 -0.21 -0.34 3.77 0.00 -1.90 -1.22 119.26 121.03 1urb h ALA 103 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1urb h ALA 103 Cb 0.88 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1urb h ALA 103 CO 0.04 -0.47 0.17 0.00 0.00 0.00 0.00 179.25 179.00 1urb h ALA 104 N 0.27 0.44 -0.24 0.00 0.00 -1.66 -1.09 119.26 116.98 1urb h ALA 104 Ca -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1urb h ALA 104 Cb 0.40 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1urb h ALA 104 CO 0.04 -0.02 0.08 0.66 0.00 0.00 0.00 179.25 180.01 1urb h SER 105 N 0.42 0.34 -0.93 0.00 4.64 -1.58 -0.39 113.55 116.04 1urb h SER 105 Ca 0.12 -0.19 0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1urb h SER 105 Cb 0.09 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1urb h SER 105 CO -0.02 0.44 0.61 0.00 -0.87 0.00 0.00 176.83 176.99 1urb h ALA 106 N 0.91 1.41 -0.52 5.18 0.00 -1.11 -1.42 119.26 123.72 1urb h ALA 106 Ca 0.08 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1urb h ALA 106 Cb 0.21 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1urb h ALA 106 CO -0.00 0.49 0.13 1.15 0.00 0.00 0.00 179.25 181.02 1urb h THR 107 N 1.16 1.24 -0.36 0.00 2.02 -0.76 -0.87 112.91 115.34 1urb h THR 107 Ca 0.38 -0.85 0.07 0.00 0.77 0.00 0.00 66.41 66.77 1urb h THR 107 Cb 0.03 0.79 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 1urb h THR 107 CO -0.12 0.31 -0.01 0.00 0.37 0.00 0.00 175.52 176.07 1urb h ALA 108 N 1.01 0.32 0.00 6.16 0.00 0.02 0.18 119.26 126.94 1urb h ALA 108 Ca 0.17 0.11 -0.17 0.00 0.00 0.00 0.00 54.91 55.02 1urb h ALA 108 Cb 0.33 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1urb h ALA 108 CO 0.00 -0.41 -0.93 0.11 0.00 0.00 0.00 179.25 178.02 1urb h TRP 109 N 0.08 0.00 0.00 0.00 0.09 -1.39 -1.03 115.95 113.70 1urb h TRP 109 Ca 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 58.89 59.13 1urb h TRP 109 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.16 29.49 1urb h TRP 109 CO -0.26 0.71 -0.27 0.66 0.09 0.00 0.00 178.44 179.37 1urb h SER 110 N 0.00 0.00 0.00 0.11 4.64 -0.76 -3.27 113.55 114.27 1urb h SER 110 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1urb h SER 110 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1urb h SER 110 CO 0.08 0.13 -0.04 0.35 -0.87 0.00 0.00 176.83 176.47 1urb n THR 111 N -3.07 0.00 -0.99 2.95 -2.24 0.59 -0.06 114.28 111.46 1urb n THR 111 Ca 0.03 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1urb n THR 111 Cb 0.59 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 1urb n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1urb n GLY 112 N 0.79 0.58 3.14 3.38 0.00 -0.39 -4.90 105.19 107.78 1urb n GLY 112 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1urb n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1urb s VAL 113 N -2.30 1.20 0.50 1.61 0.11 -1.25 -4.90 120.40 115.37 1urb s VAL 113 Ca 0.00 -0.75 -0.21 0.00 -2.93 0.00 0.00 61.98 58.09 1urb s VAL 113 Cb 0.00 -1.02 -0.07 0.00 -1.53 0.00 0.00 36.38 33.76 1urb s VAL 113 CO 0.00 0.25 1.11 -0.54 -3.33 0.00 0.00 175.10 172.59 1urb s LYS 114 N -0.58 3.61 0.17 1.54 -0.14 -1.26 -3.73 119.74 119.36 1urb s LYS 114 Ca 0.05 1.58 -0.00 0.00 -1.36 0.00 0.00 55.97 56.23 1urb s LYS 114 Cb -0.06 -2.15 0.00 0.00 -1.68 0.00 0.00 37.83 33.94 1urb s LYS 114 CO -0.00 -0.63 0.22 -2.37 -0.76 0.00 0.00 175.35 171.82 1urb n THR 115 N -0.95 0.00 -3.30 2.17 5.66 -1.26 -4.49 114.28 112.10 1urb n THR 115 Ca 0.10 -0.92 -0.27 0.00 -3.05 0.00 0.00 64.05 59.91 1urb n THR 115 Cb 0.51 0.55 -0.02 0.00 -1.55 0.00 0.00 70.33 69.81 1urb n THR 115 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1urb s TYR 116 N -3.77 3.49 0.08 1.09 1.13 -1.25 -0.85 117.35 117.27 1urb s TYR 116 Ca 0.15 0.53 -0.33 0.00 -1.41 0.00 0.00 57.07 56.01 1urb s TYR 116 Cb -0.00 -2.03 -0.13 0.00 -1.10 0.00 0.00 41.96 38.70 1urb s TYR 116 CO 0.11 0.12 1.72 0.09 -2.51 0.00 0.00 175.55 175.08 1urb n ASN 117 N -1.37 3.42 0.00 -0.18 3.02 -1.26 -2.08 115.26 116.82 1urb n ASN 117 Ca -0.03 1.03 0.00 0.00 -0.03 0.00 0.00 54.58 55.55 1urb n ASN 117 Cb 0.55 -1.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 1urb n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1urb n GLY 118 N 3.88 0.05 3.86 7.41 0.00 -1.26 -4.94 105.19 114.18 1urb n GLY 118 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1urb n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1urb s ALA 119 N -2.01 3.25 -0.20 4.61 0.00 -0.88 -0.41 121.76 126.13 1urb s ALA 119 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 1urb s ALA 119 Cb 0.00 -2.85 0.05 0.00 0.00 0.00 0.00 23.12 20.32 1urb s ALA 119 CO 0.00 0.05 -0.02 -0.51 0.00 0.00 0.00 175.76 175.28 1urb s LEU 120 N -3.59 1.80 -1.64 0.00 1.43 -0.53 -3.85 118.68 112.30 1urb s LEU 120 Ca 0.55 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 1urb s LEU 120 Cb -0.10 -0.90 0.00 0.00 0.03 0.00 0.00 46.19 45.22 1urb s LEU 120 CO 0.26 -0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1urb n GLY 121 N 4.86 0.07 3.05 -3.19 0.00 -1.25 -0.99 105.19 107.74 1urb n GLY 121 Ca -0.11 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 1urb n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1urb s VAL 122 N -2.86 0.13 0.00 1.61 -7.23 -1.26 -2.63 120.40 108.16 1urb s VAL 122 Ca 0.00 -1.05 0.00 0.00 -1.81 0.00 0.00 61.98 59.12 1urb s VAL 122 Cb 0.00 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.31 1urb s VAL 122 CO 0.00 -0.58 0.00 -0.90 -0.31 0.00 0.00 175.10 173.31 1urb n ASP 123 N 1.15 0.00 0.09 4.85 5.68 -0.63 -4.77 116.55 122.93 1urb n ASP 123 Ca -0.21 -0.84 0.10 0.00 -0.50 0.00 0.00 54.79 53.34 1urb n ASP 123 Cb 0.57 0.00 0.43 0.00 -1.14 0.00 0.00 41.12 40.98 1urb n ASP 123 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1urb n ILE 124 N -1.18 0.92 0.67 2.12 -5.35 -1.26 -1.05 119.36 114.23 1urb n ILE 124 Ca 0.00 0.27 0.11 0.00 -0.27 0.00 0.00 62.75 62.85 1urb n ILE 124 Cb 0.00 -1.15 0.27 0.00 -1.74 0.00 0.00 39.64 37.03 1urb n ILE 124 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1urb n HIS 125 N -2.00 0.41 -1.33 4.28 8.25 -1.26 -4.92 115.22 118.65 1urb n HIS 125 Ca 0.02 -0.20 -0.10 0.00 -0.26 0.00 0.00 57.72 57.18 1urb n HIS 125 Cb 0.20 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.26 1urb n HIS 125 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1urb n GLU 126 N 1.00 -0.72 -3.14 -0.41 1.02 -0.21 -5.01 120.64 113.17 1urb n GLU 126 Ca 0.18 0.85 -0.39 0.00 -0.02 0.00 0.00 57.16 57.78 1urb n GLU 126 Cb 0.48 -4.79 -0.06 0.00 -0.02 0.00 0.00 31.44 27.06 1urb n GLU 126 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1urb s LYS 127 N -2.92 4.36 0.57 3.49 2.20 -1.26 -4.76 119.74 121.42 1urb s LYS 127 Ca 0.00 0.87 -0.18 0.00 -0.36 0.00 0.00 55.97 56.30 1urb s LYS 127 Cb 0.00 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 1urb s LYS 127 CO 0.00 0.44 1.09 -0.51 -0.36 0.00 0.00 175.35 176.01 1urb s ASP 128 N -0.49 5.72 -0.02 1.43 1.01 -1.26 -1.60 116.67 121.45 1urb s ASP 128 Ca 0.33 2.00 -0.01 0.00 0.71 0.00 0.00 52.55 55.58 1urb s ASP 128 Cb -0.20 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.19 1urb s ASP 128 CO 0.20 -1.22 0.05 -1.00 0.21 0.00 0.00 175.17 173.41 1urb s HIS 129 N -2.11 -0.03 0.40 4.23 3.76 -1.08 -4.91 115.29 115.55 1urb s HIS 129 Ca 0.68 0.16 -0.27 0.00 -0.15 0.00 0.00 55.06 55.48 1urb s HIS 129 Cb -0.20 -0.09 -0.10 0.00 1.11 0.00 0.00 32.58 33.30 1urb s HIS 129 CO 0.31 -0.07 1.47 -2.30 -0.85 0.00 0.00 174.74 173.31 1urb n PRO 130 N 3.64 2.55 -2.81 8.40 -0.02 -1.26 -4.83 135.00 140.66 1urb n PRO 130 Ca -0.20 0.90 -0.26 0.00 -2.02 0.00 0.00 63.50 61.92 1urb n PRO 130 Cb 0.55 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1urb n PRO 130 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1urb s THR 131 N -1.14 4.66 0.50 3.45 -4.23 -1.26 -4.52 115.64 113.10 1urb s THR 131 Ca 0.56 -0.07 0.15 0.00 -1.18 0.00 0.00 61.69 61.15 1urb s THR 131 Cb -0.46 -3.76 0.28 0.00 1.34 0.00 0.00 72.50 69.90 1urb s THR 131 CO 0.62 -0.67 2.11 -0.29 -0.54 0.00 0.00 174.62 175.85 1urb h ILE 132 N 0.31 0.99 -0.07 2.99 6.09 -0.80 -0.58 117.51 126.45 1urb h ILE 132 Ca -0.47 -0.04 -0.10 0.00 -1.37 0.00 0.00 64.86 62.87 1urb h ILE 132 Cb 1.22 0.86 0.01 0.00 0.47 0.00 0.00 36.82 39.37 1urb h ILE 132 CO 0.61 0.02 -0.36 0.25 -3.07 0.00 0.00 178.15 175.60 1urb h LEU 133 N 0.13 0.43 -0.24 2.19 6.46 -1.84 -0.16 115.31 122.27 1urb h LEU 133 Ca 0.06 -0.66 0.02 0.00 -0.12 0.00 0.00 57.88 57.18 1urb h LEU 133 Cb 0.10 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 1urb h LEU 133 CO -0.01 1.02 0.11 -0.33 -0.62 0.00 0.00 178.44 178.61 1urb h GLU 134 N -0.13 0.24 -0.68 1.25 5.08 -1.64 -0.29 114.58 118.40 1urb h GLU 134 Ca -0.03 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1urb h GLU 134 Cb 1.02 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1urb h GLU 134 CO 0.07 0.16 0.45 0.52 -1.00 0.00 0.00 179.01 179.21 1urb h MET 135 N 0.24 0.90 -0.73 2.33 2.86 -1.09 0.34 114.93 119.78 1urb h MET 135 Ca 0.10 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 1urb h MET 135 Cb 0.04 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 1urb h MET 135 CO -0.08 0.60 0.41 0.00 1.06 0.00 0.00 176.91 178.90 1urb h ALA 136 N 1.25 0.93 -0.42 6.32 0.00 -0.57 -1.24 119.26 125.53 1urb h ALA 136 Ca 0.25 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1urb h ALA 136 Cb -0.10 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 1urb h ALA 136 CO -0.05 0.43 0.01 -0.22 0.00 0.00 0.00 179.25 179.42 1urb h LYS 137 N 1.00 0.67 -0.41 0.00 3.64 -0.23 -1.46 116.57 119.78 1urb h LYS 137 Ca 0.26 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1urb h LYS 137 Cb 0.02 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1urb h LYS 137 CO -0.04 0.68 0.05 0.00 -2.27 0.00 0.00 179.45 177.88 1urb h ALA 138 N 1.38 0.55 0.00 5.00 0.00 0.04 -1.65 119.26 124.57 1urb h ALA 138 Ca 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1urb h ALA 138 Cb 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1urb h ALA 138 CO 0.01 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.54 1urb n ALA 139 N -2.38 2.02 -0.06 0.00 0.00 -0.57 -4.87 120.51 114.65 1urb n ALA 139 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1urb n ALA 139 Cb 0.25 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1urb n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1urb n GLY 140 N 0.26 0.47 3.82 0.00 0.00 -0.62 -5.07 105.19 104.04 1urb n GLY 140 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1urb n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1urb s LEU 141 N 0.00 3.35 0.54 0.99 1.43 -0.59 -4.85 118.68 119.55 1urb s LEU 141 Ca 0.00 1.70 -0.17 0.00 -1.03 0.00 0.00 54.13 54.63 1urb s LEU 141 Cb 0.00 -4.51 -0.06 0.00 0.03 0.00 0.00 46.19 41.64 1urb s LEU 141 CO 0.00 -1.21 1.02 0.00 0.23 0.00 0.00 176.35 176.39 1urb s ALA 142 N -2.73 2.90 -0.00 4.21 0.00 -0.68 -4.24 121.76 121.22 1urb s ALA 142 Ca 0.61 0.35 0.01 0.00 0.00 0.00 0.00 51.96 52.93 1urb s ALA 142 Cb -0.14 -3.19 -0.00 0.00 0.00 0.00 0.00 23.12 19.78 1urb s ALA 142 CO 0.44 -0.47 -0.04 0.95 0.00 0.00 0.00 175.76 176.64 1urb s THR 143 N -2.42 0.34 0.05 0.00 -4.23 -1.26 -1.30 115.64 106.82 1urb s THR 143 Ca 0.62 -0.20 0.03 0.00 -1.18 0.00 0.00 61.69 60.97 1urb s THR 143 Cb -0.13 -0.29 -0.03 0.00 1.34 0.00 0.00 72.50 73.39 1urb s THR 143 CO 0.31 0.09 -0.10 -0.83 -0.54 0.00 0.00 174.62 173.54 1urb s GLY 144 N -0.13 0.65 -0.18 3.99 0.00 0.91 -1.72 107.32 110.84 1urb s GLY 144 Ca 0.01 -0.84 -0.04 0.00 0.00 0.00 0.00 44.72 43.85 1urb s GLY 144 CO -0.00 -0.87 0.16 0.21 0.00 0.00 0.00 173.10 172.59 1urb s ASN 145 N -1.56 1.71 -0.02 1.64 2.47 0.22 -2.10 114.94 117.29 1urb s ASN 145 Ca -0.06 -0.32 0.05 0.00 0.42 0.00 0.00 52.86 52.95 1urb s ASN 145 Cb -0.10 0.11 -0.01 0.00 -1.45 0.00 0.00 41.25 39.80 1urb s ASN 145 CO 0.01 -0.33 -0.18 -0.69 -3.72 0.00 0.00 177.10 172.20 1urb s VAL 146 N 2.24 1.41 0.18 -5.21 1.01 -0.01 -1.33 120.40 118.69 1urb s VAL 146 Ca 0.04 -0.75 -0.18 0.00 0.00 0.00 0.00 61.98 61.10 1urb s VAL 146 Cb -0.15 -1.18 0.03 0.00 0.00 0.00 0.00 36.38 35.08 1urb s VAL 146 CO -0.10 0.40 0.51 -0.55 0.00 0.00 0.00 175.10 175.36 1urb s SER 147 N -0.31 -0.28 0.00 3.32 0.15 -0.33 -0.59 113.70 115.66 1urb s SER 147 Ca 0.04 -0.41 0.23 0.00 0.70 0.00 0.00 55.95 56.51 1urb s SER 147 Cb -0.08 0.56 0.07 0.00 -1.71 0.00 0.00 66.02 64.86 1urb s SER 147 CO -0.00 -1.01 1.15 0.35 1.20 0.00 0.00 173.24 174.93 1urb n THR 148 N -0.32 0.00 -2.80 6.45 -2.24 -1.11 -3.88 114.28 110.38 1urb n THR 148 Ca -0.12 -0.34 -0.15 0.00 -2.27 0.00 0.00 64.05 61.18 1urb n THR 148 Cb 0.63 1.32 0.07 0.00 -2.10 0.00 0.00 70.33 70.25 1urb n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1urb n ALA 149 N 0.42 0.56 -2.02 6.98 0.00 -1.26 -0.93 120.51 124.26 1urb n ALA 149 Ca 0.11 -1.47 -0.42 0.00 0.00 0.00 0.00 53.44 51.66 1urb n ALA 149 Cb 0.51 0.33 -0.03 0.00 0.00 0.00 0.00 19.45 20.26 1urb n ALA 149 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1urb s GLU 150 N -4.10 4.33 0.62 0.00 2.02 -1.26 -1.16 118.70 119.15 1urb s GLU 150 Ca 0.46 2.14 0.29 0.00 0.02 0.00 0.00 54.97 57.88 1urb s GLU 150 Cb -0.03 -3.19 1.59 0.00 0.10 0.00 0.00 34.13 32.60 1urb s GLU 150 CO 0.30 -0.38 1.96 -0.07 0.02 0.00 0.00 175.26 177.08 1urb h LEU 151 N 5.88 0.00 0.00 1.80 -0.00 -1.50 0.22 115.31 121.70 1urb h LEU 151 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.44 1urb h LEU 151 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.87 1urb h LEU 151 CO 0.82 0.00 -0.02 0.00 -0.00 0.00 0.00 178.44 179.24 1urb n GLN 152 N -3.43 0.09 -1.13 1.13 3.00 -1.26 -3.68 117.38 112.10 1urb n GLN 152 Ca 0.03 0.07 -0.33 0.00 -0.01 0.00 0.00 57.00 56.77 1urb n GLN 152 Cb 0.48 -1.61 0.12 0.00 0.00 0.00 0.00 30.24 29.24 1urb n GLN 152 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1urb s ASP 153 N -3.54 3.71 0.13 1.08 2.15 0.76 -4.63 116.67 116.33 1urb s ASP 153 Ca 0.13 2.26 -0.25 0.00 0.43 0.00 0.00 52.55 55.11 1urb s ASP 153 Cb 0.17 -2.58 -0.06 0.00 -0.30 0.00 0.00 42.92 40.15 1urb s ASP 153 CO 0.56 -2.58 1.44 0.00 -0.17 0.00 0.00 175.17 174.41 1urb n ALA 154 N -3.37 -0.53 0.05 3.66 0.00 -1.26 -1.38 120.51 117.68 1urb n ALA 154 Ca 0.13 0.70 -0.11 0.00 0.00 0.00 0.00 53.44 54.15 1urb n ALA 154 Cb 0.51 -0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 1urb n ALA 154 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1urb h THR 155 N 0.00 0.35 0.00 0.00 2.02 -1.92 0.57 112.91 113.94 1urb h THR 155 Ca 0.13 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.19 1urb h THR 155 Cb 0.34 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1urb h THR 155 CO -0.77 0.00 -0.58 1.55 0.37 0.00 0.00 175.52 176.08 1urb h PRO 156 N -0.43 0.00 -0.50 6.66 0.13 -1.80 -3.27 132.00 132.78 1urb h PRO 156 Ca 0.07 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.09 1urb h PRO 156 Cb 0.53 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1urb h PRO 156 CO -0.26 0.58 -0.11 0.00 -0.23 0.00 0.00 178.00 177.99 1urb h ALA 157 N 1.42 0.69 -0.66 -0.56 0.00 -0.80 -3.15 119.26 116.19 1urb h ALA 157 Ca -0.01 -0.34 0.19 0.00 0.00 0.00 0.00 54.91 54.75 1urb h ALA 157 Cb 1.13 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1urb h ALA 157 CO 0.08 0.60 0.59 0.00 0.00 0.00 0.00 179.25 180.51 1urb h ALA 158 N 0.90 2.49 0.00 0.00 0.00 -0.94 0.30 119.26 122.01 1urb h ALA 158 Ca 0.13 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1urb h ALA 158 Cb 0.67 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1urb h ALA 158 CO 0.05 -0.93 -0.56 -0.07 0.00 0.00 0.00 179.25 177.73 1urb h LEU 159 N 0.00 0.00 -0.67 0.00 3.38 -1.73 -3.37 115.31 112.92 1urb h LEU 159 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1urb h LEU 159 Cb 1.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.25 1urb h LEU 159 CO -0.00 0.56 0.00 1.33 0.09 0.00 0.00 178.44 180.42 1urb n VAL 160 N -3.39 0.00 -4.26 1.22 0.24 -0.29 -4.42 118.33 107.42 1urb n VAL 160 Ca 0.01 -0.39 -0.20 0.00 -2.04 0.00 0.00 64.34 61.72 1urb n VAL 160 Cb 0.69 1.20 -0.11 0.00 -1.47 0.00 0.00 33.84 34.14 1urb n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1urb s ALA 161 N -0.10 1.62 -0.29 2.33 0.00 0.91 -4.24 121.76 121.98 1urb s ALA 161 Ca 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.65 1urb s ALA 161 Cb 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 23.12 23.09 1urb s ALA 161 CO 0.00 0.18 0.09 -1.01 0.00 0.00 0.00 175.76 175.02 1urb s HIS 162 N -1.87 1.52 0.01 0.00 3.76 -1.25 -3.85 115.29 113.60 1urb s HIS 162 Ca 0.09 -1.57 -0.03 0.00 -0.15 0.00 0.00 55.06 53.41 1urb s HIS 162 Cb -0.06 -1.56 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1urb s HIS 162 CO 0.04 -0.84 0.03 0.14 -0.85 0.00 0.00 174.74 173.26 1urb s VAL 163 N 1.68 0.09 -0.41 -0.90 -7.23 -0.16 -4.95 120.40 108.53 1urb s VAL 163 Ca 0.08 -0.76 0.26 0.00 -1.81 0.00 0.00 61.98 59.75 1urb s VAL 163 Cb -0.17 -0.30 0.28 0.00 0.56 0.00 0.00 36.38 36.75 1urb s VAL 163 CO -0.24 -0.42 1.77 0.71 -0.31 0.00 0.00 175.10 176.61 1urb h THR 164 N 4.55 0.00 -3.07 5.32 1.35 -1.90 -1.39 112.91 117.77 1urb h THR 164 Ca -0.31 -0.33 -0.20 0.00 -0.55 0.00 0.00 66.41 65.02 1urb h THR 164 Cb 1.20 1.15 -0.30 0.00 -1.73 0.00 0.00 68.15 68.48 1urb h THR 164 CO 0.41 0.00 -0.50 -0.55 -0.25 0.00 0.00 175.52 174.63 1urb s SER 165 N -4.59 -0.24 0.58 5.36 0.15 -1.25 -4.31 113.70 109.39 1urb s SER 165 Ca 0.04 0.48 0.28 0.00 0.70 0.00 0.00 55.95 57.45 1urb s SER 165 Cb 0.09 0.38 1.58 0.00 -1.71 0.00 0.00 66.02 66.36 1urb s SER 165 CO 0.45 -0.15 2.06 0.08 1.20 0.00 0.00 173.24 176.87 1urb h ARG 166 N 7.07 0.00 0.00 5.44 0.11 -1.01 -1.78 114.38 124.21 1urb h ARG 166 Ca -0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.68 1urb h ARG 166 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1urb h ARG 166 CO 0.38 0.00 0.00 0.87 0.10 0.00 0.00 179.97 181.32 1urb h LYS 167 N 0.00 0.00 -4.09 0.08 1.57 -1.95 -3.38 116.57 108.80 1urb h LYS 167 Ca 0.12 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.27 1urb h LYS 167 Cb 0.64 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.97 1urb h LYS 167 CO -0.00 0.00 2.69 0.00 -0.57 0.00 0.00 179.45 181.57 1urb h TYR 169 N 6.93 -0.95 -4.00 0.00 -1.99 -1.88 -1.53 116.97 113.55 1urb h TYR 169 Ca 0.51 -0.02 -0.23 0.00 2.00 0.00 0.00 58.73 60.99 1urb h TYR 169 Cb 0.56 0.32 -0.05 0.00 2.00 0.00 0.00 36.73 39.56 1urb h TYR 169 CO 1.45 -0.59 -0.18 0.41 -0.00 0.00 0.00 178.16 179.25 1urb n GLY 170 N -0.82 3.86 0.39 3.88 0.00 -1.26 -1.09 105.19 110.15 1urb n GLY 170 Ca -0.13 -2.12 -0.10 0.00 0.00 0.00 0.00 46.02 43.68 1urb n GLY 170 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1urb h PRO 171 N 0.00 -0.32 0.06 1.61 0.11 -1.92 -0.96 132.00 130.58 1urb h PRO 171 Ca -0.14 0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.02 1urb h PRO 171 Cb 0.47 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.61 1urb h PRO 171 CO 0.22 -0.21 -0.31 0.66 -0.21 0.00 0.00 178.00 178.14 1urb h SER 172 N -0.33 -0.92 -0.56 -2.05 4.64 -1.97 -0.82 113.55 111.53 1urb h SER 172 Ca 0.14 0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.52 1urb h SER 172 Cb 0.58 0.36 -0.03 0.00 -0.31 0.00 0.00 62.40 63.01 1urb h SER 172 CO -0.56 -0.39 0.18 0.00 -0.87 0.00 0.00 176.83 175.19 1urb h ALA 173 N 0.19 1.19 -0.61 5.18 0.00 -1.87 -2.91 119.26 120.44 1urb h ALA 173 Ca 0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1urb h ALA 173 Cb 0.56 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1urb h ALA 173 CO -0.22 0.56 0.24 1.15 0.00 0.00 0.00 179.25 180.98 1urb h THR 174 N 0.88 1.23 -0.64 0.00 2.02 -0.72 0.79 112.91 116.47 1urb h THR 174 Ca 0.20 -0.73 0.12 0.00 0.77 0.00 0.00 66.41 66.77 1urb h THR 174 Cb 0.26 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 1urb h THR 174 CO -0.01 0.28 0.43 0.28 0.37 0.00 0.00 175.52 176.88 1urb h SER 175 N 0.85 0.32 0.00 4.18 0.02 -0.95 0.53 113.55 118.50 1urb h SER 175 Ca 0.20 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.09 1urb h SER 175 Cb 0.21 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1urb h SER 175 CO -0.02 0.18 -1.97 -1.84 -1.14 0.00 0.00 176.83 172.05 1urb n GLU 176 N -4.46 0.69 -0.07 3.45 0.28 -1.05 -4.19 120.64 115.29 1urb n GLU 176 Ca 0.11 -0.14 -0.07 0.00 -0.16 0.00 0.00 57.16 56.90 1urb n GLU 176 Cb 0.46 -1.46 -0.12 0.00 1.43 0.00 0.00 31.44 31.75 1urb n GLU 176 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1urb n LYS 177 N -2.29 1.55 -3.19 3.44 5.02 0.25 -4.69 118.16 118.25 1urb n LYS 177 Ca -0.10 -0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.94 1urb n LYS 177 Cb 0.64 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 34.21 1urb n LYS 177 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1urb h PRO 179 N 3.58 0.71 0.00 0.00 0.13 -1.70 0.11 132.00 134.83 1urb h PRO 179 Ca 0.14 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1urb h PRO 179 Cb 0.70 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 31.67 1urb h PRO 179 CO 0.71 0.47 -0.04 0.78 -0.23 0.00 0.00 178.00 179.69 1urb h GLY 180 N 0.73 0.00 0.15 1.56 0.00 -1.92 -2.73 103.07 100.86 1urb h GLY 180 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1urb h GLY 180 CO -0.30 0.00 -1.57 0.70 0.00 0.00 0.00 176.54 175.36 1urb n ASN 181 N -3.21 0.37 -4.62 0.19 4.13 0.28 -4.04 115.26 108.36 1urb n ASN 181 Ca -0.01 -0.23 -0.48 0.00 1.68 0.00 0.00 54.58 55.55 1urb n ASN 181 Cb 0.24 1.50 -0.04 0.00 -1.54 0.00 0.00 39.78 39.94 1urb n ASN 181 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1urb n ALA 182 N -2.03 0.03 -0.11 5.41 0.00 -0.49 0.69 120.51 124.01 1urb n ALA 182 Ca -0.01 0.45 -0.09 0.00 0.00 0.00 0.00 53.44 53.79 1urb n ALA 182 Cb 0.50 -2.14 -0.01 0.00 0.00 0.00 0.00 19.45 17.79 1urb n ALA 182 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1urb h LEU 183 N 4.01 0.42 -0.70 0.00 5.85 -1.88 0.39 115.31 123.41 1urb h LEU 183 Ca -0.44 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1urb h LEU 183 Cb 1.31 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1urb h LEU 183 CO 0.74 0.36 0.00 -1.84 -0.34 0.00 0.00 178.44 177.36 1urb n GLU 184 N -4.80 0.10 -0.67 1.25 0.00 -1.26 -1.14 120.64 114.12 1urb n GLU 184 Ca -0.01 0.49 0.01 0.00 0.00 0.00 0.00 57.16 57.65 1urb n GLU 184 Cb 0.06 -1.76 0.24 0.00 0.00 0.00 0.00 31.44 29.98 1urb n GLU 184 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1urb n LYS 185 N -1.96 2.61 -1.03 3.44 5.02 -0.73 -4.93 118.16 120.57 1urb n LYS 185 Ca 0.01 -3.00 -0.01 0.00 -2.02 0.00 0.00 58.31 53.29 1urb n LYS 185 Cb 0.10 -1.89 -0.00 0.00 -0.02 0.00 0.00 35.03 33.21 1urb n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1urb n GLY 186 N -0.72 0.47 3.93 0.72 0.00 -0.29 -4.90 105.19 104.40 1urb n GLY 186 Ca 0.29 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1urb n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1urb s GLY 187 N -2.21 1.73 0.13 -0.02 0.00 0.13 -4.96 107.32 102.12 1urb s GLY 187 Ca 0.00 -1.11 0.27 0.00 0.00 0.00 0.00 44.72 43.88 1urb s GLY 187 CO 0.00 -0.46 1.82 0.28 0.00 0.00 0.00 173.10 174.74 1urb n LYS 188 N -3.49 0.15 0.00 2.90 5.02 -0.98 -4.22 118.16 117.55 1urb n LYS 188 Ca 0.13 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 1urb n LYS 188 Cb 0.60 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1urb n LYS 188 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1urb n GLY 189 N 1.25 1.58 3.70 0.72 0.00 0.22 -4.57 105.19 108.09 1urb n GLY 189 Ca 0.06 -2.19 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1urb n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1urb s SER 190 N 0.00 2.06 0.09 1.61 1.04 -1.26 -4.67 113.70 112.56 1urb s SER 190 Ca 0.00 0.72 -0.25 0.00 0.48 0.00 0.00 55.95 56.90 1urb s SER 190 Cb 0.00 -1.06 -0.15 0.00 0.10 0.00 0.00 66.02 64.92 1urb s SER 190 CO 0.00 -3.43 1.71 0.40 0.98 0.00 0.00 173.24 172.90 1urb h ILE 191 N -2.11 0.82 -0.96 -1.02 2.04 -1.19 0.17 117.51 115.26 1urb h ILE 191 Ca -0.48 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.42 1urb h ILE 191 Cb 1.30 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 1urb h ILE 191 CO 0.44 0.00 0.63 0.74 0.00 0.00 0.00 178.15 179.96 1urb h THR 192 N -0.21 1.18 -0.25 -0.27 2.02 -1.36 0.51 112.91 114.53 1urb h THR 192 Ca -0.01 -0.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 1urb h THR 192 Cb 0.18 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.42 1urb h THR 192 CO 0.01 0.22 0.04 -0.33 0.37 0.00 0.00 175.52 175.83 1urb h GLU 193 N 1.23 0.42 -0.10 6.66 5.08 -1.69 -1.94 114.58 124.24 1urb h GLU 193 Ca 0.38 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1urb h GLU 193 Cb -0.02 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1urb h GLU 193 CO -0.11 0.55 -0.18 1.96 -1.00 0.00 0.00 179.01 180.22 1urb h GLN 194 N 0.23 0.16 -0.06 2.33 4.20 -0.11 -1.63 115.11 120.22 1urb h GLN 194 Ca 0.08 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1urb h GLN 194 Cb 0.33 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1urb h GLN 194 CO 0.01 0.35 0.03 1.25 -0.67 0.00 0.00 178.83 179.79 1urb h LEU 195 N 0.15 0.08 -1.57 1.46 6.46 -0.64 0.21 115.31 121.45 1urb h LEU 195 Ca 0.03 -0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 1urb h LEU 195 Cb 0.42 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.31 1urb h LEU 195 CO 0.03 0.17 0.26 -0.07 -0.62 0.00 0.00 178.44 178.21 1urb h LEU 196 N -0.01 0.48 -0.18 2.25 -0.00 -0.81 -2.63 115.31 114.42 1urb h LEU 196 Ca 0.02 -0.02 -0.10 0.00 -0.00 0.00 0.00 57.88 57.79 1urb h LEU 196 Cb 0.10 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 40.64 1urb h LEU 196 CO -0.00 0.36 -0.28 0.78 -0.00 0.00 0.00 178.44 179.30 1urb h ASN 197 N 0.56 0.55 -0.70 -0.43 2.35 -0.48 -3.21 115.58 114.22 1urb h ASN 197 Ca 0.15 -0.53 0.14 0.00 -0.55 0.00 0.00 56.30 55.52 1urb h ASN 197 Cb -0.04 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.12 1urb h ASN 197 CO -0.03 0.97 0.47 0.00 -1.65 0.00 0.00 177.43 177.19 1urb h ALA 198 N 0.60 2.14 -6.27 -0.83 0.00 -0.26 -3.47 119.26 111.16 1urb h ALA 198 Ca 0.02 -0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.51 1urb h ALA 198 Cb 0.86 -0.05 0.06 0.00 0.00 0.00 0.00 17.79 18.65 1urb h ALA 198 CO 0.06 -0.32 -0.87 -2.13 0.00 0.00 0.00 179.25 175.99 1urb n ARG 199 N -4.46 -1.17 -1.80 0.00 0.63 -1.13 -4.97 116.66 103.76 1urb n ARG 199 Ca 0.13 0.57 -0.32 0.00 -0.92 0.00 0.00 57.85 57.30 1urb n ARG 199 Cb 0.51 -3.89 0.04 0.00 0.45 0.00 0.00 32.46 29.56 1urb n ARG 199 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1urb s ALA 200 N -3.36 2.62 0.18 5.13 0.00 -1.26 -4.94 121.76 120.13 1urb s ALA 200 Ca 0.37 0.34 -0.09 0.00 0.00 0.00 0.00 51.96 52.58 1urb s ALA 200 Cb -0.14 -3.24 0.07 0.00 0.00 0.00 0.00 23.12 19.81 1urb s ALA 200 CO 0.87 -1.10 1.62 -0.44 0.00 0.00 0.00 175.76 176.71 1urb h ASP 201 N -0.07 1.03 -3.36 0.00 3.32 -1.66 -3.42 116.42 112.27 1urb h ASP 201 Ca -0.46 -0.32 -0.52 0.00 0.02 0.00 0.00 57.03 55.74 1urb h ASP 201 Cb 1.22 -0.28 -0.34 0.00 0.22 0.00 0.00 39.33 40.15 1urb h ASP 201 CO 0.56 1.12 -0.81 -0.69 -1.72 0.00 0.00 179.24 177.69 1urb s VAL 202 N -4.90 1.15 -0.08 -1.35 1.01 -0.84 0.10 120.40 115.49 1urb s VAL 202 Ca -0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 1urb s VAL 202 Cb 0.13 -1.07 0.04 0.00 0.00 0.00 0.00 36.38 35.48 1urb s VAL 202 CO 0.86 0.37 0.04 -0.89 0.00 0.00 0.00 175.10 175.48 1urb s THR 203 N 0.88 0.09 -0.01 3.92 2.01 -0.52 -0.61 115.64 121.39 1urb s THR 203 Ca -0.10 0.18 0.01 0.00 0.31 0.00 0.00 61.69 62.09 1urb s THR 203 Cb -0.15 -0.39 0.00 0.00 0.01 0.00 0.00 72.50 71.97 1urb s THR 203 CO 0.01 0.11 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.26 1urb s LEU 204 N 2.08 1.90 0.00 4.42 1.43 -0.44 -0.66 118.68 127.40 1urb s LEU 204 Ca 0.04 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1urb s LEU 204 Cb -0.13 -0.23 0.00 0.00 0.03 0.00 0.00 46.19 45.86 1urb s LEU 204 CO -0.05 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.17 1urb n GLY 205 N 3.13 -0.50 0.00 -3.19 0.00 -0.48 -1.18 105.19 102.96 1urb n GLY 205 Ca -0.15 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1urb n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1urb n GLY 206 N 0.00 2.04 1.24 -0.02 0.00 -0.31 -1.39 105.19 106.75 1urb n GLY 206 Ca 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1urb n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1urb n GLY 207 N 5.00 0.91 0.21 -0.02 0.00 -0.25 -1.35 105.19 109.68 1urb n GLY 207 Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 46.02 45.54 1urb n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1urb h ALA 208 N 0.00 1.11 -0.34 4.61 0.00 -0.73 -3.32 119.26 120.60 1urb h ALA 208 Ca 0.00 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.72 1urb h ALA 208 Cb 0.73 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 1urb h ALA 208 CO 0.00 0.36 -0.37 -0.22 0.00 0.00 0.00 179.25 179.02 1urb h LYS 209 N 0.00 -0.31 0.00 0.00 3.64 -1.64 -1.64 116.57 116.62 1urb h LYS 209 Ca -0.00 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1urb h LYS 209 Cb 0.71 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1urb h LYS 209 CO 0.04 -0.21 -0.07 1.15 -2.27 0.00 0.00 179.45 178.09 1urb h THR 210 N -0.32 0.75 0.00 1.00 2.02 -1.83 -1.64 112.91 112.88 1urb h THR 210 Ca 0.14 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1urb h THR 210 Cb 0.57 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1urb h THR 210 CO -0.51 0.07 0.00 0.49 0.37 0.00 0.00 175.52 175.94 1urb n PHE 211 N -4.02 0.03 0.31 3.16 3.01 -0.62 -1.45 117.46 117.89 1urb n PHE 211 Ca -0.03 0.01 0.13 0.00 1.01 0.00 0.00 57.45 58.57 1urb n PHE 211 Cb 0.16 -0.52 0.25 0.00 -0.01 0.00 0.00 39.48 39.36 1urb n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1urb h ALA 212 N 2.42 1.00 -2.28 4.37 0.00 -1.33 0.01 119.26 123.44 1urb h ALA 212 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 1urb h ALA 212 Cb 0.22 0.00 0.17 0.00 0.00 0.00 0.00 17.79 18.17 1urb h ALA 212 CO 0.00 0.00 0.23 -1.21 0.00 0.00 0.00 179.25 178.27 1urb s GLU 213 N -3.21 1.19 -0.05 0.00 2.02 -0.52 -4.66 118.70 113.46 1urb s GLU 213 Ca 0.07 1.18 0.01 0.00 0.02 0.00 0.00 54.97 56.26 1urb s GLU 213 Cb 0.07 -1.77 -0.03 0.00 0.10 0.00 0.00 34.13 32.49 1urb s GLU 213 CO 0.64 -2.39 -0.05 0.95 0.02 0.00 0.00 175.26 174.43 1urb s THR 214 N -2.77 3.83 0.21 3.63 -4.23 -1.26 -0.64 115.64 114.42 1urb s THR 214 Ca 0.65 -0.51 -0.31 0.00 -1.18 0.00 0.00 61.69 60.34 1urb s THR 214 Cb -0.20 -2.60 -0.10 0.00 1.34 0.00 0.00 72.50 70.94 1urb s THR 214 CO 0.58 0.54 1.48 0.00 -0.54 0.00 0.00 174.62 176.68 1urb s ALA 215 N -0.88 3.68 -0.20 3.99 0.00 -0.31 -4.83 121.76 123.21 1urb s ALA 215 Ca 0.14 1.33 0.18 0.00 0.00 0.00 0.00 51.96 53.61 1urb s ALA 215 Cb -0.11 -3.58 0.05 0.00 0.00 0.00 0.00 23.12 19.48 1urb s ALA 215 CO 0.03 -0.75 1.27 1.79 0.00 0.00 0.00 175.76 178.11 1urb h THR 216 N 3.75 0.54 -2.69 0.00 1.35 -1.92 0.21 112.91 114.15 1urb h THR 216 Ca -0.45 -1.83 -0.08 0.00 -0.55 0.00 0.00 66.41 63.51 1urb h THR 216 Cb 1.21 2.15 -0.02 0.00 -1.73 0.00 0.00 68.15 69.77 1urb h THR 216 CO 0.83 0.31 0.01 0.00 -0.25 0.00 0.00 175.52 176.42 1urb n ALA 217 N -2.24 -0.40 0.00 6.62 0.00 -1.26 -4.85 120.51 118.38 1urb n ALA 217 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1urb n ALA 217 Cb 0.71 0.51 0.00 0.00 0.00 0.00 0.00 19.45 20.67 1urb n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1urb n GLY 218 N -0.24 -2.22 0.36 0.00 0.00 -1.26 -3.67 105.19 98.15 1urb n GLY 218 Ca -0.01 -1.51 0.12 0.00 0.00 0.00 0.00 46.02 44.62 1urb n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1urb h GLU 219 N 0.00 0.51 -0.72 1.61 4.81 -2.01 -1.83 114.58 116.94 1urb h GLU 219 Ca 0.00 -0.03 -0.36 0.00 -0.13 0.00 0.00 59.36 58.84 1urb h GLU 219 Cb 0.00 -0.12 -0.21 0.00 0.63 0.00 0.00 28.75 29.05 1urb h GLU 219 CO 0.00 0.34 0.34 0.91 -0.73 0.00 0.00 179.01 179.87 1urb n TRP 220 N -4.49 2.25 -1.66 0.92 8.01 -1.26 -5.01 117.44 116.21 1urb n TRP 220 Ca 0.12 -1.69 -0.43 0.00 -1.31 0.00 0.00 57.50 54.19 1urb n TRP 220 Cb 0.40 -0.75 -0.01 0.00 -2.01 0.00 0.00 31.31 28.94 1urb n TRP 220 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 1urb n GLN 221 N -1.05 1.84 0.00 -0.99 7.27 -0.69 -1.56 117.38 122.20 1urb n GLN 221 Ca 0.48 0.65 0.00 0.00 0.07 0.00 0.00 57.00 58.19 1urb n GLN 221 Cb 1.40 -2.16 0.00 0.00 2.41 0.00 0.00 30.24 31.90 1urb n GLN 221 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1urb n GLY 222 N 1.04 2.85 3.84 1.69 0.00 0.06 -4.91 105.19 109.76 1urb n GLY 222 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1urb n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1urb s LYS 223 N -0.12 4.03 0.71 1.61 1.02 -0.60 -4.74 119.74 121.65 1urb s LYS 223 Ca 0.00 0.60 -0.13 0.00 0.02 0.00 0.00 55.97 56.45 1urb s LYS 223 Cb 0.00 -2.77 0.03 0.00 -0.52 0.00 0.00 37.83 34.57 1urb s LYS 223 CO 0.00 0.36 1.11 0.95 -0.92 0.00 0.00 175.35 176.86 1urb s THR 224 N -1.65 3.13 0.50 2.17 -4.23 -1.26 -1.17 115.64 113.15 1urb s THR 224 Ca 0.44 0.47 0.19 0.00 -1.18 0.00 0.00 61.69 61.61 1urb s THR 224 Cb -0.14 -2.97 0.26 0.00 1.34 0.00 0.00 72.50 71.00 1urb s THR 224 CO 0.20 -0.38 2.12 -0.07 -0.54 0.00 0.00 174.62 175.95 1urb h LEU 225 N -0.41 0.00 -0.22 4.79 3.38 -0.16 -1.01 115.31 121.67 1urb h LEU 225 Ca -0.46 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 1urb h LEU 225 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1urb h LEU 225 CO 0.52 0.06 -0.00 -0.09 0.09 0.00 0.00 178.44 179.02 1urb h ARG 226 N 0.00 0.39 -0.77 1.13 2.43 -1.29 -0.85 114.38 115.43 1urb h ARG 226 Ca -0.00 -0.13 0.03 0.00 -0.81 0.00 0.00 59.98 59.08 1urb h ARG 226 Cb 0.12 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 1urb h ARG 226 CO 0.01 0.58 0.48 0.93 -1.51 0.00 0.00 179.97 180.47 1urb h GLU 227 N 0.16 0.91 -0.58 0.20 5.08 -1.52 -0.31 114.58 118.52 1urb h GLU 227 Ca 0.06 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1urb h GLU 227 Cb 0.41 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1urb h GLU 227 CO 0.01 0.60 0.37 0.37 -1.00 0.00 0.00 179.01 179.36 1urb h GLN 228 N 0.94 0.72 -0.15 2.33 4.15 -1.05 0.12 115.11 122.17 1urb h GLN 228 Ca 0.31 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.71 1urb h GLN 228 Cb 0.02 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.52 1urb h GLN 228 CO -0.12 0.48 -0.03 0.00 -1.93 0.00 0.00 178.83 177.23 1urb h ALA 229 N 1.23 0.11 -0.18 3.38 0.00 -0.01 0.15 119.26 123.94 1urb h ALA 229 Ca 0.22 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1urb h ALA 229 Cb -0.04 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1urb h ALA 229 CO -0.07 -0.47 0.11 1.96 0.00 0.00 0.00 179.25 180.77 1urb h GLN 230 N 0.01 0.22 0.00 0.00 4.20 -0.73 -1.28 115.11 117.52 1urb h GLN 230 Ca 0.07 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1urb h GLN 230 Cb 0.11 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1urb h GLN 230 CO -0.15 0.14 -0.11 0.00 -0.67 0.00 0.00 178.83 178.05 1urb h ALA 231 N 1.08 1.53 -0.25 3.87 0.00 -0.32 -0.96 119.26 124.21 1urb h ALA 231 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1urb h ALA 231 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1urb h ALA 231 CO -0.03 0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.89 1urb n ARG 232 N -3.99 1.70 -0.50 0.00 1.74 0.50 -4.91 116.66 111.20 1urb n ARG 232 Ca -0.02 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.97 1urb n ARG 232 Cb 0.19 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1urb n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1urb n GLY 233 N 1.05 0.73 3.78 -0.13 0.00 -0.36 -4.99 105.19 105.26 1urb n GLY 233 Ca 0.13 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1urb n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1urb s TYR 234 N -2.00 3.32 -0.42 1.61 1.51 -0.54 -4.02 117.35 116.81 1urb s TYR 234 Ca 0.00 1.66 -0.20 0.00 -1.01 0.00 0.00 57.07 57.52 1urb s TYR 234 Cb 0.00 -3.12 0.02 0.00 -0.11 0.00 0.00 41.96 38.75 1urb s TYR 234 CO 0.00 -0.56 0.58 -0.65 -1.11 0.00 0.00 175.55 173.81 1urb s GLN 235 N -2.40 3.30 -0.18 -0.62 -0.21 0.74 -4.59 119.66 115.70 1urb s GLN 235 Ca 0.56 -0.41 -0.18 0.00 0.02 0.00 0.00 55.36 55.35 1urb s GLN 235 Cb -0.22 -3.93 -0.04 0.00 1.00 0.00 0.00 33.01 29.82 1urb s GLN 235 CO 0.28 -0.91 0.49 -0.51 -2.12 0.00 0.00 175.29 172.52 1urb s LEU 236 N 2.61 4.17 0.00 2.90 1.02 -1.26 -0.61 118.68 127.51 1urb s LEU 236 Ca 0.20 0.67 0.07 0.00 0.02 0.00 0.00 54.13 55.09 1urb s LEU 236 Cb -0.15 -2.67 -0.02 0.00 0.02 0.00 0.00 46.19 43.37 1urb s LEU 236 CO 0.17 -0.13 -0.22 -0.69 0.02 0.00 0.00 176.35 175.50 1urb s VAL 237 N 1.39 1.74 0.00 -1.59 1.01 -0.29 -4.99 120.40 117.66 1urb s VAL 237 Ca 0.24 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1urb s VAL 237 Cb -0.15 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1urb s VAL 237 CO 0.09 0.42 0.69 -1.54 0.00 0.00 0.00 175.10 174.76 1urb n SER 238 N 2.33 0.75 -3.79 3.32 3.41 -1.26 -0.68 113.62 117.71 1urb n SER 238 Ca -0.16 -1.38 -0.08 0.00 -0.26 0.00 0.00 58.87 56.99 1urb n SER 238 Cb 0.53 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 1urb n SER 238 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1urb s ASP 239 N -0.38 -0.30 0.21 4.04 1.47 -1.26 -4.57 116.67 115.88 1urb s ASP 239 Ca 0.00 -0.53 -0.10 0.00 1.18 0.00 0.00 52.55 53.11 1urb s ASP 239 Cb 0.00 0.68 0.22 0.00 -0.34 0.00 0.00 42.92 43.48 1urb s ASP 239 CO 0.00 -1.24 1.82 0.00 0.68 0.00 0.00 175.17 176.43 1urb h ALA 240 N 2.04 0.88 0.04 2.11 0.00 -1.27 -0.94 119.26 122.12 1urb h ALA 240 Ca -0.23 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.70 1urb h ALA 240 Cb 1.26 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1urb h ALA 240 CO 0.28 0.08 -0.14 0.00 0.00 0.00 0.00 179.25 179.47 1urb h ALA 241 N 1.33 -0.20 -0.86 0.00 0.00 -1.91 0.62 119.26 118.25 1urb h ALA 241 Ca 0.29 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.22 1urb h ALA 241 Cb 0.14 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1urb h ALA 241 CO -0.16 -0.65 0.55 0.77 0.00 0.00 0.00 179.25 179.77 1urb h SER 242 N -0.26 0.93 -0.48 0.00 0.02 -1.88 -2.17 113.55 109.71 1urb h SER 242 Ca 0.03 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1urb h SER 242 Cb 0.30 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 1urb h SER 242 CO -0.11 0.64 0.31 0.25 -1.14 0.00 0.00 176.83 176.78 1urb h LEU 243 N 1.09 0.55 -1.76 5.07 5.85 -0.23 -2.25 115.31 123.63 1urb h LEU 243 Ca 0.34 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 1urb h LEU 243 Cb -0.02 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 1urb h LEU 243 CO -0.11 0.42 -0.16 0.78 -0.34 0.00 0.00 178.44 179.03 1urb h ASN 244 N 0.64 0.00 1.07 1.25 2.35 -0.39 -2.60 115.58 117.90 1urb h ASN 244 Ca 0.17 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1urb h ASN 244 Cb -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 1urb h ASN 244 CO -0.04 0.16 -0.12 0.28 -1.65 0.00 0.00 177.43 176.06 1urb h SER 245 N 0.00 0.00 -2.62 5.81 0.02 -0.80 -3.44 113.55 112.51 1urb h SER 245 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1urb h SER 245 Cb 0.34 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.91 1urb h SER 245 CO 0.02 0.12 1.04 -0.69 -1.14 0.00 0.00 176.83 176.19 1urb s VAL 246 N -3.60 2.76 -0.19 2.27 1.01 -0.98 -4.88 120.40 116.79 1urb s VAL 246 Ca 0.01 0.28 0.11 0.00 0.00 0.00 0.00 61.98 62.38 1urb s VAL 246 Cb 0.09 -3.18 -0.23 0.00 0.00 0.00 0.00 36.38 33.07 1urb s VAL 246 CO 0.61 0.00 0.09 0.35 0.00 0.00 0.00 175.10 176.14 1urb n THR 247 N 4.67 1.48 -3.85 3.92 -2.24 -1.26 -5.00 114.28 112.00 1urb n THR 247 Ca 0.17 -0.75 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 1urb n THR 247 Cb 0.39 -0.91 -0.09 0.00 -2.10 0.00 0.00 70.33 67.62 1urb n THR 247 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1urb s GLU 248 N -2.52 0.60 -0.12 -0.78 -1.05 -1.26 -4.95 118.70 108.62 1urb s GLU 248 Ca -0.17 -0.47 -0.05 0.00 -0.15 0.00 0.00 54.97 54.13 1urb s GLU 248 Cb 0.07 0.25 0.06 0.00 -0.44 0.00 0.00 34.13 34.07 1urb s GLU 248 CO 0.76 -0.16 0.25 0.00 0.95 0.00 0.00 175.26 177.06 1urb s ALA 249 N -1.87 -0.52 0.22 -0.84 0.00 -1.26 -4.92 121.76 112.57 1urb s ALA 249 Ca -0.11 0.93 -0.06 0.00 0.00 0.00 0.00 51.96 52.72 1urb s ALA 249 Cb -0.04 -0.87 0.03 0.00 0.00 0.00 0.00 23.12 22.23 1urb s ALA 249 CO -0.00 -0.48 0.41 0.27 0.00 0.00 0.00 175.76 175.96 1urb n ASN 250 N 4.96 -1.18 0.19 0.00 0.23 -1.03 -4.84 115.26 113.59 1urb n ASN 250 Ca -0.13 -1.98 0.11 0.00 -0.53 0.00 0.00 54.58 52.05 1urb n ASN 250 Cb 0.51 2.01 0.64 0.00 -2.08 0.00 0.00 39.78 40.86 1urb n ASN 250 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1urb h GLN 251 N 0.00 0.02 -0.19 -3.83 1.08 -1.93 0.24 115.11 110.50 1urb h GLN 251 Ca -0.18 -0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 56.81 1urb h GLN 251 Cb 0.71 -0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.14 1urb h GLN 251 CO 0.24 0.01 -0.69 1.96 -0.95 0.00 0.00 178.83 179.40 1urb h GLN 252 N 0.02 0.78 -2.11 1.46 7.50 -1.96 -3.39 115.11 117.41 1urb h GLN 252 Ca 0.06 -0.58 -0.53 0.00 0.50 0.00 0.00 58.65 58.10 1urb h GLN 252 Cb 0.22 0.10 -0.35 0.00 0.05 0.00 0.00 27.48 27.51 1urb h GLN 252 CO -0.00 1.20 -0.93 0.36 -1.50 0.00 0.00 178.83 177.96 1urb n LYS 253 N -3.95 0.29 -2.03 1.46 2.85 -0.71 -4.88 118.16 111.19 1urb n LYS 253 Ca -0.06 -3.01 -0.37 0.00 -1.05 0.00 0.00 58.31 53.82 1urb n LYS 253 Cb 0.70 -1.59 0.02 0.00 -0.65 0.00 0.00 35.03 33.51 1urb n LYS 253 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1urb s PRO 254 N 0.03 3.26 -0.15 -1.58 0.04 0.77 -2.48 135.00 134.89 1urb s PRO 254 Ca 0.33 1.91 -0.16 0.00 0.04 0.00 0.00 61.00 63.13 1urb s PRO 254 Cb 0.05 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1urb s PRO 254 CO -0.17 -1.00 0.37 -1.17 0.04 0.00 0.00 177.00 175.07 1urb s LEU 255 N -3.61 4.24 -0.24 -3.56 2.96 0.12 -0.19 118.68 118.39 1urb s LEU 255 Ca 0.72 0.61 0.00 0.00 -0.22 0.00 0.00 54.13 55.24 1urb s LEU 255 Cb -0.32 -2.50 0.07 0.00 0.50 0.00 0.00 46.19 43.93 1urb s LEU 255 CO 0.37 0.04 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.21 1urb s LEU 256 N 0.63 2.48 -0.35 -0.68 2.96 0.22 -1.44 118.68 122.49 1urb s LEU 256 Ca 0.20 -1.25 -0.11 0.00 -0.22 0.00 0.00 54.13 52.76 1urb s LEU 256 Cb -0.14 -1.08 0.02 0.00 0.50 0.00 0.00 46.19 45.48 1urb s LEU 256 CO 0.07 -0.28 0.19 -0.83 -1.32 0.00 0.00 176.35 174.18 1urb s GLY 257 N 1.46 1.91 -0.54 7.98 0.00 0.16 -1.14 107.32 117.15 1urb s GLY 257 Ca -0.02 -1.60 -0.03 0.00 0.00 0.00 0.00 44.72 43.06 1urb s GLY 257 CO -0.09 0.79 0.35 1.08 0.00 0.00 0.00 173.10 175.24 1urb s LEU 258 N 1.58 5.29 0.00 0.66 1.43 0.14 -1.39 118.68 126.40 1urb s LEU 258 Ca 0.03 -2.48 0.25 0.00 -1.03 0.00 0.00 54.13 50.90 1urb s LEU 258 Cb -0.18 -1.86 0.98 0.00 0.03 0.00 0.00 46.19 45.16 1urb s LEU 258 CO 0.07 -0.46 1.69 0.49 0.23 0.00 0.00 176.35 178.37 1urb n PHE 259 N 4.00 0.08 -3.54 0.29 3.72 -0.49 -4.38 117.46 117.13 1urb n PHE 259 Ca 0.03 -0.04 -0.10 0.00 -0.05 0.00 0.00 57.45 57.29 1urb n PHE 259 Cb 0.39 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.90 1urb n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1urb s ALA 260 N -1.92 -1.88 0.17 4.37 0.00 -1.26 -4.95 121.76 116.29 1urb s ALA 260 Ca 0.36 1.33 -0.11 0.00 0.00 0.00 0.00 51.96 53.54 1urb s ALA 260 Cb 0.19 -0.18 0.07 0.00 0.00 0.00 0.00 23.12 23.21 1urb s ALA 260 CO 0.31 -0.48 1.70 -0.44 0.00 0.00 0.00 175.76 176.84 1urb h ASP 261 N 2.34 0.89 0.00 0.00 3.32 -1.94 -0.97 116.42 120.06 1urb h ASP 261 Ca -0.20 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1urb h ASP 261 Cb 1.19 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1urb h ASP 261 CO 0.31 0.87 0.00 0.61 -1.72 0.00 0.00 179.24 179.31 1urb n GLY 262 N -0.69 1.94 3.77 2.75 0.00 -1.26 -1.95 105.19 109.74 1urb n GLY 262 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1urb n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1urb s ASN 263 N 0.91 6.94 0.61 1.61 0.01 -1.26 -1.10 114.94 122.67 1urb s ASN 263 Ca 0.00 2.18 -0.17 0.00 -0.71 0.00 0.00 52.86 54.16 1urb s ASN 263 Cb 0.00 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 1urb s ASN 263 CO 0.00 -0.37 1.15 -0.04 -1.51 0.00 0.00 177.10 176.33 1urb s MET 264 N -2.01 2.96 0.42 -0.60 -1.94 -0.11 -4.93 119.30 113.08 1urb s MET 264 Ca 0.52 1.59 -0.25 0.00 -1.71 0.00 0.00 55.69 55.84 1urb s MET 264 Cb -0.28 -1.95 -0.10 0.00 2.01 0.00 0.00 34.83 34.51 1urb s MET 264 CO 0.35 -1.16 1.06 -0.35 -0.01 0.00 0.00 175.02 174.91 1urb n PRO 265 N -1.90 1.46 -2.51 2.03 -0.04 -1.26 -4.95 135.00 127.83 1urb n PRO 265 Ca 0.12 0.52 -0.36 0.00 -0.04 0.00 0.00 63.50 63.74 1urb n PRO 265 Cb 0.51 -2.10 -0.04 0.00 -0.04 0.00 0.00 33.50 31.83 1urb n PRO 265 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1urb s VAL 266 N -1.25 3.65 0.09 0.52 1.01 -1.26 -4.99 120.40 118.16 1urb s VAL 266 Ca 0.63 1.22 -0.15 0.00 0.00 0.00 0.00 61.98 63.68 1urb s VAL 266 Cb -0.55 -3.61 -0.13 0.00 0.00 0.00 0.00 36.38 32.09 1urb s VAL 266 CO 0.57 -0.03 1.34 -0.09 0.00 0.00 0.00 175.10 176.89 1urb h ARG 267 N 2.30 0.69 -6.50 2.72 2.43 -1.88 -3.43 114.38 110.70 1urb h ARG 267 Ca -0.49 -0.46 -0.65 0.00 -0.81 0.00 0.00 59.98 57.58 1urb h ARG 267 Cb 1.22 0.06 -0.25 0.00 -0.42 0.00 0.00 29.97 30.58 1urb h ARG 267 CO 0.61 1.08 -0.86 -1.58 -1.51 0.00 0.00 179.97 177.71 1urb s TRP 268 N -4.03 2.11 0.16 2.20 0.51 -1.26 -1.11 118.94 117.52 1urb s TRP 268 Ca -0.12 -0.40 0.07 0.00 -2.12 0.00 0.00 56.10 53.53 1urb s TRP 268 Cb 0.08 -1.24 -0.04 0.00 -0.81 0.00 0.00 33.47 31.46 1urb s TRP 268 CO 0.85 0.15 -0.01 -0.51 -0.51 0.00 0.00 176.95 176.92 1urb s LEU 269 N -1.38 3.30 -0.18 2.99 1.43 0.11 -3.91 118.68 121.04 1urb s LEU 269 Ca 0.10 -0.37 -0.35 0.00 -1.03 0.00 0.00 54.13 52.49 1urb s LEU 269 Cb -0.10 -1.98 0.14 0.00 0.03 0.00 0.00 46.19 44.28 1urb s LEU 269 CO 0.03 0.11 1.19 -0.83 0.23 0.00 0.00 176.35 177.08 1urb s GLY 270 N -2.79 -0.30 0.85 -3.19 0.00 -1.26 -1.88 107.32 98.75 1urb s GLY 270 Ca 0.27 1.60 -0.11 0.00 0.00 0.00 0.00 44.72 46.47 1urb s GLY 270 CO 0.18 0.54 1.09 2.56 0.00 0.00 0.00 173.10 177.47 1urb s PRO 271 N -2.42 1.65 0.36 2.90 0.04 -1.26 -4.89 135.00 131.38 1urb s PRO 271 Ca 0.09 1.00 -0.25 0.00 0.04 0.00 0.00 61.00 61.88 1urb s PRO 271 Cb -0.01 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.59 1urb s PRO 271 CO -0.05 -2.02 0.97 0.21 0.04 0.00 0.00 177.00 176.15 1urb s LYS 272 N -4.91 4.44 0.34 4.56 2.20 -1.26 -4.60 119.74 120.51 1urb s LYS 272 Ca 0.63 1.34 -0.29 0.00 -0.36 0.00 0.00 55.97 57.29 1urb s LYS 272 Cb -0.18 -2.64 -0.11 0.00 -1.51 0.00 0.00 37.83 33.39 1urb s LYS 272 CO 0.57 0.14 1.41 0.00 -0.36 0.00 0.00 175.35 177.10 1urb s ALA 273 N -1.72 3.55 0.23 3.13 0.00 0.12 -5.01 121.76 122.06 1urb s ALA 273 Ca 0.54 1.42 0.09 0.00 0.00 0.00 0.00 51.96 54.00 1urb s ALA 273 Cb -0.18 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 1urb s ALA 273 CO 0.23 -0.84 -0.15 0.95 0.00 0.00 0.00 175.76 175.94 1urb s THR 274 N -1.01 1.92 0.01 0.00 -4.23 -0.85 -4.63 115.64 106.84 1urb s THR 274 Ca 0.52 -2.26 -0.31 0.00 -1.18 0.00 0.00 61.69 58.46 1urb s THR 274 Cb -0.43 -2.14 -0.10 0.00 1.34 0.00 0.00 72.50 71.17 1urb s THR 274 CO 0.57 -0.52 1.94 0.00 -0.54 0.00 0.00 174.62 176.06 1urb n TYR 275 N -0.46 2.47 -2.08 3.99 9.36 -1.26 -0.60 117.16 128.57 1urb n TYR 275 Ca -0.07 -0.26 -0.17 0.00 3.32 0.00 0.00 57.90 60.72 1urb n TYR 275 Cb 0.60 -2.76 -0.03 0.00 -0.63 0.00 0.00 39.34 36.53 1urb n TYR 275 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1urb n HIS 276 N 7.16 -0.57 0.20 2.98 8.25 -1.26 -4.91 115.22 127.07 1urb n HIS 276 Ca 0.21 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.73 1urb n HIS 276 Cb 0.37 -3.28 0.54 0.00 1.12 0.00 0.00 29.99 28.75 1urb n HIS 276 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1urb h GLY 277 N 0.00 0.10 2.00 -1.41 0.00 -0.93 0.51 103.07 103.33 1urb h GLY 277 Ca -0.39 -0.04 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1urb h GLY 277 CO 0.49 0.04 -0.14 3.45 0.00 0.00 0.00 176.54 180.38 1urb h ASN 278 N 0.09 0.00 0.00 0.19 -1.07 -1.81 -2.29 115.58 110.69 1urb h ASN 278 Ca 0.02 0.00 -0.13 0.00 0.07 0.00 0.00 56.30 56.26 1urb h ASN 278 Cb 0.14 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.37 1urb h ASN 278 CO 0.01 0.14 -0.98 -0.38 0.07 0.00 0.00 177.43 176.29 1urb n ILE 279 N -3.21 1.48 0.16 6.14 2.08 -0.48 -4.58 119.36 120.95 1urb n ILE 279 Ca 0.01 0.07 0.09 0.00 0.56 0.00 0.00 62.75 63.49 1urb n ILE 279 Cb 0.46 -2.21 0.08 0.00 -0.75 0.00 0.00 39.64 37.23 1urb n ILE 279 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1urb h ASP 280 N -1.00 0.00 -3.11 4.38 3.32 -1.09 -3.47 116.42 115.45 1urb h ASP 280 Ca -0.20 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.22 1urb h ASP 280 Cb 0.95 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.35 1urb h ASP 280 CO -0.12 0.14 -0.75 -0.54 -1.72 0.00 0.00 179.24 176.26 1urb s LYS 281 N -3.18 1.96 1.03 3.56 1.02 -0.86 -5.05 119.74 118.22 1urb s LYS 281 Ca 0.04 -1.29 -0.13 0.00 0.02 0.00 0.00 55.97 54.61 1urb s LYS 281 Cb 0.07 -2.11 0.20 0.00 -0.52 0.00 0.00 37.83 35.47 1urb s LYS 281 CO 0.72 0.44 1.09 -1.25 -0.92 0.00 0.00 175.35 175.43 1urb s PRO 282 N -2.72 0.18 0.32 -1.68 0.04 -1.26 -4.60 135.00 125.28 1urb s PRO 282 Ca 0.23 0.45 -0.28 0.00 0.04 0.00 0.00 61.00 61.44 1urb s PRO 282 Cb -0.09 -1.71 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 1urb s PRO 282 CO 0.14 -2.88 1.17 0.00 0.04 0.00 0.00 177.00 175.46 1urb s ALA 283 N -2.96 3.38 0.05 8.56 0.00 -1.26 -4.67 121.76 124.85 1urb s ALA 283 Ca 0.66 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.60 1urb s ALA 283 Cb -0.18 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1urb s ALA 283 CO 0.58 -0.36 0.24 0.08 0.00 0.00 0.00 175.76 176.29 1urb s VAL 284 N -1.22 5.36 -0.14 0.00 1.01 0.36 -4.82 120.40 120.95 1urb s VAL 284 Ca 0.48 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.27 1urb s VAL 284 Cb -0.34 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1urb s VAL 284 CO 0.44 0.20 -0.14 -0.89 0.00 0.00 0.00 175.10 174.70 1urb s THR 285 N -1.46 1.53 0.58 3.92 2.01 -1.26 -0.94 115.64 120.01 1urb s THR 285 Ca 0.33 -0.61 -0.19 0.00 0.31 0.00 0.00 61.69 61.52 1urb s THR 285 Cb -0.13 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.91 1urb s THR 285 CO 0.24 0.45 1.23 0.00 -0.69 0.00 0.00 174.62 175.85 1urb s THR 287 N -1.54 1.64 0.34 0.00 -1.32 -0.79 -4.97 115.64 109.00 1urb s THR 287 Ca 0.76 -0.97 -0.29 0.00 -1.21 0.00 0.00 61.69 59.98 1urb s THR 287 Cb -0.32 -1.38 -0.12 0.00 -1.51 0.00 0.00 72.50 69.17 1urb s THR 287 CO 0.35 0.39 1.47 -2.65 -2.21 0.00 0.00 174.62 171.97 1urb n PRO 288 N 2.37 2.52 -2.26 7.08 -0.02 -1.26 0.08 135.00 143.51 1urb n PRO 288 Ca -0.16 0.89 -0.43 0.00 -2.02 0.00 0.00 63.50 61.78 1urb n PRO 288 Cb 0.53 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.39 1urb n PRO 288 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1urb s ASN 289 N 0.03 6.57 0.41 2.55 2.47 -0.27 -4.68 114.94 122.02 1urb s ASN 289 Ca 0.58 1.51 0.20 0.00 0.42 0.00 0.00 52.86 55.56 1urb s ASN 289 Cb -0.51 -2.54 0.85 0.00 -1.45 0.00 0.00 41.25 37.60 1urb s ASN 289 CO 0.58 -1.11 1.82 1.55 -3.72 0.00 0.00 177.10 176.23 1urb h PRO 290 N 9.81 0.00 -0.89 0.43 0.13 -1.90 -3.31 132.00 136.27 1urb h PRO 290 Ca -0.30 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.74 1urb h PRO 290 Cb 1.13 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.20 1urb h PRO 290 CO 1.01 0.32 0.12 1.04 -0.23 0.00 0.00 178.00 180.25 1urb n GLN 291 N -3.65 2.25 0.01 0.86 6.02 -1.26 -4.49 117.38 117.11 1urb n GLN 291 Ca -0.01 -1.36 0.11 0.00 -0.01 0.00 0.00 57.00 55.74 1urb n GLN 291 Cb 0.43 -1.71 0.07 0.00 1.02 0.00 0.00 30.24 30.06 1urb n GLN 291 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1urb n ARG 292 N 0.07 0.11 -1.84 -1.09 1.85 -1.25 -4.93 116.66 109.59 1urb n ARG 292 Ca 0.18 -0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.03 1urb n ARG 292 Cb 0.81 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 30.68 1urb n ARG 292 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1urb n ASN 293 N -1.67 -9.40 0.06 2.89 3.02 -1.26 -4.20 115.26 104.70 1urb n ASN 293 Ca 0.04 1.37 0.09 0.00 -0.03 0.00 0.00 54.58 56.05 1urb n ASN 293 Cb 0.37 -5.28 0.38 0.00 -0.61 0.00 0.00 39.78 34.65 1urb n ASN 293 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1urb n ASP 294 N -0.15 0.29 -0.15 6.41 2.03 -1.26 -2.93 116.55 120.79 1urb n ASP 294 Ca 0.00 0.58 0.11 0.00 0.52 0.00 0.00 54.79 56.00 1urb n ASP 294 Cb 0.00 -0.64 0.13 0.00 -0.72 0.00 0.00 41.12 39.89 1urb n ASP 294 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1urb n SER 295 N -1.83 1.06 -4.51 1.67 3.41 -1.26 -4.82 113.62 107.34 1urb n SER 295 Ca 0.03 -0.85 -0.37 0.00 -0.26 0.00 0.00 58.87 57.41 1urb n SER 295 Cb 0.18 0.48 -0.12 0.00 -0.26 0.00 0.00 64.21 64.49 1urb n SER 295 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1urb s VAL 296 N -2.79 4.76 0.59 -3.33 1.01 -1.15 -0.76 120.40 118.74 1urb s VAL 296 Ca 0.15 -0.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 1urb s VAL 296 Cb 0.18 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 1urb s VAL 296 CO 0.68 0.30 1.19 -2.16 0.00 0.00 0.00 175.10 175.11 1urb s PRO 297 N 1.64 3.01 0.60 2.72 0.04 -1.26 -4.81 135.00 136.93 1urb s PRO 297 Ca 0.07 1.76 -0.03 0.00 0.04 0.00 0.00 61.00 62.84 1urb s PRO 297 Cb -0.15 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.48 1urb s PRO 297 CO 0.07 -1.16 0.86 0.95 0.04 0.00 0.00 177.00 177.76 1urb s THR 298 N -1.68 2.90 0.34 1.26 -4.23 -1.26 -4.89 115.64 108.08 1urb s THR 298 Ca 0.76 -0.38 0.04 0.00 -1.18 0.00 0.00 61.69 60.93 1urb s THR 298 Cb -0.29 -3.15 0.29 0.00 1.34 0.00 0.00 72.50 70.69 1urb s THR 298 CO 0.33 -0.13 1.95 0.25 -0.54 0.00 0.00 174.62 176.47 1urb h LEU 299 N -0.16 0.74 -0.72 4.79 5.85 -1.95 -0.53 115.31 123.33 1urb h LEU 299 Ca -0.44 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.21 1urb h LEU 299 Cb 1.29 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 1urb h LEU 299 CO 0.57 0.48 0.14 0.00 -0.34 0.00 0.00 178.44 179.29 1urb h ALA 300 N 1.58 0.95 -0.24 1.25 0.00 -1.91 0.12 119.26 121.00 1urb h ALA 300 Ca 0.33 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1urb h ALA 300 Cb 0.21 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1urb h ALA 300 CO -0.11 0.67 -0.18 1.96 0.00 0.00 0.00 179.25 181.58 1urb h GLN 301 N 1.05 0.55 -0.78 0.00 4.20 -1.68 -0.92 115.11 117.53 1urb h GLN 301 Ca 0.21 -0.27 0.01 0.00 0.06 0.00 0.00 58.65 58.66 1urb h GLN 301 Cb 0.41 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 1urb h GLN 301 CO 0.01 0.85 0.52 0.52 -0.67 0.00 0.00 178.83 180.05 1urb h MET 302 N 0.26 1.03 -0.02 1.46 2.86 -0.92 -0.26 114.93 119.34 1urb h MET 302 Ca 0.05 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1urb h MET 302 Cb 0.72 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1urb h MET 302 CO 0.05 0.68 0.01 1.15 1.06 0.00 0.00 176.91 179.86 1urb h THR 303 N 1.06 1.09 -0.56 2.22 2.02 -0.67 -0.18 112.91 117.89 1urb h THR 303 Ca 0.29 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1urb h THR 303 Cb -0.12 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1urb h THR 303 CO -0.06 0.07 0.37 -0.78 0.37 0.00 0.00 175.52 175.49 1urb h ASP 304 N -0.07 0.64 -0.17 4.18 3.58 -0.86 0.56 116.42 124.28 1urb h ASP 304 Ca 0.01 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1urb h ASP 304 Cb 0.11 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 1urb h ASP 304 CO -0.00 0.47 0.05 0.50 -2.88 0.00 0.00 179.24 177.38 1urb h LYS 305 N 0.76 0.25 -0.53 0.28 1.63 -0.93 -1.02 116.57 117.01 1urb h LYS 305 Ca 0.20 -0.05 0.07 0.00 -0.85 0.00 0.00 60.65 60.02 1urb h LYS 305 Cb -0.08 -0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.45 1urb h LYS 305 CO -0.04 0.36 0.21 0.00 -3.45 0.00 0.00 179.45 176.53 1urb h ALA 306 N 0.88 0.66 -0.94 5.00 0.00 -0.59 0.27 119.26 124.54 1urb h ALA 306 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1urb h ALA 306 Cb 0.21 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1urb h ALA 306 CO -0.00 -0.18 0.59 0.82 0.00 0.00 0.00 179.25 180.48 1urb h ILE 307 N 0.40 1.25 -0.03 0.00 2.04 -0.62 0.14 117.51 120.70 1urb h ILE 307 Ca 0.25 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 1urb h ILE 307 Cb 0.26 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1urb h ILE 307 CO -0.24 0.25 0.01 -0.08 0.00 0.00 0.00 178.15 178.09 1urb h GLU 308 N 1.28 0.04 -0.20 2.37 4.81 0.20 -0.75 114.58 122.33 1urb h GLU 308 Ca 0.34 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.47 1urb h GLU 308 Cb -0.10 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1urb h GLU 308 CO -0.07 0.19 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.09 1urb h LEU 309 N -0.12 0.55 -1.42 1.64 3.38 -0.56 -3.19 115.31 115.60 1urb h LEU 309 Ca 0.01 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 1urb h LEU 309 Cb 0.16 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1urb h LEU 309 CO -0.00 0.94 -0.29 -0.07 0.09 0.00 0.00 178.44 179.10 1urb h LEU 310 N 0.18 0.00 0.00 1.67 4.07 -0.75 -2.92 115.31 117.56 1urb h LEU 310 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1urb h LEU 310 Cb 0.79 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.53 1urb h LEU 310 CO 0.06 0.29 0.00 -1.54 -1.08 0.00 0.00 178.44 176.17 1urb n SER 311 N -4.15 0.00 0.00 -0.43 3.41 -0.29 -2.80 113.62 109.36 1urb n SER 311 Ca -0.02 0.45 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 1urb n SER 311 Cb 0.34 -0.48 0.50 0.00 -0.26 0.00 0.00 64.21 64.32 1urb n SER 311 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1urb n LYS 312 N -1.48 0.03 -2.98 4.33 5.02 -1.10 -4.54 118.16 117.43 1urb n LYS 312 Ca 0.04 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 56.00 1urb n LYS 312 Cb 0.18 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1urb n LYS 312 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1urb s ASN 313 N -2.97 6.33 0.66 4.39 3.84 -1.12 -4.93 114.94 121.14 1urb s ASN 313 Ca 0.12 -0.42 0.40 0.00 0.21 0.00 0.00 52.86 53.17 1urb s ASN 313 Cb 0.15 -2.37 2.20 0.00 -0.55 0.00 0.00 41.25 40.68 1urb s ASN 313 CO 0.42 -1.00 2.27 1.05 -2.79 0.00 0.00 177.10 177.05 1urb h GLU 314 N 9.09 0.00 -0.20 0.43 4.11 -1.90 -2.26 114.58 123.85 1urb h GLU 314 Ca -0.26 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.10 1urb h GLU 314 Cb 1.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1urb h GLU 314 CO 1.00 0.00 -0.19 0.87 0.07 0.00 0.00 179.01 180.76 1urb h LYS 315 N 0.00 0.35 0.00 1.06 1.79 -1.91 -3.49 116.57 114.36 1urb h LYS 315 Ca 0.01 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1urb h LYS 315 Cb 0.14 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1urb h LYS 315 CO -0.00 0.54 0.00 0.41 -1.08 0.00 0.00 179.45 179.32 1urb n GLY 316 N -0.61 0.87 3.35 3.86 0.00 -0.85 -4.93 105.19 106.88 1urb n GLY 316 Ca -0.00 -2.19 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 1urb n GLY 316 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1urb s PHE 317 N -0.96 -0.11 -0.10 1.61 -0.12 -1.19 -1.68 117.98 115.43 1urb s PHE 317 Ca 0.00 -0.22 0.02 0.00 -0.05 0.00 0.00 56.93 56.68 1urb s PHE 317 Cb 0.00 0.23 0.01 0.00 -0.63 0.00 0.00 43.02 42.64 1urb s PHE 317 CO 0.00 -0.73 -0.16 0.12 -0.05 0.00 0.00 175.22 174.40 1urb s PHE 318 N -3.83 1.96 -0.03 3.49 5.36 -0.42 -1.44 117.98 123.06 1urb s PHE 318 Ca 0.05 -0.87 0.01 0.00 -0.96 0.00 0.00 56.93 55.17 1urb s PHE 318 Cb 0.02 -1.39 0.01 0.00 -0.34 0.00 0.00 43.02 41.32 1urb s PHE 318 CO -0.09 -0.43 -0.04 -1.17 -1.46 0.00 0.00 175.22 172.03 1urb s LEU 319 N 0.82 1.51 -0.10 6.12 2.96 -0.38 -0.06 118.68 129.55 1urb s LEU 319 Ca -0.10 -0.10 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 1urb s LEU 319 Cb -0.16 -0.35 -0.00 0.00 0.50 0.00 0.00 46.19 46.18 1urb s LEU 319 CO 0.01 -0.02 -0.23 -1.58 -1.32 0.00 0.00 176.35 173.21 1urb s GLN 320 N 0.60 3.07 -0.05 1.98 0.74 -0.89 -0.75 119.66 124.36 1urb s GLN 320 Ca -0.07 -0.86 0.06 0.00 0.05 0.00 0.00 55.36 54.54 1urb s GLN 320 Cb -0.11 -2.33 -0.01 0.00 1.10 0.00 0.00 33.01 31.66 1urb s GLN 320 CO -0.00 0.19 -0.23 0.08 -0.55 0.00 0.00 175.29 174.78 1urb s VAL 321 N 0.32 1.89 -0.08 1.34 1.01 0.72 -0.83 120.40 124.77 1urb s VAL 321 Ca -0.17 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.84 1urb s VAL 321 Cb -0.18 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.62 1urb s VAL 321 CO 0.08 0.53 -0.12 -0.70 0.00 0.00 0.00 175.10 174.89 1urb s GLU 322 N -0.18 1.74 -0.93 2.72 2.12 0.24 -0.86 118.70 123.55 1urb s GLU 322 Ca -0.02 -0.41 -0.15 0.00 0.36 0.00 0.00 54.97 54.75 1urb s GLU 322 Cb -0.13 -1.49 0.19 0.00 0.26 0.00 0.00 34.13 32.96 1urb s GLU 322 CO 0.03 -0.03 1.01 0.20 -0.54 0.00 0.00 175.26 175.93 1urb s GLY 323 N 0.86 2.41 0.07 -1.50 0.00 -0.08 -2.75 107.32 106.33 1urb s GLY 323 Ca -0.11 -3.16 -0.16 0.00 0.00 0.00 0.00 44.72 41.29 1urb s GLY 323 CO 0.01 1.64 1.31 0.00 0.00 0.00 0.00 173.10 176.07 1urb h ALA 324 N 8.02 0.29 0.00 3.20 0.00 -1.90 -2.10 119.26 126.78 1urb h ALA 324 Ca 0.16 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1urb h ALA 324 Cb 1.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1urb h ALA 324 CO 0.97 0.41 0.00 0.43 0.00 0.00 0.00 179.25 181.06 1urb n SER 325 N -4.24 0.00 0.03 0.00 7.64 -1.26 -2.92 113.62 112.88 1urb n SER 325 Ca -0.06 -0.47 -0.13 0.00 1.01 0.00 0.00 58.87 59.22 1urb n SER 325 Cb 0.55 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.67 1urb n SER 325 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1urb h ILE 326 N 0.00 1.15 -0.45 0.44 2.04 -1.75 -1.99 117.51 116.94 1urb h ILE 326 Ca 0.00 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.18 1urb h ILE 326 Cb 0.00 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1urb h ILE 326 CO 0.00 0.16 0.12 -0.78 0.00 0.00 0.00 178.15 177.66 1urb h ASP 327 N -0.35 0.67 0.16 1.72 3.58 -0.82 -1.52 116.42 119.86 1urb h ASP 327 Ca -0.01 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.23 1urb h ASP 327 Cb 0.31 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1urb h ASP 327 CO 0.01 0.71 -0.14 0.11 -2.88 0.00 0.00 179.24 177.05 1urb h LYS 328 N 0.59 -0.31 -0.16 0.28 1.79 -1.64 -0.54 116.57 116.58 1urb h LYS 328 Ca 0.14 0.02 -0.07 0.00 -2.18 0.00 0.00 60.65 58.57 1urb h LYS 328 Cb 0.30 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.00 1urb h LYS 328 CO -0.00 -0.21 -0.21 1.96 -1.08 0.00 0.00 179.45 179.92 1urb h GLN 329 N -0.32 0.27 -0.42 3.15 1.08 -1.31 -1.14 115.11 116.42 1urb h GLN 329 Ca -0.00 -0.08 -0.03 0.00 -1.45 0.00 0.00 58.65 57.09 1urb h GLN 329 Cb 0.30 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1urb h GLN 329 CO -0.03 0.48 0.15 0.22 -0.95 0.00 0.00 178.83 178.70 1urb h ASP 330 N 0.25 0.60 -0.85 1.46 1.82 -0.96 -0.86 116.42 117.88 1urb h ASP 330 Ca 0.04 -0.19 -0.01 0.00 -0.39 0.00 0.00 57.03 56.49 1urb h ASP 330 Cb 0.51 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 40.33 1urb h ASP 330 CO 0.03 0.63 0.48 0.45 -1.61 0.00 0.00 179.24 179.22 1urb h HIS 331 N 0.54 1.15 0.00 0.28 3.86 -0.48 -1.52 115.15 118.98 1urb h HIS 331 Ca 0.14 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1urb h HIS 331 Cb 0.22 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 28.32 1urb h HIS 331 CO 0.01 0.79 0.00 0.00 0.86 0.00 0.00 177.93 179.59 1urb n ALA 332 N -2.38 2.49 -3.91 2.45 0.00 -0.49 -2.52 120.51 116.15 1urb n ALA 332 Ca 0.09 -0.09 -0.25 0.00 0.00 0.00 0.00 53.44 53.18 1urb n ALA 332 Cb 0.08 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.29 1urb n ALA 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1urb n ALA 333 N -0.75 -1.93 -3.94 0.00 0.00 -0.57 -4.72 120.51 108.59 1urb n ALA 333 Ca 0.11 -0.21 -0.30 0.00 0.00 0.00 0.00 53.44 53.04 1urb n ALA 333 Cb 0.05 -1.85 -0.14 0.00 0.00 0.00 0.00 19.45 17.50 1urb n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1urb s ASN 334 N -4.25 4.39 0.17 0.00 3.84 -0.42 -0.70 114.94 117.96 1urb s ASN 334 Ca 0.08 -2.63 -0.20 0.00 0.21 0.00 0.00 52.86 50.33 1urb s ASN 334 Cb -0.04 -1.54 0.10 0.00 -0.55 0.00 0.00 41.25 39.21 1urb s ASN 334 CO 0.87 -0.29 1.62 -0.65 -2.79 0.00 0.00 177.10 175.86 1urb h PRO 335 N 6.97 -0.16 -1.01 0.43 0.11 -1.84 -2.05 132.00 134.46 1urb h PRO 335 Ca -0.06 0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.14 1urb h PRO 335 Cb 0.94 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.02 1urb h PRO 335 CO 0.60 -0.11 0.65 0.00 -0.21 0.00 0.00 178.00 178.93 1urb h GLY 337 N 1.14 0.62 0.98 0.00 0.00 -1.56 -1.09 103.07 103.15 1urb h GLY 337 Ca 0.45 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 1urb h GLY 337 CO -0.20 0.54 -0.08 -1.61 0.00 0.00 0.00 176.54 175.19 1urb h GLN 338 N 0.29 -0.22 -0.57 4.80 4.15 -0.86 -2.29 115.11 120.41 1urb h GLN 338 Ca 0.05 0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.43 1urb h GLN 338 Cb 0.72 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 1urb h GLN 338 CO 0.05 -0.13 0.16 0.82 -1.93 0.00 0.00 178.83 177.80 1urb h ILE 339 N -0.25 1.24 -0.16 2.39 2.04 -0.96 -2.70 117.51 119.11 1urb h ILE 339 Ca -0.02 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 1urb h ILE 339 Cb 0.19 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1urb h ILE 339 CO 0.04 0.32 -0.04 1.23 0.00 0.00 0.00 178.15 179.70 1urb h GLY 340 N 0.81 0.25 2.00 5.37 0.00 -1.11 -0.91 103.07 109.48 1urb h GLY 340 Ca 0.18 -0.13 -0.15 0.00 0.00 0.00 0.00 47.33 47.23 1urb h GLY 340 CO -0.00 0.12 -0.72 0.83 0.00 0.00 0.00 176.54 176.77 1urb h GLU 341 N 0.23 0.00 -0.30 4.80 4.39 -1.23 -1.21 114.58 121.26 1urb h GLU 341 Ca 0.05 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.61 1urb h GLU 341 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1urb h GLU 341 CO 0.01 0.72 -0.39 1.15 -1.16 0.00 0.00 179.01 179.33 1urb h THR 342 N 0.00 1.29 -0.57 1.13 2.02 -0.96 0.55 112.91 116.36 1urb h THR 342 Ca -0.01 -1.56 -0.10 0.00 0.77 0.00 0.00 66.41 65.51 1urb h THR 342 Cb 1.34 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 69.20 1urb h THR 342 CO 0.09 0.51 -0.05 0.58 0.37 0.00 0.00 175.52 177.02 1urb h VAL 343 N 0.59 1.27 -0.17 3.16 2.07 -1.08 -1.55 116.25 120.54 1urb h VAL 343 Ca 0.05 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.37 1urb h VAL 343 Cb 0.93 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1urb h VAL 343 CO 0.08 0.43 0.09 -0.78 0.02 0.00 0.00 177.57 177.42 1urb h ASP 344 N 0.94 0.14 -0.89 0.57 3.58 -0.88 -2.03 116.42 117.85 1urb h ASP 344 Ca 0.16 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.62 1urb h ASP 344 Cb 0.61 -0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.59 1urb h ASP 344 CO 0.04 0.11 0.59 0.25 -2.88 0.00 0.00 179.24 177.35 1urb h LEU 345 N 0.20 1.01 -0.82 2.28 5.85 -0.71 -2.50 115.31 120.62 1urb h LEU 345 Ca 0.07 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.88 1urb h LEU 345 Cb 0.01 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 40.70 1urb h LEU 345 CO -0.04 0.73 0.45 -0.78 -0.34 0.00 0.00 178.44 178.45 1urb h ASP 346 N 1.19 0.59 -0.79 1.25 3.58 -0.56 0.04 116.42 121.73 1urb h ASP 346 Ca 0.33 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.84 1urb h ASP 346 Cb -0.12 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 40.86 1urb h ASP 346 CO -0.08 0.30 0.46 -0.33 -2.88 0.00 0.00 179.24 176.72 1urb h GLU 347 N 0.70 1.09 -0.51 0.28 5.08 -1.10 -0.74 114.58 119.37 1urb h GLU 347 Ca 0.42 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.60 1urb h GLU 347 Cb 0.49 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1urb h GLU 347 CO -0.30 0.78 0.04 0.00 -1.00 0.00 0.00 179.01 178.53 1urb h ALA 348 N 1.24 0.68 -0.59 3.43 0.00 -0.99 -1.73 119.26 121.31 1urb h ALA 348 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1urb h ALA 348 Cb -0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1urb h ALA 348 CO -0.05 0.46 0.38 0.28 0.00 0.00 0.00 179.25 180.32 1urb h VAL 349 N 0.75 1.16 -0.40 0.00 2.07 -0.45 -0.91 116.25 118.47 1urb h VAL 349 Ca 0.15 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 1urb h VAL 349 Cb 0.47 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1urb h VAL 349 CO 0.02 0.16 0.11 1.56 0.02 0.00 0.00 177.57 179.43 1urb h GLN 350 N 0.81 0.64 -0.35 1.57 4.20 -0.45 0.12 115.11 121.64 1urb h GLN 350 Ca 0.22 -0.15 0.05 0.00 0.06 0.00 0.00 58.65 58.83 1urb h GLN 350 Cb -0.07 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.57 1urb h GLN 350 CO -0.04 0.65 0.09 0.00 -0.67 0.00 0.00 178.83 178.86 1urb h ARG 351 N 0.51 0.22 -0.23 1.46 -0.00 -0.52 -0.62 114.38 115.18 1urb h ARG 351 Ca 0.13 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.98 59.59 1urb h ARG 351 Cb 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 29.97 30.20 1urb h ARG 351 CO -0.00 0.14 0.13 0.00 0.00 0.00 0.00 179.97 180.24 1urb h ALA 352 N 1.25 0.30 -0.56 0.04 0.00 -0.77 -2.39 119.26 117.13 1urb h ALA 352 Ca 0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1urb h ALA 352 Cb 0.17 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1urb h ALA 352 CO -0.20 -0.17 0.23 -0.07 0.00 0.00 0.00 179.25 179.05 1urb h LEU 353 N 0.27 0.74 0.17 0.00 4.07 -0.34 -1.01 115.31 119.20 1urb h LEU 353 Ca 0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 57.88 57.94 1urb h LEU 353 Cb 0.07 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.62 1urb h LEU 353 CO -0.01 0.66 -0.08 -0.33 -1.08 0.00 0.00 178.44 177.60 1urb h GLU 354 N 0.81 -0.21 -0.73 1.13 5.08 -0.88 0.16 114.58 119.92 1urb h GLU 354 Ca 0.19 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.63 1urb h GLU 354 Cb 0.15 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 1urb h GLU 354 CO -0.02 0.00 0.43 0.35 -1.00 0.00 0.00 179.01 178.78 1urb h PHE 355 N -0.40 0.80 -0.52 4.33 3.57 -1.21 -2.45 116.94 121.05 1urb h PHE 355 Ca -0.02 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 1urb h PHE 355 Cb 0.32 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1urb h PHE 355 CO -0.01 0.40 -0.15 0.00 -2.23 0.00 0.00 178.31 176.31 1urb h ALA 356 N 1.36 0.74 -0.78 2.41 0.00 -1.00 -0.11 119.26 121.88 1urb h ALA 356 Ca 0.32 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1urb h ALA 356 Cb 0.16 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1urb h ALA 356 CO -0.17 0.68 0.48 -0.22 0.00 0.00 0.00 179.25 180.01 1urb h LYS 357 N 0.90 1.04 0.12 0.00 3.64 -0.25 -0.90 116.57 121.12 1urb h LYS 357 Ca 0.13 -0.08 -0.33 0.00 -1.27 0.00 0.00 60.65 59.10 1urb h LYS 357 Cb 0.73 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1urb h LYS 357 CO 0.06 0.72 -1.69 1.57 -2.27 0.00 0.00 179.45 177.83 1urb h LYS 358 N 1.06 0.26 -0.54 1.90 2.10 -1.27 -3.35 116.57 116.73 1urb h LYS 358 Ca 0.28 -0.44 -0.08 0.00 -2.00 0.00 0.00 60.65 58.40 1urb h LYS 358 Cb -0.06 0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 31.41 1urb h LYS 358 CO -0.05 1.11 -0.00 1.49 -2.00 0.00 0.00 179.45 180.00 1urb h GLU 359 N 0.07 0.92 0.00 0.07 4.22 -0.90 -3.47 114.58 115.49 1urb h GLU 359 Ca -0.31 -0.27 0.00 0.00 0.08 0.00 0.00 59.36 58.87 1urb h GLU 359 Cb 2.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.19 1urb h GLU 359 CO 0.14 0.91 0.00 0.41 -2.18 0.00 0.00 179.01 178.30 1urb n GLY 360 N -0.54 2.91 1.51 1.92 0.00 -0.35 -4.80 105.19 105.85 1urb n GLY 360 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 1urb n GLY 360 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1urb n ASN 361 N 0.00 2.33 -4.43 1.61 3.02 -1.26 -4.77 115.26 111.75 1urb n ASN 361 Ca 0.00 -3.13 -0.33 0.00 -0.03 0.00 0.00 54.58 51.09 1urb n ASN 361 Cb 0.00 -0.42 -0.13 0.00 -0.61 0.00 0.00 39.78 38.61 1urb n ASN 361 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1urb s THR 362 N -2.92 3.25 -0.26 3.41 2.01 -1.26 -0.22 115.64 119.65 1urb s THR 362 Ca 0.39 -0.61 -0.13 0.00 0.31 0.00 0.00 61.69 61.65 1urb s THR 362 Cb 0.38 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1urb s THR 362 CO -0.06 0.54 0.28 -0.22 -0.69 0.00 0.00 174.62 174.46 1urb s LEU 363 N 0.06 4.06 -0.15 4.42 2.96 -0.51 -4.17 118.68 125.34 1urb s LEU 363 Ca -0.04 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 54.03 1urb s LEU 363 Cb -0.14 -2.28 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 1urb s LEU 363 CO 0.04 -0.08 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.23 1urb s VAL 364 N 1.71 3.54 -0.08 1.68 1.01 0.28 -1.04 120.40 127.51 1urb s VAL 364 Ca 0.11 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1urb s VAL 364 Cb -0.15 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1urb s VAL 364 CO 0.09 0.50 -0.15 -0.63 0.00 0.00 0.00 175.10 174.90 1urb s ILE 365 N 0.49 1.40 -0.14 2.22 1.01 -0.31 -0.71 121.20 125.17 1urb s ILE 365 Ca -0.05 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1urb s ILE 365 Cb -0.15 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.08 1urb s ILE 365 CO 0.03 0.41 -0.19 -0.69 0.00 0.00 0.00 174.94 174.51 1urb s VAL 366 N 0.67 1.82 0.12 2.92 1.01 -0.21 -0.35 120.40 126.37 1urb s VAL 366 Ca -0.14 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 1urb s VAL 366 Cb -0.16 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.59 1urb s VAL 366 CO 0.04 0.50 0.23 1.07 0.00 0.00 0.00 175.10 176.94 1urb n THR 367 N 4.26 0.00 -4.43 3.92 5.66 -0.49 -1.71 114.28 121.48 1urb n THR 367 Ca -0.19 -0.30 -0.21 0.00 -3.05 0.00 0.00 64.05 60.30 1urb n THR 367 Cb 0.51 0.29 -0.10 0.00 -1.55 0.00 0.00 70.33 69.48 1urb n THR 367 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1urb s ALA 368 N -1.33 2.36 -0.03 1.79 0.00 -1.26 -0.13 121.76 123.16 1urb s ALA 368 Ca 0.05 -1.92 -0.04 0.00 0.00 0.00 0.00 51.96 50.05 1urb s ALA 368 Cb -0.01 0.22 -0.28 0.00 0.00 0.00 0.00 23.12 23.05 1urb s ALA 368 CO 0.04 -0.09 0.73 0.38 0.00 0.00 0.00 175.76 176.81 1urb h ASP 369 N 2.26 0.40 -4.96 0.00 2.03 -1.94 -3.48 116.42 110.74 1urb h ASP 369 Ca -0.40 -0.63 0.05 0.00 -0.73 0.00 0.00 57.03 55.31 1urb h ASP 369 Cb 1.23 -0.13 -0.11 0.00 -0.83 0.00 0.00 39.33 39.49 1urb h ASP 369 CO 0.68 1.54 0.30 -1.38 -1.03 0.00 0.00 179.24 179.35 1urb s HIS 370 N -2.60 -0.39 0.48 4.15 -3.43 -1.26 -4.85 115.29 107.40 1urb s HIS 370 Ca -0.12 0.13 -0.18 0.00 -0.80 0.00 0.00 55.06 54.09 1urb s HIS 370 Cb 0.07 0.59 -0.09 0.00 -1.43 0.00 0.00 32.58 31.72 1urb s HIS 370 CO 0.84 -0.86 0.97 0.00 -2.00 0.00 0.00 174.74 173.68 1urb s ALA 371 N -3.60 3.07 0.00 -1.38 0.00 -1.25 -3.55 121.76 115.05 1urb s ALA 371 Ca 0.05 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.26 1urb s ALA 371 Cb -0.02 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1urb s ALA 371 CO -0.07 -0.09 0.00 1.58 0.00 0.00 0.00 175.76 177.19 1urb n HIS 372 N -1.21 -0.34 -0.03 0.00 -0.00 -1.26 -1.62 115.22 110.76 1urb n HIS 372 Ca 0.07 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.11 1urb n HIS 372 Cb 0.54 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 30.27 1urb n HIS 372 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1urb n ALA 373 N -3.00 1.30 -1.56 1.57 0.00 -1.16 -4.33 120.51 113.34 1urb n ALA 373 Ca 0.00 -0.81 -0.50 0.00 0.00 0.00 0.00 53.44 52.13 1urb n ALA 373 Cb 0.00 -0.65 -0.05 0.00 0.00 0.00 0.00 19.45 18.75 1urb n ALA 373 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1urb n SER 374 N -3.16 1.01 -4.15 0.00 3.41 -1.26 -4.72 113.62 104.76 1urb n SER 374 Ca -0.26 1.14 -0.16 0.00 -0.26 0.00 0.00 58.87 59.33 1urb n SER 374 Cb 1.06 -1.16 -0.12 0.00 -0.26 0.00 0.00 64.21 63.74 1urb n SER 374 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1urb s GLN 375 N -0.28 0.75 -0.32 4.33 -0.21 -0.47 -4.80 119.66 118.67 1urb s GLN 375 Ca 0.76 -0.95 -0.13 0.00 0.02 0.00 0.00 55.36 55.06 1urb s GLN 375 Cb -0.92 -0.64 -0.03 0.00 1.00 0.00 0.00 33.01 32.43 1urb s GLN 375 CO 0.52 0.13 0.24 0.42 -2.12 0.00 0.00 175.29 174.49 1urb s ILE 376 N -1.54 5.28 0.37 1.08 1.01 -1.26 -0.82 121.20 125.32 1urb s ILE 376 Ca -0.02 -0.06 0.09 0.00 0.00 0.00 0.00 60.65 60.65 1urb s ILE 376 Cb -0.09 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.64 1urb s ILE 376 CO 0.01 0.06 -0.03 0.68 0.00 0.00 0.00 174.94 175.66 1urb s VAL 377 N 1.77 2.24 0.55 2.92 -7.23 -0.62 -4.99 120.40 115.03 1urb s VAL 377 Ca 0.07 -2.08 -0.20 0.00 -1.81 0.00 0.00 61.98 57.96 1urb s VAL 377 Cb -0.17 -2.79 -0.07 0.00 0.56 0.00 0.00 36.38 33.91 1urb s VAL 377 CO 0.11 -0.13 0.95 0.00 -0.31 0.00 0.00 175.10 175.71 1urb n ALA 378 N -0.89 0.11 -0.04 1.32 0.00 -1.26 -3.97 120.51 115.78 1urb n ALA 378 Ca -0.05 0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.51 1urb n ALA 378 Cb 0.64 -2.08 0.41 0.00 0.00 0.00 0.00 19.45 18.42 1urb n ALA 378 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1urb h PRO 379 N 0.80 0.58 -0.17 0.00 0.11 -1.93 -1.54 132.00 129.85 1urb h PRO 379 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1urb h PRO 379 Cb 1.36 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1urb h PRO 379 CO 0.52 0.38 0.00 -0.40 -0.21 0.00 0.00 178.00 178.30 1urb n ASP 380 N -4.47 1.30 -4.66 -2.05 5.68 -1.26 -4.85 116.55 106.24 1urb n ASP 380 Ca 0.05 -1.75 -0.44 0.00 -0.50 0.00 0.00 54.79 52.15 1urb n ASP 380 Cb 0.10 -0.11 -0.02 0.00 -1.14 0.00 0.00 41.12 39.95 1urb n ASP 380 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1urb n THR 381 N 0.11 1.56 -3.85 2.12 -1.04 -0.58 -4.96 114.28 107.64 1urb n THR 381 Ca 0.14 -0.39 -0.33 0.00 -2.04 0.00 0.00 64.05 61.43 1urb n THR 381 Cb 0.25 -1.38 -0.12 0.00 -1.82 0.00 0.00 70.33 67.26 1urb n THR 381 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1urb s LYS 382 N -1.20 2.28 0.16 -2.82 2.47 -1.26 -4.86 119.74 114.51 1urb s LYS 382 Ca 0.62 -2.65 0.02 0.00 -1.56 0.00 0.00 55.97 52.41 1urb s LYS 382 Cb -0.64 -3.51 -0.04 0.00 -1.46 0.00 0.00 37.83 32.19 1urb s LYS 382 CO 0.57 -1.15 0.30 0.00 0.16 0.00 0.00 175.35 175.23 1urb s ALA 383 N -0.30 3.96 -0.71 3.13 0.00 -1.26 -5.00 121.76 121.58 1urb s ALA 383 Ca 0.18 -1.04 0.24 0.00 0.00 0.00 0.00 51.96 51.34 1urb s ALA 383 Cb -0.22 -1.79 0.91 0.00 0.00 0.00 0.00 23.12 22.02 1urb s ALA 383 CO -0.02 0.51 1.74 -0.35 0.00 0.00 0.00 175.76 177.63 1urb n PRO 384 N -0.63 0.17 0.00 0.00 -0.04 -1.26 -4.61 135.00 128.63 1urb n PRO 384 Ca -0.07 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 1urb n PRO 384 Cb 0.54 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1urb n PRO 384 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1urb n GLY 385 N 0.69 2.57 3.80 0.55 0.00 -1.26 -5.03 105.19 106.51 1urb n GLY 385 Ca 0.04 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.89 1urb n GLY 385 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1urb s LEU 386 N 0.00 4.33 0.16 0.99 1.43 -0.60 -4.15 118.68 120.83 1urb s LEU 386 Ca 0.00 0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1urb s LEU 386 Cb 0.00 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 1urb s LEU 386 CO 0.00 0.27 0.05 0.42 0.23 0.00 0.00 176.35 177.32 1urb s THR 387 N -0.38 0.29 -0.23 5.49 -4.23 -0.50 -0.36 115.64 115.72 1urb s THR 387 Ca 0.15 -1.94 -0.26 0.00 -1.18 0.00 0.00 61.69 58.46 1urb s THR 387 Cb -0.13 -2.13 0.08 0.00 1.34 0.00 0.00 72.50 71.66 1urb s THR 387 CO 0.04 -0.41 0.80 -1.58 -0.54 0.00 0.00 174.62 172.93 1urb s GLN 388 N -4.02 0.78 -0.14 3.99 0.74 -0.51 -2.02 119.66 118.49 1urb s GLN 388 Ca 0.26 0.76 -0.07 0.00 0.05 0.00 0.00 55.36 56.35 1urb s GLN 388 Cb 0.07 0.38 -0.04 0.00 1.10 0.00 0.00 33.01 34.52 1urb s GLN 388 CO 0.04 -0.13 0.13 0.00 -0.55 0.00 0.00 175.29 174.78 1urb s ALA 389 N 0.04 3.82 0.10 1.58 0.00 -1.26 -0.64 121.76 125.40 1urb s ALA 389 Ca -0.01 -0.66 0.08 0.00 0.00 0.00 0.00 51.96 51.38 1urb s ALA 389 Cb -0.04 -1.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.05 1urb s ALA 389 CO 0.01 0.52 -0.21 -0.51 0.00 0.00 0.00 175.76 175.57 1urb s LEU 390 N -0.74 2.30 -0.44 0.00 2.01 0.14 -0.49 118.68 121.46 1urb s LEU 390 Ca 0.13 -0.68 -0.18 0.00 0.01 0.00 0.00 54.13 53.41 1urb s LEU 390 Cb -0.12 -0.90 0.03 0.00 0.01 0.00 0.00 46.19 45.22 1urb s LEU 390 CO 0.03 0.06 0.50 0.20 1.01 0.00 0.00 176.35 178.16 1urb s ASN 391 N -1.89 6.22 0.91 2.29 0.01 -0.12 -0.78 114.94 121.58 1urb s ASN 391 Ca 0.07 -0.72 -0.13 0.00 -0.71 0.00 0.00 52.86 51.36 1urb s ASN 391 Cb -0.10 -2.25 0.18 0.00 0.41 0.00 0.00 41.25 39.50 1urb s ASN 391 CO 0.04 -0.68 1.26 0.42 -1.51 0.00 0.00 177.10 176.63 1urb s THR 392 N 2.30 2.03 -0.38 1.60 -4.23 -0.31 -4.85 115.64 111.80 1urb s THR 392 Ca 0.14 -0.12 0.25 0.00 -1.18 0.00 0.00 61.69 60.78 1urb s THR 392 Cb -0.18 -2.90 0.27 0.00 1.34 0.00 0.00 72.50 71.03 1urb s THR 392 CO 0.14 0.00 1.76 0.50 -0.54 0.00 0.00 174.62 176.48 1urb h LYS 393 N -1.42 0.00 0.00 3.99 3.64 -1.48 -1.36 116.57 119.95 1urb h LYS 393 Ca -0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1urb h LYS 393 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1urb h LYS 393 CO 0.39 0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 177.32 1urb n ASP 394 N -2.39 0.47 0.00 4.20 8.00 -1.26 -4.88 116.55 120.69 1urb n ASP 394 Ca 0.02 0.55 0.00 0.00 0.71 0.00 0.00 54.79 56.07 1urb n ASP 394 Cb 0.25 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 1urb n ASP 394 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1urb n GLY 395 N 1.31 0.47 3.52 0.44 0.00 -0.51 -5.05 105.19 105.36 1urb n GLY 395 Ca 0.06 -0.90 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 1urb n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1urb s ALA 396 N -2.00 2.70 -0.11 4.61 0.00 -1.26 -4.93 121.76 120.77 1urb s ALA 396 Ca 0.00 -2.14 -0.10 0.00 0.00 0.00 0.00 51.96 49.72 1urb s ALA 396 Cb 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 1urb s ALA 396 CO 0.00 -0.19 0.22 0.08 0.00 0.00 0.00 175.76 175.87 1urb s VAL 397 N -3.01 5.36 -0.02 0.00 1.01 -1.26 -1.16 120.40 121.32 1urb s VAL 397 Ca 0.35 0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.78 1urb s VAL 397 Cb 0.08 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1urb s VAL 397 CO 0.16 0.55 -0.18 -0.32 0.00 0.00 0.00 175.10 175.32 1urb s MET 398 N -0.64 1.47 -0.12 2.72 0.00 0.04 -4.91 119.30 117.86 1urb s MET 398 Ca 0.16 -0.63 0.01 0.00 0.00 0.00 0.00 55.69 55.24 1urb s MET 398 Cb -0.13 -1.40 -0.01 0.00 0.00 0.00 0.00 34.83 33.29 1urb s MET 398 CO 0.05 0.36 -0.15 0.08 0.00 0.00 0.00 175.02 175.36 1urb s VAL 399 N -0.36 2.86 -0.09 10.11 1.01 -1.25 0.28 120.40 132.95 1urb s VAL 399 Ca 0.06 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1urb s VAL 399 Cb -0.07 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1urb s VAL 399 CO -0.00 0.54 -0.08 -0.04 0.00 0.00 0.00 175.10 175.52 1urb s MET 400 N 0.23 2.97 -0.06 2.72 -1.94 0.19 -1.59 119.30 121.82 1urb s MET 400 Ca -0.10 -0.57 0.06 0.00 -1.71 0.00 0.00 55.69 53.36 1urb s MET 400 Cb -0.16 -2.64 -0.01 0.00 2.01 0.00 0.00 34.83 34.04 1urb s MET 400 CO 0.06 0.53 -0.23 0.45 -0.01 0.00 0.00 175.02 175.82 1urb s SER 401 N -0.46 2.89 -0.42 3.03 0.15 -0.00 -1.43 113.70 117.47 1urb s SER 401 Ca 0.07 -0.49 0.03 0.00 0.70 0.00 0.00 55.95 56.26 1urb s SER 401 Cb -0.12 -0.86 0.12 0.00 -1.71 0.00 0.00 66.02 63.45 1urb s SER 401 CO 0.02 0.22 0.17 -0.31 1.20 0.00 0.00 173.24 174.54 1urb s TYR 402 N -0.07 2.86 -0.33 3.44 1.51 0.52 -1.37 117.35 123.91 1urb s TYR 402 Ca -0.05 -2.74 0.17 0.00 -1.01 0.00 0.00 57.07 53.43 1urb s TYR 402 Cb -0.14 -2.48 0.46 0.00 -0.11 0.00 0.00 41.96 39.69 1urb s TYR 402 CO 0.04 -0.83 0.98 0.41 -1.11 0.00 0.00 175.55 175.04 1urb n GLY 403 N 3.80 2.13 0.06 0.71 0.00 -1.26 -1.56 105.19 109.08 1urb n GLY 403 Ca 0.04 -1.47 0.01 0.00 0.00 0.00 0.00 46.02 44.60 1urb n GLY 403 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1urb n ASN 404 N -0.15 1.37 -3.71 1.61 6.94 -1.26 -4.83 115.26 115.24 1urb n ASN 404 Ca 0.13 -1.30 -0.14 0.00 -0.02 0.00 0.00 54.58 53.25 1urb n ASN 404 Cb 0.80 -0.01 -0.09 0.00 -2.36 0.00 0.00 39.78 38.13 1urb n ASN 404 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1urb s SER 405 N -0.34 -0.40 -0.22 0.53 0.15 -1.26 -4.68 113.70 107.47 1urb s SER 405 Ca 0.02 0.58 0.10 0.00 0.70 0.00 0.00 55.95 57.35 1urb s SER 405 Cb 0.01 0.65 -0.21 0.00 -1.71 0.00 0.00 66.02 64.76 1urb s SER 405 CO 0.02 -0.33 -0.06 -0.62 1.20 0.00 0.00 173.24 173.45 1urb n GLU 406 N 2.00 0.67 0.00 5.44 1.02 -1.26 -4.86 120.64 123.65 1urb n GLU 406 Ca -0.17 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1urb n GLU 406 Cb 0.57 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1urb n GLU 406 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1urb n GLU 407 N -3.01 2.01 0.38 3.49 1.02 -1.26 -4.94 120.64 118.33 1urb n GLU 407 Ca -0.39 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.58 1urb n GLU 407 Cb 1.07 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 32.41 1urb n GLU 407 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1urb h ASP 408 N 0.00 -0.83 -3.44 1.62 3.04 -2.00 -3.45 116.42 111.37 1urb h ASP 408 Ca 0.00 0.00 -0.67 0.00 -3.24 0.00 0.00 57.03 53.13 1urb h ASP 408 Cb 0.00 0.21 -0.28 0.00 -1.04 0.00 0.00 39.33 38.23 1urb h ASP 408 CO 0.00 -0.50 -0.79 -0.44 -2.04 0.00 0.00 179.24 175.47 1urb s SER 409 N -4.41 3.84 0.29 4.15 0.01 -1.26 -4.99 113.70 111.32 1urb s SER 409 Ca -0.17 -0.35 -0.30 0.00 1.31 0.00 0.00 55.95 56.44 1urb s SER 409 Cb 0.02 -1.46 -0.13 0.00 0.21 0.00 0.00 66.02 64.67 1urb s SER 409 CO 0.54 0.19 1.37 0.00 0.41 0.00 0.00 173.24 175.75 1urb n GLN 410 N 3.35 2.14 -2.40 12.44 1.13 -1.05 -4.89 117.38 128.11 1urb n GLN 410 Ca -0.18 0.76 -0.25 0.00 -1.94 0.00 0.00 57.00 55.39 1urb n GLN 410 Cb 0.53 -2.39 0.10 0.00 0.11 0.00 0.00 30.24 28.58 1urb n GLN 410 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1urb s GLU 411 N -1.04 1.79 0.72 -1.09 2.02 -1.26 -4.63 118.70 115.21 1urb s GLU 411 Ca 0.62 -0.73 -0.08 0.00 0.02 0.00 0.00 54.97 54.80 1urb s GLU 411 Cb -0.60 -2.24 0.06 0.00 0.10 0.00 0.00 34.13 31.45 1urb s GLU 411 CO 0.55 -1.42 1.05 -1.01 0.02 0.00 0.00 175.26 174.45 1urb s HIS 412 N -3.22 2.99 0.14 1.61 3.76 -1.26 -2.96 115.29 116.34 1urb s HIS 412 Ca 0.64 0.59 0.01 0.00 -0.15 0.00 0.00 55.06 56.16 1urb s HIS 412 Cb -0.07 -3.22 -0.04 0.00 1.11 0.00 0.00 32.58 30.35 1urb s HIS 412 CO 0.45 -1.43 -0.01 0.95 -0.85 0.00 0.00 174.74 173.84 1urb s THR 413 N -3.32 0.58 -1.86 1.30 -4.23 -0.64 -4.86 115.64 102.61 1urb s THR 413 Ca 0.60 -1.95 0.19 0.00 -1.18 0.00 0.00 61.69 59.35 1urb s THR 413 Cb -0.11 -1.93 0.58 0.00 1.34 0.00 0.00 72.50 72.38 1urb s THR 413 CO 0.46 -0.63 1.48 0.61 -0.54 0.00 0.00 174.62 176.00 1urb n GLY 414 N -0.14 2.06 3.77 3.99 0.00 -1.26 -3.81 105.19 109.80 1urb n GLY 414 Ca -0.09 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1urb n GLY 414 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1urb s SER 415 N -0.97 6.49 0.76 1.61 0.15 -1.26 -4.86 113.70 115.62 1urb s SER 415 Ca 0.43 2.92 -0.14 0.00 0.70 0.00 0.00 55.95 59.87 1urb s SER 415 Cb 0.23 -2.66 0.06 0.00 -1.71 0.00 0.00 66.02 61.94 1urb s SER 415 CO 0.28 -0.76 1.20 0.00 1.20 0.00 0.00 173.24 175.16 1urb s GLN 416 N -1.91 1.92 0.12 5.44 -2.07 -1.26 -4.51 119.66 117.38 1urb s GLN 416 Ca 0.52 1.75 -0.03 0.00 -1.82 0.00 0.00 55.36 55.78 1urb s GLN 416 Cb -0.44 -1.81 -0.03 0.00 -1.09 0.00 0.00 33.01 29.64 1urb s GLN 416 CO 0.59 -2.00 0.09 -0.48 -1.32 0.00 0.00 175.29 172.17 1urb s LEU 417 N -5.41 1.76 0.34 2.60 0.05 -0.91 -4.89 118.68 112.21 1urb s LEU 417 Ca 0.74 -1.07 -0.28 0.00 0.05 0.00 0.00 54.13 53.56 1urb s LEU 417 Cb -0.29 0.48 -0.12 0.00 -2.05 0.00 0.00 46.19 44.21 1urb s LEU 417 CO 0.48 -0.73 1.32 -1.14 -0.55 0.00 0.00 176.35 175.73 1urb n ARG 418 N -0.07 2.20 -3.74 1.48 0.63 -1.26 -0.99 116.66 114.91 1urb n ARG 418 Ca -0.08 0.77 -0.16 0.00 -0.92 0.00 0.00 57.85 57.46 1urb n ARG 418 Cb 0.63 -2.38 -0.16 0.00 0.45 0.00 0.00 32.46 31.00 1urb n ARG 418 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1urb s ILE 419 N -1.03 -0.08 0.12 5.15 2.07 -0.67 -4.21 121.20 122.56 1urb s ILE 419 Ca 0.56 0.26 0.06 0.00 -1.41 0.00 0.00 60.65 60.12 1urb s ILE 419 Cb -0.56 -0.13 -0.04 0.00 0.13 0.00 0.00 42.46 41.86 1urb s ILE 419 CO 0.62 0.11 -0.15 0.00 -1.91 0.00 0.00 174.94 173.60 1urb s ALA 420 N 1.34 1.55 0.11 1.50 0.00 -0.70 -0.45 121.76 125.12 1urb s ALA 420 Ca -0.06 -1.29 -0.09 0.00 0.00 0.00 0.00 51.96 50.52 1urb s ALA 420 Cb -0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 1urb s ALA 420 CO -0.04 0.14 0.23 0.00 0.00 0.00 0.00 175.76 176.09 1urb s ALA 421 N -2.00 -0.22 -0.09 0.00 0.00 0.23 -1.05 121.76 118.63 1urb s ALA 421 Ca 0.09 -0.64 -0.09 0.00 0.00 0.00 0.00 51.96 51.32 1urb s ALA 421 Cb -0.06 0.59 0.02 0.00 0.00 0.00 0.00 23.12 23.68 1urb s ALA 421 CO 0.03 -0.55 0.25 -0.47 0.00 0.00 0.00 175.76 175.03 1urb s TYR 422 N -3.88 -0.27 0.00 0.00 5.04 0.12 -2.90 117.35 115.46 1urb s TYR 422 Ca 0.08 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.35 1urb s TYR 422 Cb 0.04 0.09 0.00 0.00 0.35 0.00 0.00 41.96 42.44 1urb s TYR 422 CO -0.08 -0.15 0.00 0.41 -1.34 0.00 0.00 175.55 174.39 1urb n GLY 423 N 2.84 -1.45 3.74 8.97 0.00 -1.26 -0.55 105.19 117.48 1urb n GLY 423 Ca -0.13 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.28 1urb n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1urb s PRO 424 N -0.48 4.15 -0.00 1.61 0.04 -1.26 -2.88 135.00 136.18 1urb s PRO 424 Ca 0.00 2.52 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1urb s PRO 424 Cb 0.00 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.48 1urb s PRO 424 CO 0.00 -0.62 0.00 0.72 0.04 0.00 0.00 177.00 177.14 1urb n HIS 425 N 2.63 0.00 0.27 0.56 8.25 -0.28 -4.63 115.22 122.02 1urb n HIS 425 Ca 0.10 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.69 1urb n HIS 425 Cb 0.38 -0.15 0.78 0.00 1.12 0.00 0.00 29.99 32.11 1urb n HIS 425 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1urb h ALA 426 N 0.00 1.29 0.00 -1.41 0.00 -1.78 -2.33 119.26 115.03 1urb h ALA 426 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1urb h ALA 426 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1urb h ALA 426 CO 0.00 0.12 0.19 0.00 0.00 0.00 0.00 179.25 179.56 1urb h ALA 427 N 1.91 1.19 0.00 0.00 0.00 -1.90 -1.95 119.26 118.51 1urb h ALA 427 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1urb h ALA 427 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1urb h ALA 427 CO 0.01 -0.19 0.00 0.09 0.00 0.00 0.00 179.25 179.17 1urb n ASN 428 N -2.90 0.00 -0.47 0.00 3.02 -0.88 -2.63 115.26 111.40 1urb n ASN 428 Ca -0.02 -0.73 0.06 0.00 -0.03 0.00 0.00 54.58 53.86 1urb n ASN 428 Cb 0.24 -0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.45 1urb n ASN 428 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1urb n VAL 429 N -1.01 0.00 -2.89 2.41 0.24 -0.73 -4.99 118.33 111.36 1urb n VAL 429 Ca 0.18 -0.47 -0.33 0.00 -2.04 0.00 0.00 64.34 61.67 1urb n VAL 429 Cb 0.09 1.24 -0.07 0.00 -1.47 0.00 0.00 33.84 33.63 1urb n VAL 429 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1urb s VAL 430 N -1.17 4.44 0.00 3.34 1.01 -1.08 -2.93 120.40 124.01 1urb s VAL 430 Ca 0.14 1.40 0.00 0.00 0.00 0.00 0.00 61.98 63.52 1urb s VAL 430 Cb 0.11 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1urb s VAL 430 CO 0.19 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.68 1urb n GLY 431 N -0.40 -1.09 3.71 4.51 0.00 -1.25 -4.76 105.19 105.90 1urb n GLY 431 Ca 0.05 -1.21 -0.40 0.00 0.00 0.00 0.00 46.02 44.46 1urb n GLY 431 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1urb s LEU 432 N 0.00 4.30 0.28 0.99 2.96 -1.26 -2.06 118.68 123.89 1urb s LEU 432 Ca 0.00 1.15 0.04 0.00 -0.22 0.00 0.00 54.13 55.10 1urb s LEU 432 Cb 0.00 -3.07 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 1urb s LEU 432 CO 0.00 -0.14 0.23 0.42 -1.32 0.00 0.00 176.35 175.54 1urb s THR 433 N 0.95 0.00 0.21 3.68 -4.23 -0.81 -5.00 115.64 110.43 1urb s THR 433 Ca 0.37 -1.99 0.09 0.00 -1.18 0.00 0.00 61.69 58.98 1urb s THR 433 Cb -0.17 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 1urb s THR 433 CO 0.17 0.00 -0.05 -0.62 -0.54 0.00 0.00 174.62 173.58 1urb s ASP 434 N -3.29 4.41 0.40 3.99 -1.08 -1.26 -1.13 116.67 118.72 1urb s ASP 434 Ca 0.40 -0.58 0.14 0.00 -0.52 0.00 0.00 52.55 51.99 1urb s ASP 434 Cb 0.04 -0.80 0.97 0.00 -1.46 0.00 0.00 42.92 41.68 1urb s ASP 434 CO 0.21 0.07 1.89 -0.61 0.52 0.00 0.00 175.17 177.26 1urb h GLN 435 N 2.56 0.50 0.00 4.34 4.15 -1.41 0.02 115.11 125.26 1urb h GLN 435 Ca -0.46 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 1urb h GLN 435 Cb 1.22 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 1urb h GLN 435 CO 0.57 0.33 -0.22 1.79 -1.93 0.00 0.00 178.83 179.36 1urb h THR 436 N 0.51 0.65 0.00 2.39 1.35 -1.85 -2.16 112.91 113.79 1urb h THR 436 Ca 0.41 -1.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.23 1urb h THR 436 Cb 0.84 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 68.91 1urb h THR 436 CO -0.16 0.22 -0.15 0.44 -0.25 0.00 0.00 175.52 175.62 1urb h ASP 437 N 0.00 0.00 -0.64 5.36 3.32 -1.31 -2.40 116.42 120.75 1urb h ASP 437 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1urb h ASP 437 Cb 0.63 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.15 1urb h ASP 437 CO 0.03 0.15 0.40 0.25 -1.72 0.00 0.00 179.24 178.36 1urb h LEU 438 N 0.00 0.77 -0.28 1.55 5.85 -1.44 0.14 115.31 121.89 1urb h LEU 438 Ca -0.00 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1urb h LEU 438 Cb 0.31 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1urb h LEU 438 CO 0.02 0.58 0.08 0.15 -0.34 0.00 0.00 178.44 178.93 1urb h PHE 439 N 0.89 0.46 -0.33 1.25 3.57 -1.48 -0.62 116.94 120.68 1urb h PHE 439 Ca 0.24 -0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.59 1urb h PHE 439 Cb -0.05 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 1urb h PHE 439 CO 0.00 0.50 -0.19 1.88 -2.23 0.00 0.00 178.31 178.27 1urb h TYR 440 N 0.29 0.68 -0.32 0.41 0.05 -1.38 -1.06 116.97 115.64 1urb h TYR 440 Ca 0.09 -0.14 -0.03 0.00 0.05 0.00 0.00 58.73 58.70 1urb h TYR 440 Cb 0.26 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 1urb h TYR 440 CO 0.01 0.76 0.07 1.15 -1.05 0.00 0.00 178.16 179.10 1urb h THR 441 N 0.55 1.22 -0.42 -2.88 2.02 -0.46 0.59 112.91 113.53 1urb h THR 441 Ca 0.09 -0.75 -0.08 0.00 0.77 0.00 0.00 66.41 66.43 1urb h THR 441 Cb 0.64 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1urb h THR 441 CO 0.05 0.25 -0.07 0.24 0.37 0.00 0.00 175.52 176.36 1urb h MET 442 N 0.36 0.78 0.13 6.66 2.86 -0.96 -0.08 114.93 124.69 1urb h MET 442 Ca 0.10 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1urb h MET 442 Cb 0.30 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1urb h MET 442 CO 0.00 0.89 -0.06 -0.22 1.06 0.00 0.00 176.91 178.58 1urb h LYS 443 N 0.60 -0.17 -0.37 1.72 3.64 -1.12 -1.38 116.57 119.49 1urb h LYS 443 Ca 0.11 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.42 1urb h LYS 443 Cb 0.58 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1urb h LYS 443 CO 0.03 -0.04 -0.09 0.00 -2.27 0.00 0.00 179.45 177.08 1urb h ALA 444 N 0.59 1.15 -0.55 5.00 0.00 -0.81 -1.80 119.26 122.84 1urb h ALA 444 Ca -0.02 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1urb h ALA 444 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1urb h ALA 444 CO 0.03 0.54 0.03 0.00 0.00 0.00 0.00 179.25 179.85 1urb h ALA 445 N 1.32 0.74 0.00 0.00 0.00 -0.80 -2.11 119.26 118.40 1urb h ALA 445 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1urb h ALA 445 Cb 0.51 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1urb h ALA 445 CO 0.03 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.09 1urb n LEU 446 N -4.30 0.00 -0.97 0.00 4.32 -0.54 -1.34 117.00 114.18 1urb n LEU 446 Ca 0.02 0.49 -0.11 0.00 -0.02 0.00 0.00 56.01 56.39 1urb n LEU 446 Cb 0.31 -0.49 -0.03 0.00 -1.62 0.00 0.00 43.42 41.58 1urb n LEU 446 CO 0.42 -0.09 -0.12 0.61 -1.22 0.00 0.00 177.39 177.00 1urb n GLY 447 N 0.94 0.84 3.78 -0.72 0.00 -0.79 -4.88 105.19 104.36 1urb n GLY 447 Ca 0.06 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 1urb n GLY 447 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1urb s LEU 448 N -2.72 2.82 0.00 0.99 2.96 -0.74 -5.03 118.68 116.97 1urb s LEU 448 Ca 0.00 1.62 0.00 0.00 -0.22 0.00 0.00 54.13 55.53 1urb s LEU 448 Cb 0.00 -4.29 0.00 0.00 0.50 0.00 0.00 46.19 42.40 1urb s LEU 448 CO 0.00 -2.01 0.44 2.29 -1.32 0.00 0.00 176.35 175.75