#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1f s THR 10 N 0.00 4.43 0.34 1.39 2.01 -1.26 -5.03 115.64 117.51 1p1f s THR 10 Ca 0.00 1.67 0.09 0.00 0.31 0.00 0.00 61.69 63.76 1p1f s THR 10 Cb 0.00 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 1p1f s THR 10 CO 0.00 -0.34 0.04 -0.44 -0.69 0.00 0.00 174.62 173.19 1p1f s SER 11 N 1.85 4.28 -0.38 3.53 0.01 -1.26 -4.78 113.70 116.96 1p1f s SER 11 Ca 0.49 -0.95 0.05 0.00 1.31 0.00 0.00 55.95 56.85 1p1f s SER 11 Cb -0.16 -0.57 0.17 0.00 0.21 0.00 0.00 66.02 65.67 1p1f s SER 11 CO 0.15 -0.26 0.51 0.54 0.41 0.00 0.00 173.24 174.59 1p1f s VAL 12 N -2.50 -0.70 -0.44 3.43 0.11 -1.26 -4.97 120.40 114.07 1p1f s VAL 12 Ca 0.35 -0.43 -0.21 0.00 -2.93 0.00 0.00 61.98 58.76 1p1f s VAL 12 Cb -0.00 -0.41 0.03 0.00 -1.53 0.00 0.00 36.38 34.47 1p1f s VAL 12 CO 0.20 -0.26 0.66 -0.75 -3.33 0.00 0.00 175.10 171.61 1p1f s LYS 13 N 1.78 3.28 -0.11 1.54 2.20 -1.26 -4.94 119.74 122.23 1p1f s LYS 13 Ca 0.16 -0.37 -0.14 0.00 -0.36 0.00 0.00 55.97 55.25 1p1f s LYS 13 Cb -0.10 -3.96 -0.05 0.00 -1.51 0.00 0.00 37.83 32.22 1p1f s LYS 13 CO -0.08 -1.03 0.34 0.08 -0.36 0.00 0.00 175.35 174.29 1p1f s VAL 14 N 2.86 5.24 -0.42 4.02 1.01 -1.26 -5.06 120.40 126.78 1p1f s VAL 14 Ca 0.23 0.65 -0.17 0.00 0.00 0.00 0.00 61.98 62.69 1p1f s VAL 14 Cb -0.14 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1p1f s VAL 14 CO 0.19 0.45 0.45 -0.69 0.00 0.00 0.00 175.10 175.50 1p1f s VAL 15 N -0.06 5.07 0.02 2.92 1.01 -1.26 -5.01 120.40 123.09 1p1f s VAL 15 Ca 0.20 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 1p1f s VAL 15 Cb -0.14 -4.05 0.07 0.00 0.00 0.00 0.00 36.38 32.26 1p1f s VAL 15 CO 0.07 -0.43 0.67 0.28 0.00 0.00 0.00 175.10 175.69 1p1f s THR 16 N 2.18 0.00 -2.15 3.92 -1.32 -1.26 -5.02 115.64 111.99 1p1f s THR 16 Ca 0.13 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.77 1p1f s THR 16 Cb -0.17 -1.00 0.40 0.00 -1.51 0.00 0.00 72.50 70.22 1p1f s THR 16 CO 0.14 0.00 1.44 -0.90 -2.21 0.00 0.00 174.62 173.09 1p1f n ASP 17 N 0.45 1.51 -0.09 8.08 5.68 -1.26 -3.54 116.55 127.38 1p1f n ASP 17 Ca -0.18 -1.79 0.12 0.00 -0.50 0.00 0.00 54.79 52.45 1p1f n ASP 17 Cb 0.60 -0.13 0.31 0.00 -1.14 0.00 0.00 41.12 40.76 1p1f n ASP 17 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1p1f n LYS 18 N 0.25 0.31 -4.83 0.11 5.02 -1.26 -4.85 118.16 112.91 1p1f n LYS 18 Ca 0.14 -0.17 -0.30 0.00 -2.02 0.00 0.00 58.31 55.96 1p1f n LYS 18 Cb 0.28 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 33.63 1p1f n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p1f s THR 20 N 0.63 1.32 -0.34 0.00 -1.32 0.27 -4.90 115.64 111.30 1p1f s THR 20 Ca -0.14 -1.04 -0.03 0.00 -1.21 0.00 0.00 61.69 59.27 1p1f s THR 20 Cb -0.16 -1.17 0.06 0.00 -1.51 0.00 0.00 72.50 69.72 1p1f s THR 20 CO 0.04 0.11 0.08 -0.31 -2.21 0.00 0.00 174.62 172.32 1p1f s TYR 21 N -0.79 3.33 -0.10 9.09 1.51 -1.26 -0.23 117.35 128.90 1p1f s TYR 21 Ca 0.04 -1.86 0.01 0.00 -1.01 0.00 0.00 57.07 54.24 1p1f s TYR 21 Cb -0.08 -2.42 0.02 0.00 -0.11 0.00 0.00 41.96 39.37 1p1f s TYR 21 CO 0.01 -0.82 -0.09 0.21 -1.11 0.00 0.00 175.55 173.75 1p1f s LYS 22 N 1.27 1.57 -1.15 -0.62 2.20 -0.94 -4.92 119.74 117.15 1p1f s LYS 22 Ca -0.01 -0.30 -0.12 0.00 -0.36 0.00 0.00 55.97 55.18 1p1f s LYS 22 Cb -0.20 -1.51 -0.02 0.00 -1.51 0.00 0.00 37.83 34.58 1p1f s LYS 22 CO -0.01 -0.16 0.81 -0.25 -0.36 0.00 0.00 175.35 175.37 1p1f n ASP 23 N 4.54 -4.67 -2.20 1.43 10.43 -1.26 -2.62 116.55 122.19 1p1f n ASP 23 Ca -0.16 -0.88 -0.21 0.00 2.57 0.00 0.00 54.79 56.11 1p1f n ASP 23 Cb 0.51 -4.06 -0.02 0.00 1.84 0.00 0.00 41.12 39.38 1p1f n ASP 23 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1p1f n ASN 24 N -2.92 -5.78 -3.94 -2.24 3.02 -1.26 -4.98 115.26 97.16 1p1f n ASN 24 Ca -0.14 0.08 -0.10 0.00 -0.03 0.00 0.00 54.58 54.39 1p1f n ASN 24 Cb 0.62 -4.85 -0.11 0.00 -0.61 0.00 0.00 39.78 34.83 1p1f n ASN 24 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1p1f s GLU 25 N -4.79 0.35 -0.20 3.52 2.02 -1.08 -1.61 118.70 116.92 1p1f s GLU 25 Ca 0.00 -0.50 -0.06 0.00 0.02 0.00 0.00 54.97 54.43 1p1f s GLU 25 Cb 0.00 0.14 -0.03 0.00 0.10 0.00 0.00 34.13 34.33 1p1f s GLU 25 CO 0.00 -0.07 0.04 -1.17 0.02 0.00 0.00 175.26 174.08 1p1f s LEU 26 N -1.34 3.57 -0.26 1.80 2.96 0.45 -2.21 118.68 123.65 1p1f s LEU 26 Ca -0.15 -0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 53.69 1p1f s LEU 26 Cb -0.09 -1.91 0.03 0.00 0.50 0.00 0.00 46.19 44.73 1p1f s LEU 26 CO -0.00 0.11 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.34 1p1f s LEU 27 N 0.74 3.37 -0.12 -0.68 1.43 0.68 -0.81 118.68 123.29 1p1f s LEU 27 Ca 0.02 -0.96 0.02 0.00 -1.03 0.00 0.00 54.13 52.19 1p1f s LEU 27 Cb -0.14 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1p1f s LEU 27 CO 0.02 -0.16 -0.19 -0.89 0.23 0.00 0.00 176.35 175.36 1p1f s THR 28 N 1.31 1.76 0.21 5.49 2.01 -0.64 0.96 115.64 126.75 1p1f s THR 28 Ca -0.01 -0.81 -0.22 0.00 0.31 0.00 0.00 61.69 60.96 1p1f s THR 28 Cb -0.17 -1.57 -0.08 0.00 0.01 0.00 0.00 72.50 70.68 1p1f s THR 28 CO -0.03 0.49 0.75 -0.54 -0.69 0.00 0.00 174.62 174.60 1p1f s LYS 29 N 0.81 4.36 -0.16 4.92 1.02 0.21 -0.76 119.74 130.15 1p1f s LYS 29 Ca -0.09 0.98 -0.15 0.00 0.02 0.00 0.00 55.97 56.73 1p1f s LYS 29 Cb -0.16 -3.00 0.04 0.00 -0.52 0.00 0.00 37.83 34.20 1p1f s LYS 29 CO 0.00 0.45 0.42 -0.47 -0.92 0.00 0.00 175.35 174.83 1p1f s TYR 30 N -1.41 -0.47 -0.50 3.18 5.04 -0.25 -4.89 117.35 118.06 1p1f s TYR 30 Ca 0.41 1.14 -0.05 0.00 -2.44 0.00 0.00 57.07 56.12 1p1f s TYR 30 Cb -0.19 0.16 0.13 0.00 0.35 0.00 0.00 41.96 42.41 1p1f s TYR 30 CO 0.23 -0.22 0.34 0.45 -1.34 0.00 0.00 175.55 175.00 1p1f s SER 31 N 0.22 5.47 -0.52 4.32 0.15 -1.26 0.05 113.70 122.13 1p1f s SER 31 Ca -0.00 -2.23 -0.28 0.00 0.70 0.00 0.00 55.95 54.14 1p1f s SER 31 Cb -0.03 -1.91 0.02 0.00 -1.71 0.00 0.00 66.02 62.39 1p1f s SER 31 CO 0.01 -0.55 1.28 -0.47 1.20 0.00 0.00 173.24 174.70 1p1f s TYR 32 N 0.87 2.53 0.09 3.44 6.14 -0.17 -4.88 117.35 125.37 1p1f s TYR 32 Ca 0.10 0.54 0.00 0.00 0.64 0.00 0.00 57.07 58.36 1p1f s TYR 32 Cb -0.23 -4.44 -0.04 0.00 0.42 0.00 0.00 41.96 37.68 1p1f s TYR 32 CO -0.03 -1.69 0.24 -1.21 0.64 0.00 0.00 175.55 173.50 1p1f s GLU 33 N 4.99 3.45 0.00 4.97 2.02 -1.26 -1.61 118.70 131.27 1p1f s GLU 33 Ca 0.50 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 55.03 1p1f s GLU 33 Cb -0.09 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 31.13 1p1f s GLU 33 CO 0.28 0.57 0.00 -1.71 0.02 0.00 0.00 175.26 174.42 1p1f n ASN 34 N 0.03 0.00 -3.59 -0.19 5.15 0.25 -4.98 115.26 111.93 1p1f n ASN 34 Ca -0.05 -0.81 -0.15 0.00 -0.60 0.00 0.00 54.58 52.97 1p1f n ASN 34 Cb 0.52 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.70 1p1f n ASN 34 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1p1f s ALA 35 N -1.00 -1.81 0.00 5.20 0.00 -1.26 0.71 121.76 123.60 1p1f s ALA 35 Ca 0.00 1.76 -0.00 0.00 0.00 0.00 0.00 51.96 53.71 1p1f s ALA 35 Cb 0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1p1f s ALA 35 CO 0.00 -0.34 0.09 0.08 0.00 0.00 0.00 175.76 175.59 1p1f s VAL 36 N -0.24 4.77 0.14 0.00 1.01 -0.01 -4.90 120.40 121.17 1p1f s VAL 36 Ca -0.03 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1p1f s VAL 36 Cb -0.03 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 1p1f s VAL 36 CO 0.03 0.33 -0.15 -0.69 0.00 0.00 0.00 175.10 174.62 1p1f s VAL 37 N -1.22 1.49 -0.12 2.92 1.01 -1.26 0.18 120.40 123.41 1p1f s VAL 37 Ca 0.24 -1.86 -0.07 0.00 0.00 0.00 0.00 61.98 60.30 1p1f s VAL 37 Cb -0.12 -1.70 0.05 0.00 0.00 0.00 0.00 36.38 34.61 1p1f s VAL 37 CO 0.15 -0.44 0.28 -0.89 0.00 0.00 0.00 175.10 174.20 1p1f s THR 38 N -2.31 -0.03 0.00 3.92 2.01 -0.80 -4.96 115.64 113.47 1p1f s THR 38 Ca 0.13 0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.24 1p1f s THR 38 Cb -0.04 -0.43 0.00 0.00 0.01 0.00 0.00 72.50 72.04 1p1f s THR 38 CO 0.04 0.05 0.00 1.17 -0.69 0.00 0.00 174.62 175.19 1p1f n LYS 39 N 4.05 0.34 -3.57 4.92 3.00 -1.26 0.04 118.16 125.69 1p1f n LYS 39 Ca -0.23 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 57.93 1p1f n LYS 39 Cb 0.54 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.51 1p1f n LYS 39 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1p1f s THR 40 N -0.48 0.02 0.49 3.15 -4.23 -1.05 -4.78 115.64 108.77 1p1f s THR 40 Ca 0.00 -0.19 0.27 0.00 -1.18 0.00 0.00 61.69 60.59 1p1f s THR 40 Cb 0.00 -0.95 0.45 0.00 1.34 0.00 0.00 72.50 73.34 1p1f s THR 40 CO 0.00 -0.10 1.87 0.00 -0.54 0.00 0.00 174.62 175.85 1p1f h ALA 41 N 2.90 2.62 -0.00 3.99 0.00 -2.00 1.43 119.26 128.21 1p1f h ALA 41 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1p1f h ALA 41 Cb 1.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1p1f h ALA 41 CO 0.40 -0.89 -0.15 -1.13 0.00 0.00 0.00 179.25 177.48 1p1f n SER 42 N -4.36 0.20 -0.47 0.00 3.41 -1.26 -4.94 113.62 106.20 1p1f n SER 42 Ca 0.19 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1p1f n SER 42 Cb 0.88 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 1p1f n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p1f n GLY 43 N 1.45 0.83 3.43 5.00 0.00 0.49 -5.08 105.19 111.32 1p1f n GLY 43 Ca 0.08 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1p1f n GLY 43 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1p1f s ARG 44 N -3.36 3.17 -0.33 1.61 3.52 -1.25 -4.84 118.95 117.47 1p1f s ARG 44 Ca 0.00 -0.65 -0.17 0.00 -0.13 0.00 0.00 55.73 54.78 1p1f s ARG 44 Cb 0.00 -2.61 -0.01 0.00 -1.56 0.00 0.00 34.95 30.77 1p1f s ARG 44 CO 0.00 0.35 0.47 -0.06 -0.81 0.00 0.00 175.30 175.25 1p1f s PHE 45 N -0.00 3.20 -0.45 5.12 0.40 -1.26 -2.52 117.98 122.47 1p1f s PHE 45 Ca -0.03 0.24 -0.17 0.00 -0.60 0.00 0.00 56.93 56.38 1p1f s PHE 45 Cb -0.14 -2.81 0.04 0.00 0.51 0.00 0.00 43.02 40.62 1p1f s PHE 45 CO 0.04 -0.45 0.46 -0.51 0.70 0.00 0.00 175.22 175.46 1p1f s ASP 46 N 1.71 6.18 -0.30 1.36 1.01 0.11 -4.92 116.67 121.82 1p1f s ASP 46 Ca 0.17 -0.90 -0.14 0.00 0.71 0.00 0.00 52.55 52.40 1p1f s ASP 46 Cb -0.16 -2.22 -0.03 0.00 1.01 0.00 0.00 42.92 41.52 1p1f s ASP 46 CO 0.12 -0.65 0.33 -0.69 0.21 0.00 0.00 175.17 174.49 1p1f s VAL 47 N 2.10 5.20 -0.32 -1.27 1.01 -1.26 -1.90 120.40 123.95 1p1f s VAL 47 Ca 0.10 0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.38 1p1f s VAL 47 Cb -0.19 -3.72 0.08 0.00 0.00 0.00 0.00 36.38 32.55 1p1f s VAL 47 CO 0.11 0.07 0.01 0.28 0.00 0.00 0.00 175.10 175.58 1p1f s THR 48 N 1.99 2.48 0.99 3.92 -1.32 0.13 -4.97 115.64 118.86 1p1f s THR 48 Ca 0.12 -1.96 -0.16 0.00 -1.21 0.00 0.00 61.69 58.49 1p1f s THR 48 Cb -0.16 -2.64 -0.03 0.00 -1.51 0.00 0.00 72.50 68.16 1p1f s THR 48 CO 0.11 -0.37 -0.15 -2.65 -2.21 0.00 0.00 174.62 169.35 1p1f n PRO 49 N 4.40 -0.32 -3.69 7.08 -0.02 -1.26 -0.83 135.00 140.36 1p1f n PRO 49 Ca -0.05 -0.07 -0.14 0.00 -2.02 0.00 0.00 63.50 61.22 1p1f n PRO 49 Cb 0.42 -1.51 -0.14 0.00 -0.02 0.00 0.00 33.50 32.25 1p1f n PRO 49 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1p1f s THR 50 N -2.23 -0.24 -0.01 3.45 2.01 0.22 -4.65 115.64 114.20 1p1f s THR 50 Ca 0.50 0.26 0.07 0.00 0.31 0.00 0.00 61.69 62.83 1p1f s THR 50 Cb -0.17 -0.36 -0.02 0.00 0.01 0.00 0.00 72.50 71.96 1p1f s THR 50 CO 0.72 0.11 -0.22 0.54 -0.69 0.00 0.00 174.62 175.08 1p1f s VAL 51 N 1.97 1.74 -0.19 3.82 0.11 -1.26 0.84 120.40 127.43 1p1f s VAL 51 Ca -0.02 -0.99 -0.08 0.00 -2.93 0.00 0.00 61.98 57.96 1p1f s VAL 51 Cb -0.12 -1.45 0.08 0.00 -1.53 0.00 0.00 36.38 33.36 1p1f s VAL 51 CO -0.07 0.45 0.41 -1.58 -3.33 0.00 0.00 175.10 170.97 1p1f s GLN 52 N -0.63 0.34 0.16 1.54 2.00 -0.63 -5.00 119.66 117.43 1p1f s GLN 52 Ca 0.08 0.94 -0.14 0.00 -2.00 0.00 0.00 55.36 54.24 1p1f s GLN 52 Cb -0.09 0.19 -0.07 0.00 0.80 0.00 0.00 33.01 33.85 1p1f s GLN 52 CO -0.00 -0.22 0.56 -0.51 -0.50 0.00 0.00 175.29 174.62 1p1f s ASP 53 N 2.19 6.83 0.17 6.67 -0.00 -1.26 -1.00 116.67 130.27 1p1f s ASP 53 Ca -0.04 1.10 0.01 0.00 -0.00 0.00 0.00 52.55 53.62 1p1f s ASP 53 Cb -0.11 -2.30 -0.05 0.00 -0.00 0.00 0.00 42.92 40.47 1p1f s ASP 53 CO -0.13 0.08 0.01 -0.31 -0.00 0.00 0.00 175.17 174.83 1p1f s TYR 54 N -1.50 1.19 -0.28 4.23 1.51 0.11 -0.15 117.35 122.46 1p1f s TYR 54 Ca 0.39 -1.05 -0.04 0.00 -1.01 0.00 0.00 57.07 55.36 1p1f s TYR 54 Cb -0.15 -0.68 0.10 0.00 -0.11 0.00 0.00 41.96 41.12 1p1f s TYR 54 CO 0.19 -0.25 0.13 0.08 -1.11 0.00 0.00 175.55 174.59 1p1f s VAL 55 N -3.70 -0.06 0.32 0.71 1.01 -0.97 -1.09 120.40 116.62 1p1f s VAL 55 Ca 0.25 -0.70 -0.15 0.00 0.00 0.00 0.00 61.98 61.37 1p1f s VAL 55 Cb 0.06 -0.94 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 1p1f s VAL 55 CO 0.04 -0.68 0.73 -0.36 0.00 0.00 0.00 175.10 174.83 1p1f s PHE 56 N 2.10 3.38 -0.07 5.22 0.08 0.06 -2.56 117.98 126.19 1p1f s PHE 56 Ca 0.08 1.21 0.01 0.00 0.12 0.00 0.00 56.93 58.35 1p1f s PHE 56 Cb -0.16 -2.53 0.02 0.00 -0.57 0.00 0.00 43.02 39.78 1p1f s PHE 56 CO -0.34 0.11 -0.07 0.21 -0.10 0.00 0.00 175.22 175.02 1p1f s LYS 57 N -2.94 1.27 -0.26 0.44 2.20 0.38 -1.61 119.74 119.23 1p1f s LYS 57 Ca 0.54 -0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.92 1p1f s LYS 57 Cb -0.10 -1.23 0.04 0.00 -1.51 0.00 0.00 37.83 35.03 1p1f s LYS 57 CO 0.18 -0.11 -0.08 -1.17 -0.36 0.00 0.00 175.35 173.80 1p1f s LEU 58 N 1.13 3.34 -0.24 5.43 0.20 0.01 0.03 118.68 128.58 1p1f s LEU 58 Ca -0.07 -1.15 -0.29 0.00 0.69 0.00 0.00 54.13 53.31 1p1f s LEU 58 Cb -0.14 -1.61 -0.03 0.00 -0.43 0.00 0.00 46.19 43.98 1p1f s LEU 58 CO -0.01 -0.17 1.87 -0.62 -0.29 0.00 0.00 176.35 177.12 1p1f s ASP 59 N 1.21 5.97 0.26 3.68 -1.08 -0.05 -0.41 116.67 126.26 1p1f s ASP 59 Ca -0.04 1.66 0.11 0.00 -0.52 0.00 0.00 52.55 53.76 1p1f s ASP 59 Cb -0.18 -2.52 0.30 0.00 -1.46 0.00 0.00 42.92 39.05 1p1f s ASP 59 CO -0.05 -1.58 1.57 -0.07 0.52 0.00 0.00 175.17 175.56 1p1f h LEU 60 N 13.17 0.00 -8.21 -1.34 3.38 -1.64 -3.41 115.31 117.27 1p1f h LEU 60 Ca -0.37 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.42 1p1f h LEU 60 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1p1f h LEU 60 CO 1.00 0.65 0.48 -0.54 0.09 0.00 0.00 178.44 180.11 1p1f s LYS 61 N -3.46 2.08 0.42 1.13 1.02 -1.23 -4.90 119.74 114.80 1p1f s LYS 61 Ca -0.01 -0.19 -0.22 0.00 0.02 0.00 0.00 55.97 55.57 1p1f s LYS 61 Cb 0.12 -4.99 -0.09 0.00 -0.52 0.00 0.00 37.83 32.34 1p1f s LYS 61 CO 0.76 -4.05 1.01 -1.59 -0.92 0.00 0.00 175.35 170.56 1p1f s LYS 62 N 7.69 4.11 0.44 1.68 -2.85 -1.26 -4.99 119.74 124.57 1p1f s LYS 62 Ca 0.78 1.36 -0.25 0.00 -1.00 0.00 0.00 55.97 56.85 1p1f s LYS 62 Cb -0.08 -2.35 -0.08 0.00 -2.06 0.00 0.00 37.83 33.26 1p1f s LYS 62 CO 0.06 -0.16 1.43 -1.25 0.10 0.00 0.00 175.35 175.53 1p1f s PRO 63 N -2.84 3.72 0.41 1.78 0.04 -1.26 -4.93 135.00 131.93 1p1f s PRO 63 Ca 0.61 2.42 0.20 0.00 0.04 0.00 0.00 61.00 64.26 1p1f s PRO 63 Cb -0.17 -2.68 0.90 0.00 0.04 0.00 0.00 34.50 32.59 1p1f s PRO 63 CO 0.21 -0.79 1.85 0.93 0.04 0.00 0.00 177.00 179.24 1p1f h GLU 64 N 2.38 0.00 -3.14 4.56 5.08 -1.97 -3.42 114.58 118.06 1p1f h GLU 64 Ca -0.51 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.64 1p1f h GLU 64 Cb 1.26 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.21 1p1f h GLU 64 CO 0.61 0.30 -0.53 0.15 -1.00 0.00 0.00 179.01 178.54 1p1f s LYS 65 N -3.90 0.16 -0.34 2.33 -0.14 -1.26 -4.94 119.74 111.65 1p1f s LYS 65 Ca -0.01 0.44 -0.10 0.00 -1.36 0.00 0.00 55.97 54.94 1p1f s LYS 65 Cb 0.12 -0.13 0.01 0.00 -1.68 0.00 0.00 37.83 36.16 1p1f s LYS 65 CO 0.67 -0.15 0.17 -1.17 -0.76 0.00 0.00 175.35 174.11 1p1f s LEU 66 N 1.12 4.38 0.12 3.17 0.20 -0.76 -4.62 118.68 122.28 1p1f s LEU 66 Ca -0.08 -0.77 -0.31 0.00 0.69 0.00 0.00 54.13 53.66 1p1f s LEU 66 Cb -0.10 -2.00 -0.08 0.00 -0.43 0.00 0.00 46.19 43.58 1p1f s LEU 66 CO -0.07 -0.29 1.35 -0.83 -0.29 0.00 0.00 176.35 176.23 1p1f s GLY 67 N 1.57 2.09 -0.05 7.98 0.00 -0.37 -0.94 107.32 117.60 1p1f s GLY 67 Ca 0.03 1.08 0.02 0.00 0.00 0.00 0.00 44.72 45.84 1p1f s GLY 67 CO 0.06 2.27 -0.07 -0.42 0.00 0.00 0.00 173.10 174.93 1p1f s ILE 68 N 0.98 0.76 -0.18 0.90 1.01 -0.66 -1.01 121.20 123.00 1p1f s ILE 68 Ca 0.63 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 61.02 1p1f s ILE 68 Cb -0.36 -0.74 0.04 0.00 0.01 0.00 0.00 42.46 41.42 1p1f s ILE 68 CO 0.31 0.27 -0.08 -0.04 0.00 0.00 0.00 174.94 175.40 1p1f s MET 69 N 0.80 1.74 0.04 2.79 -1.94 -0.86 -1.03 119.30 120.84 1p1f s MET 69 Ca -0.13 -0.66 -0.01 0.00 -1.71 0.00 0.00 55.69 53.19 1p1f s MET 69 Cb -0.15 -2.18 -0.04 0.00 2.01 0.00 0.00 34.83 34.47 1p1f s MET 69 CO 0.02 -0.42 0.20 -0.51 -0.01 0.00 0.00 175.02 174.30 1p1f s LEU 70 N 1.52 4.36 -0.41 -0.03 1.02 -0.09 -2.50 118.68 122.55 1p1f s LEU 70 Ca 0.00 0.29 -0.05 0.00 0.02 0.00 0.00 54.13 54.39 1p1f s LEU 70 Cb -0.15 -2.85 0.10 0.00 0.02 0.00 0.00 46.19 43.30 1p1f s LEU 70 CO -0.08 0.20 0.21 -0.63 0.02 0.00 0.00 176.35 176.07 1p1f s ILE 71 N -1.45 3.59 0.00 -0.59 1.01 -0.94 0.11 121.20 122.93 1p1f s ILE 71 Ca 0.33 -1.81 0.00 0.00 0.00 0.00 0.00 60.65 59.17 1p1f s ILE 71 Cb -0.13 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.00 1p1f s ILE 71 CO 0.25 -0.60 0.00 0.61 0.00 0.00 0.00 174.94 175.20 1p1f n GLY 72 N 4.71 1.92 0.34 6.18 0.00 -0.67 0.14 105.19 117.81 1p1f n GLY 72 Ca -0.06 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.14 1p1f n GLY 72 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p1f h LEU 73 N 0.00 0.00 -2.51 0.99 5.85 -1.53 0.18 115.31 118.28 1p1f h LEU 73 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1p1f h LEU 73 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1p1f h LEU 73 CO 0.00 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.71 1p1f n GLY 74 N -1.39 2.11 2.56 3.75 0.00 -1.26 -2.98 105.19 107.97 1p1f n GLY 74 Ca 0.02 -0.76 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 1p1f n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p1f n GLY 75 N 1.59 -1.52 0.13 -0.02 0.00 0.05 -4.78 105.19 100.64 1p1f n GLY 75 Ca 0.22 -1.67 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 1p1f n GLY 75 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1p1f h ASN 76 N -1.27 -0.23 -0.04 1.61 -0.26 -1.91 -2.53 115.58 110.95 1p1f h ASN 76 Ca -0.29 0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.43 1p1f h ASN 76 Cb 0.80 0.09 0.00 0.00 -1.06 0.00 0.00 38.32 38.15 1p1f h ASN 76 CO 0.20 -0.13 -0.18 0.78 -1.06 0.00 0.00 177.43 177.04 1p1f h ASN 77 N -0.16 0.24 -0.67 5.81 -0.26 -1.90 -2.17 115.58 116.47 1p1f h ASN 77 Ca 0.02 -0.64 0.12 0.00 -0.56 0.00 0.00 56.30 55.24 1p1f h ASN 77 Cb 0.19 -0.07 -0.09 0.00 -1.06 0.00 0.00 38.32 37.29 1p1f h ASN 77 CO -0.06 0.84 0.21 1.23 -1.06 0.00 0.00 177.43 178.59 1p1f h GLY 78 N -0.35 0.94 0.85 2.83 0.00 -1.70 0.85 103.07 106.47 1p1f h GLY 78 Ca -0.01 -0.08 -0.12 0.00 0.00 0.00 0.00 47.33 47.11 1p1f h GLY 78 CO 0.04 -0.10 -0.39 1.48 0.00 0.00 0.00 176.54 177.57 1p1f h SER 79 N 0.35 0.58 -0.88 0.19 4.64 -1.34 -2.24 113.55 114.85 1p1f h SER 79 Ca 0.36 -0.59 0.03 0.00 -0.47 0.00 0.00 61.79 61.11 1p1f h SER 79 Cb 0.53 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 62.40 1p1f h SER 79 CO -0.40 1.07 0.58 0.74 -0.87 0.00 0.00 176.83 177.95 1p1f h THR 80 N 0.12 1.17 0.25 2.95 2.02 -0.73 0.21 112.91 118.90 1p1f h THR 80 Ca -0.01 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1p1f h THR 80 Cb 1.01 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 1p1f h THR 80 CO 0.08 0.20 -0.26 0.25 0.37 0.00 0.00 175.52 176.17 1p1f h LEU 81 N 1.12 -0.71 -1.05 2.58 7.12 0.84 -0.74 115.31 124.48 1p1f h LEU 81 Ca 0.34 0.07 -0.02 0.00 0.13 0.00 0.00 57.88 58.39 1p1f h LEU 81 Cb -0.03 0.25 -0.04 0.00 -0.53 0.00 0.00 40.66 40.31 1p1f h LEU 81 CO -0.09 -0.38 0.38 0.58 -0.13 0.00 0.00 178.44 178.80 1p1f h VAL 82 N -0.55 1.23 0.62 1.05 2.07 -0.76 -2.63 116.25 117.28 1p1f h VAL 82 Ca -0.00 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 1p1f h VAL 82 Cb 0.51 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1p1f h VAL 82 CO -0.07 0.27 -0.51 0.00 0.02 0.00 0.00 177.57 177.28 1p1f h ALA 83 N 1.37 -1.21 -0.97 1.67 0.00 -0.09 -1.93 119.26 118.10 1p1f h ALA 83 Ca 0.26 -0.22 0.22 0.00 0.00 0.00 0.00 54.91 55.17 1p1f h ALA 83 Cb 0.07 0.69 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1p1f h ALA 83 CO -0.04 -1.21 0.63 0.66 0.00 0.00 0.00 179.25 179.29 1p1f h SER 84 N -1.10 0.50 -0.13 0.00 4.64 -1.02 0.45 113.55 116.89 1p1f h SER 84 Ca -0.08 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1p1f h SER 84 Cb 0.92 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1p1f h SER 84 CO 0.00 0.17 -0.05 0.58 -0.87 0.00 0.00 176.83 176.66 1p1f h VAL 85 N 0.48 1.30 -0.22 0.95 2.07 -1.18 0.53 116.25 120.19 1p1f h VAL 85 Ca 0.53 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1p1f h VAL 85 Cb 1.22 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 1p1f h VAL 85 CO -0.25 0.30 0.10 -0.07 0.02 0.00 0.00 177.57 177.66 1p1f h LEU 86 N -0.05 0.29 0.59 2.57 4.07 -0.26 0.48 115.31 123.00 1p1f h LEU 86 Ca 0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 1p1f h LEU 86 Cb 0.49 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1p1f h LEU 86 CO 0.02 0.36 -0.46 0.00 -1.08 0.00 0.00 178.44 177.28 1p1f h ALA 87 N 0.95 -1.09 -0.39 1.53 0.00 -0.16 -1.74 119.26 118.36 1p1f h ALA 87 Ca 0.07 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1p1f h ALA 87 Cb 0.15 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1p1f h ALA 87 CO -0.01 -1.14 -0.27 -0.91 0.00 0.00 0.00 179.25 176.92 1p1f h ASN 88 N -1.02 0.84 -0.88 0.00 4.21 -0.86 0.54 115.58 118.42 1p1f h ASN 88 Ca -0.07 -0.33 -0.00 0.00 1.21 0.00 0.00 56.30 57.11 1p1f h ASN 88 Cb 0.85 -0.23 -0.04 0.00 -1.12 0.00 0.00 38.32 37.78 1p1f h ASN 88 CO 0.01 1.07 0.55 0.50 -1.29 0.00 0.00 177.43 178.27 1p1f h LYS 89 N 0.70 1.18 -0.60 0.81 3.64 0.02 -2.80 116.57 119.52 1p1f h LYS 89 Ca 0.08 -0.10 -0.33 0.00 -1.27 0.00 0.00 60.65 59.04 1p1f h LYS 89 Cb 0.81 -0.25 -0.20 0.00 -0.41 0.00 0.00 32.23 32.18 1p1f h LYS 89 CO 0.07 0.82 0.16 0.72 -2.27 0.00 0.00 179.45 178.94 1p1f n HIS 90 N -4.43 1.89 -3.89 1.91 8.25 -0.66 -4.97 115.22 113.33 1p1f n HIS 90 Ca 0.09 -1.81 -0.25 0.00 -0.26 0.00 0.00 57.72 55.50 1p1f n HIS 90 Cb 0.04 -0.68 0.00 0.00 1.12 0.00 0.00 29.99 30.47 1p1f n HIS 90 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1p1f n ASN 91 N -1.10 -1.94 -4.42 0.41 5.03 -0.55 -4.80 115.26 107.88 1p1f n ASN 91 Ca 0.44 -0.71 -0.44 0.00 0.87 0.00 0.00 54.58 54.74 1p1f n ASN 91 Cb 1.20 -0.85 -0.03 0.00 -1.02 0.00 0.00 39.78 39.08 1p1f n ASN 91 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 1p1f s VAL 92 N -4.17 4.77 0.97 2.41 -7.23 0.07 -4.93 120.40 112.29 1p1f s VAL 92 Ca 0.24 -1.32 -0.11 0.00 -1.81 0.00 0.00 61.98 58.98 1p1f s VAL 92 Cb -0.14 -4.67 0.18 0.00 0.56 0.00 0.00 36.38 32.31 1p1f s VAL 92 CO 0.53 -1.37 1.10 -1.83 -0.31 0.00 0.00 175.10 173.22 1p1f s GLU 93 N 2.68 0.57 0.22 4.82 -1.05 -1.26 -4.52 118.70 120.15 1p1f s GLU 93 Ca 0.25 1.26 -0.11 0.00 -0.15 0.00 0.00 54.97 56.22 1p1f s GLU 93 Cb -0.12 -1.70 -0.01 0.00 -0.44 0.00 0.00 34.13 31.87 1p1f s GLU 93 CO -0.02 -2.84 0.38 -0.59 0.95 0.00 0.00 175.26 173.14 1p1f s PHE 94 N -2.64 0.44 -0.05 4.83 -0.71 -0.96 -4.97 117.98 113.93 1p1f s PHE 94 Ca 0.66 -0.78 -0.05 0.00 -1.04 0.00 0.00 56.93 55.72 1p1f s PHE 94 Cb -0.23 0.04 -0.04 0.00 -1.21 0.00 0.00 43.02 41.58 1p1f s PHE 94 CO 0.60 -0.87 0.19 -0.65 -1.34 0.00 0.00 175.22 173.15 1p1f s GLN 95 N -4.01 3.48 0.18 1.99 -1.52 -1.26 -0.66 119.66 117.86 1p1f s GLN 95 Ca 0.22 -0.18 0.02 0.00 -1.95 0.00 0.00 55.36 53.47 1p1f s GLN 95 Cb 0.01 -3.13 -0.05 0.00 -0.22 0.00 0.00 33.01 29.63 1p1f s GLN 95 CO 0.06 0.71 0.02 0.99 -0.25 0.00 0.00 175.29 176.82 1p1f s THR 96 N -1.20 0.62 -1.67 -0.19 2.01 -0.83 -4.59 115.64 109.78 1p1f s THR 96 Ca 0.23 -1.98 0.12 0.00 0.31 0.00 0.00 61.69 60.37 1p1f s THR 96 Cb -0.13 -2.16 0.27 0.00 0.01 0.00 0.00 72.50 70.49 1p1f s THR 96 CO 0.13 -0.43 1.24 2.29 -0.69 0.00 0.00 174.62 177.15 1p1f n LYS 97 N -0.25 0.26 -0.00 4.92 2.85 -1.26 -0.33 118.16 124.35 1p1f n LYS 97 Ca -0.06 0.10 0.09 0.00 -1.05 0.00 0.00 58.31 57.40 1p1f n LYS 97 Cb 0.64 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 33.39 1p1f n LYS 97 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1p1f n GLU 98 N -1.16 0.69 0.00 -1.58 4.71 -1.26 -5.10 120.64 116.93 1p1f n GLU 98 Ca 0.07 -0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1p1f n GLU 98 Cb 0.07 -1.42 0.00 0.00 -1.01 0.00 0.00 31.44 29.08 1p1f n GLU 98 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1p1f n GLY 99 N 1.43 0.53 3.64 0.62 0.00 0.55 -4.98 105.19 106.98 1p1f n GLY 99 Ca 0.01 -2.32 -0.42 0.00 0.00 0.00 0.00 46.02 43.29 1p1f n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p1f s VAL 100 N -0.85 3.48 0.15 1.61 0.11 -1.26 -1.96 120.40 121.68 1p1f s VAL 100 Ca 0.00 0.57 0.03 0.00 -2.93 0.00 0.00 61.98 59.65 1p1f s VAL 100 Cb 0.00 -3.43 -0.04 0.00 -1.53 0.00 0.00 36.38 31.38 1p1f s VAL 100 CO 0.00 -0.13 0.25 -0.54 -3.33 0.00 0.00 175.10 171.35 1p1f s LYS 101 N 4.54 3.31 -0.02 1.54 -0.14 0.17 -4.92 119.74 124.21 1p1f s LYS 101 Ca 0.78 -0.66 -0.00 0.00 -1.36 0.00 0.00 55.97 54.73 1p1f s LYS 101 Cb -0.32 -2.89 -0.04 0.00 -1.68 0.00 0.00 37.83 32.90 1p1f s LYS 101 CO 0.32 0.52 0.03 -0.65 -0.76 0.00 0.00 175.35 174.80 1p1f s GLN 102 N -3.18 2.93 0.51 1.68 -1.52 -1.26 -2.27 119.66 116.55 1p1f s GLN 102 Ca 0.34 -0.52 -0.22 0.00 -1.95 0.00 0.00 55.36 53.01 1p1f s GLN 102 Cb -0.11 -2.77 -0.06 0.00 -0.22 0.00 0.00 33.01 29.85 1p1f s GLN 102 CO 0.27 0.65 1.26 -2.14 -0.25 0.00 0.00 175.29 175.09 1p1f s PRO 103 N -1.47 3.43 0.06 2.91 0.02 -1.26 -5.02 135.00 133.67 1p1f s PRO 103 Ca 0.19 2.01 -0.02 0.00 0.02 0.00 0.00 61.00 63.20 1p1f s PRO 103 Cb -0.12 -2.32 0.01 0.00 0.02 0.00 0.00 34.50 32.09 1p1f s PRO 103 CO 0.10 -0.89 0.11 0.27 -0.33 0.00 0.00 177.00 176.25 1p1f n ASN 104 N -0.79 -0.31 -0.88 2.53 6.94 -1.26 -4.91 115.26 116.58 1p1f n ASN 104 Ca 0.09 -1.25 0.05 0.00 -0.02 0.00 0.00 54.58 53.45 1p1f n ASN 104 Cb 0.47 0.53 0.10 0.00 -2.36 0.00 0.00 39.78 38.51 1p1f n ASN 104 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1p1f n TYR 105 N -0.08 0.00 -1.56 -2.53 4.01 -1.26 -4.90 117.16 110.83 1p1f n TYR 105 Ca -0.01 -0.85 -0.49 0.00 -0.16 0.00 0.00 57.90 56.38 1p1f n TYR 105 Cb 0.09 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 38.90 1p1f n TYR 105 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1p1f n PHE 106 N -0.37 1.12 0.00 -0.72 0.99 -1.26 -0.05 117.46 117.16 1p1f n PHE 106 Ca 0.11 0.73 0.00 0.00 -0.00 0.00 0.00 57.45 58.29 1p1f n PHE 106 Cb 0.87 -2.24 0.00 0.00 -1.00 0.00 0.00 39.48 37.11 1p1f n PHE 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1p1f n GLY 107 N 1.95 2.69 3.56 1.37 0.00 -1.26 -4.88 105.19 108.62 1p1f n GLY 107 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1p1f n GLY 107 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1f s SER 108 N -1.42 6.49 0.34 1.61 0.15 0.93 -4.47 113.70 117.32 1p1f s SER 108 Ca 0.00 0.10 0.10 0.00 0.70 0.00 0.00 55.95 56.86 1p1f s SER 108 Cb 0.00 -2.42 0.62 0.00 -1.71 0.00 0.00 66.02 62.51 1p1f s SER 108 CO 0.00 -0.95 1.78 -0.03 1.20 0.00 0.00 173.24 175.24 1p1f h MET 109 N 8.92 0.10 0.00 5.44 4.05 -1.87 0.33 114.93 131.90 1p1f h MET 109 Ca -0.24 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.14 1p1f h MET 109 Cb 1.08 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.88 1p1f h MET 109 CO 0.99 0.47 -0.25 1.79 0.23 0.00 0.00 176.91 180.13 1p1f h THR 110 N 0.08 0.00 0.00 -0.77 1.35 -1.91 -3.05 112.91 108.62 1p1f h THR 110 Ca 0.01 -0.74 -0.27 0.00 -0.55 0.00 0.00 66.41 64.86 1p1f h THR 110 Cb 0.71 1.60 -0.05 0.00 -1.73 0.00 0.00 68.15 68.68 1p1f h THR 110 CO 0.05 0.00 -2.03 0.00 -0.25 0.00 0.00 175.52 173.30 1p1f n GLN 111 N -2.59 0.78 -0.42 4.72 1.13 -1.05 -3.30 117.38 116.65 1p1f n GLN 111 Ca 0.04 0.08 0.06 0.00 -1.94 0.00 0.00 57.00 55.24 1p1f n GLN 111 Cb 0.48 -1.37 0.19 0.00 0.11 0.00 0.00 30.24 29.65 1p1f n GLN 111 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1p1f s SER 113 N -2.93 3.01 0.11 0.00 0.15 -1.15 -4.93 113.70 107.95 1p1f s SER 113 Ca 0.37 -0.73 0.10 0.00 0.70 0.00 0.00 55.95 56.39 1p1f s SER 113 Cb 0.34 -0.19 -0.04 0.00 -1.71 0.00 0.00 66.02 64.42 1p1f s SER 113 CO -0.01 0.13 -0.26 0.42 1.20 0.00 0.00 173.24 174.72 1p1f s THR 114 N -1.13 2.13 0.06 6.45 -4.23 -1.26 -0.35 115.64 117.30 1p1f s THR 114 Ca 0.11 -1.64 0.07 0.00 -1.18 0.00 0.00 61.69 59.05 1p1f s THR 114 Cb -0.10 -1.88 -0.03 0.00 1.34 0.00 0.00 72.50 71.83 1p1f s THR 114 CO 0.05 0.12 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.32 1p1f s LEU 115 N -1.87 2.70 -0.14 4.79 1.43 0.16 -4.77 118.68 120.98 1p1f s LEU 115 Ca 0.12 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.55 1p1f s LEU 115 Cb -0.10 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 1p1f s LEU 115 CO 0.05 0.24 0.78 -0.75 0.23 0.00 0.00 176.35 176.90 1p1f s LYS 116 N -1.62 4.34 0.01 1.70 2.20 -1.26 -0.74 119.74 124.36 1p1f s LYS 116 Ca 0.16 0.96 0.24 0.00 -0.36 0.00 0.00 55.97 56.97 1p1f s LYS 116 Cb -0.11 -3.53 0.31 0.00 -1.51 0.00 0.00 37.83 32.99 1p1f s LYS 116 CO 0.07 -0.20 1.27 1.28 -0.36 0.00 0.00 175.35 177.41 1p1f n LEU 117 N 4.76 0.62 0.00 5.43 4.77 -0.35 -4.97 117.00 127.26 1p1f n LEU 117 Ca 0.02 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1p1f n LEU 117 Cb 0.50 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1p1f n LEU 117 CO 0.48 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1p1f n GLY 118 N 1.48 0.68 3.87 -0.72 0.00 -1.24 -5.01 105.19 104.25 1p1f n GLY 118 Ca 0.05 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.22 1p1f n GLY 118 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1f s ILE 119 N -3.60 2.52 0.00 -0.61 -4.36 -1.26 -0.49 121.20 113.40 1p1f s ILE 119 Ca 0.00 -1.38 0.00 0.00 -0.26 0.00 0.00 60.65 59.01 1p1f s ILE 119 Cb 0.00 -2.90 0.00 0.00 1.25 0.00 0.00 42.46 40.81 1p1f s ILE 119 CO 0.00 0.00 0.00 -0.90 0.24 0.00 0.00 174.94 174.28 1p1f n ASP 120 N -1.56 0.73 -0.73 4.36 5.75 -1.13 -4.74 116.55 119.23 1p1f n ASP 120 Ca 0.03 -0.14 0.00 0.00 -0.01 0.00 0.00 54.79 54.67 1p1f n ASP 120 Cb 0.62 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 1p1f n ASP 120 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1p1f n ALA 121 N -3.00 1.32 -1.45 2.12 0.00 -1.26 -2.83 120.51 115.42 1p1f n ALA 121 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1p1f n ALA 121 Cb 0.00 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 1p1f n ALA 121 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1p1f n GLU 122 N 0.69 0.00 -1.13 0.00 0.28 -1.26 -5.00 120.64 114.22 1p1f n GLU 122 Ca 0.00 -0.01 -0.05 0.00 -0.16 0.00 0.00 57.16 56.95 1p1f n GLU 122 Cb 0.03 0.45 -0.02 0.00 1.43 0.00 0.00 31.44 33.32 1p1f n GLU 122 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1p1f n GLY 123 N 0.00 0.73 3.29 -1.84 0.00 -1.13 -5.00 105.19 101.24 1p1f n GLY 123 Ca -0.00 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 1p1f n GLY 123 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p1f s ASN 124 N -2.70 5.75 0.06 1.61 -0.87 -1.26 -4.82 114.94 112.70 1p1f s ASN 124 Ca 0.00 -1.50 -0.15 0.00 -1.57 0.00 0.00 52.86 49.64 1p1f s ASN 124 Cb 0.00 -2.03 -0.08 0.00 -0.02 0.00 0.00 41.25 39.12 1p1f s ASN 124 CO 0.00 -0.57 0.34 0.47 -2.57 0.00 0.00 177.10 174.77 1p1f n ASP 125 N 4.98 -0.35 -4.07 -1.22 10.43 -1.26 -2.83 116.55 122.23 1p1f n ASP 125 Ca -0.10 0.53 -0.31 0.00 2.57 0.00 0.00 54.79 57.48 1p1f n ASP 125 Cb 0.43 -0.44 -0.16 0.00 1.84 0.00 0.00 41.12 42.79 1p1f n ASP 125 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1p1f s VAL 126 N -0.28 1.73 0.06 2.53 1.01 0.35 -4.80 120.40 121.00 1p1f s VAL 126 Ca 0.35 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.61 1p1f s VAL 126 Cb -0.50 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1p1f s VAL 126 CO 0.26 0.49 0.04 -0.31 0.00 0.00 0.00 175.10 175.58 1p1f s TYR 127 N 1.23 3.11 0.15 5.22 1.51 -1.26 -1.21 117.35 126.11 1p1f s TYR 127 Ca 0.01 0.06 0.05 0.00 -1.01 0.00 0.00 57.07 56.18 1p1f s TYR 127 Cb -0.14 -1.61 -0.04 0.00 -0.11 0.00 0.00 41.96 40.06 1p1f s TYR 127 CO -0.08 0.50 -0.12 0.00 -1.11 0.00 0.00 175.55 174.74 1p1f s ALA 128 N -1.29 1.57 0.23 3.71 0.00 0.08 -4.93 121.76 121.13 1p1f s ALA 128 Ca 0.26 -1.49 -0.31 0.00 0.00 0.00 0.00 51.96 50.42 1p1f s ALA 128 Cb -0.12 -0.00 -0.11 0.00 0.00 0.00 0.00 23.12 22.89 1p1f s ALA 128 CO 0.18 -0.03 1.55 -2.14 0.00 0.00 0.00 175.76 175.32 1p1f s PRO 129 N -3.53 4.20 0.29 0.00 0.02 -1.26 0.37 135.00 135.09 1p1f s PRO 129 Ca 0.16 2.43 0.01 0.00 0.02 0.00 0.00 61.00 63.62 1p1f s PRO 129 Cb 0.00 -3.10 0.71 0.00 0.02 0.00 0.00 34.50 32.14 1p1f s PRO 129 CO 0.02 -0.57 1.61 0.35 -0.33 0.00 0.00 177.00 178.09 1p1f h PHE 130 N 5.71 0.16 -0.04 6.54 3.57 -0.95 0.73 116.94 132.66 1p1f h PHE 130 Ca -0.45 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.11 1p1f h PHE 130 Cb 1.21 0.08 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1p1f h PHE 130 CO 0.62 -0.31 0.00 0.27 -2.23 0.00 0.00 178.31 176.66 1p1f n ASN 131 N -5.34 0.34 -0.07 0.41 6.94 -1.21 -3.77 115.26 112.57 1p1f n ASN 131 Ca 0.21 -2.01 -0.03 0.00 -0.02 0.00 0.00 54.58 52.74 1p1f n ASN 131 Cb 0.70 -0.09 -0.16 0.00 -2.36 0.00 0.00 39.78 37.87 1p1f n ASN 131 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1p1f n SER 132 N -0.33 0.16 0.03 0.53 3.41 0.26 -4.47 113.62 113.21 1p1f n SER 132 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.52 1p1f n SER 132 Cb 0.07 1.32 -0.06 0.00 -0.26 0.00 0.00 64.21 65.27 1p1f n SER 132 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1p1f h LEU 133 N 0.00 -1.07 -8.96 1.04 4.07 -1.65 -3.38 115.31 105.35 1p1f h LEU 133 Ca -0.35 0.12 -0.58 0.00 0.08 0.00 0.00 57.88 57.15 1p1f h LEU 133 Cb 1.79 0.41 -0.17 0.00 1.08 0.00 0.00 40.66 43.76 1p1f h LEU 133 CO 0.02 -0.33 -0.79 -0.76 -1.08 0.00 0.00 178.44 175.49 1p1f s LEU 134 N -8.37 2.46 0.09 1.67 1.43 -1.26 -4.66 118.68 110.04 1p1f s LEU 134 Ca -0.10 -0.89 -0.31 0.00 -1.03 0.00 0.00 54.13 51.80 1p1f s LEU 134 Cb 0.04 -0.99 -0.09 0.00 0.03 0.00 0.00 46.19 45.18 1p1f s LEU 134 CO 0.39 0.03 1.75 -2.16 0.23 0.00 0.00 176.35 176.59 1p1f s PRO 135 N -2.88 4.17 0.12 1.29 0.04 -1.26 -4.90 135.00 131.57 1p1f s PRO 135 Ca 0.20 2.46 0.08 0.00 0.04 0.00 0.00 61.00 63.78 1p1f s PRO 135 Cb -0.06 -3.61 -0.04 0.00 0.04 0.00 0.00 34.50 30.83 1p1f s PRO 135 CO 0.09 -0.79 -0.19 -1.64 0.04 0.00 0.00 177.00 174.51 1p1f s MET 136 N 2.74 1.13 0.11 4.56 -1.94 -1.26 -4.94 119.30 119.71 1p1f s MET 136 Ca 0.78 -1.22 -0.30 0.00 -1.71 0.00 0.00 55.69 53.24 1p1f s MET 136 Cb -0.43 -1.30 -0.06 0.00 2.01 0.00 0.00 34.83 35.05 1p1f s MET 136 CO 0.34 0.29 1.06 0.08 -0.01 0.00 0.00 175.02 176.78 1p1f s VAL 137 N -1.47 4.23 0.17 -6.03 1.01 -1.26 -5.04 120.40 112.01 1p1f s VAL 137 Ca 0.08 1.79 -0.14 0.00 0.00 0.00 0.00 61.98 63.72 1p1f s VAL 137 Cb -0.08 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 1p1f s VAL 137 CO 0.05 0.24 0.56 -0.94 0.00 0.00 0.00 175.10 175.01 1p1f s SER 138 N 0.29 6.81 0.56 3.32 1.04 -1.26 -4.83 113.70 119.63 1p1f s SER 138 Ca 0.51 1.08 0.29 0.00 0.48 0.00 0.00 55.95 58.31 1p1f s SER 138 Cb -0.26 -2.29 1.46 0.00 0.10 0.00 0.00 66.02 65.03 1p1f s SER 138 CO 0.31 0.07 1.89 1.55 0.98 0.00 0.00 173.24 178.05 1p1f h PRO 139 N 3.39 0.00 0.00 4.02 0.13 -1.96 0.48 132.00 138.06 1p1f h PRO 139 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1p1f h PRO 139 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1p1f h PRO 139 CO 0.66 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.52 1p1f n ASN 140 N -3.98 0.00 0.00 1.44 5.03 -1.26 -1.58 115.26 114.91 1p1f n ASN 140 Ca 0.13 -0.66 0.00 0.00 0.87 0.00 0.00 54.58 54.91 1p1f n ASN 140 Cb 0.79 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.55 1p1f n ASN 140 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1p1f n ASP 141 N -0.82 1.38 -4.77 6.41 10.43 0.17 -4.90 116.55 124.45 1p1f n ASP 141 Ca 0.08 -1.40 -0.37 0.00 2.57 0.00 0.00 54.79 55.66 1p1f n ASP 141 Cb 0.03 0.00 -0.01 0.00 1.84 0.00 0.00 41.12 42.98 1p1f n ASP 141 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1p1f s PHE 142 N -0.40 2.94 -0.67 1.24 2.99 -0.62 -1.82 117.98 121.64 1p1f s PHE 142 Ca 0.00 1.55 0.03 0.00 0.00 0.00 0.00 56.93 58.50 1p1f s PHE 142 Cb 0.00 -3.36 0.16 0.00 0.00 0.00 0.00 43.02 39.83 1p1f s PHE 142 CO 0.00 -1.39 0.46 0.08 -0.00 0.00 0.00 175.22 174.37 1p1f s VAL 143 N -1.54 3.13 0.31 -0.44 1.01 -0.12 -4.87 120.40 117.89 1p1f s VAL 143 Ca 0.62 -3.75 -0.28 0.00 0.00 0.00 0.00 61.98 58.57 1p1f s VAL 143 Cb -0.28 -3.06 -0.09 0.00 0.00 0.00 0.00 36.38 32.94 1p1f s VAL 143 CO 0.35 -0.94 1.08 -0.69 0.00 0.00 0.00 175.10 174.90 1p1f s VAL 144 N -0.90 3.56 0.00 2.92 1.01 -1.26 -1.65 120.40 124.08 1p1f s VAL 144 Ca 0.22 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.66 1p1f s VAL 144 Cb -0.14 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1p1f s VAL 144 CO -0.09 0.26 0.00 -0.24 0.00 0.00 0.00 175.10 175.03 1p1f n SER 145 N 0.82 0.00 0.00 3.32 2.88 -0.20 -4.96 113.62 115.49 1p1f n SER 145 Ca 0.01 -0.58 0.00 0.00 -1.33 0.00 0.00 58.87 56.97 1p1f n SER 145 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1p1f n SER 145 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p1f n GLY 146 N 0.00 0.14 3.38 0.46 0.00 -1.26 -0.91 105.19 106.99 1p1f n GLY 146 Ca 0.00 -1.43 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 1p1f n GLY 146 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1p1f s TRP 147 N -3.06 1.77 -0.29 1.61 0.51 0.12 -1.29 118.94 118.30 1p1f s TRP 147 Ca 0.00 -0.74 -0.22 0.00 -2.12 0.00 0.00 56.10 53.01 1p1f s TRP 147 Cb 0.00 -0.98 0.15 0.00 -0.81 0.00 0.00 33.47 31.83 1p1f s TRP 147 CO 0.00 0.19 1.14 0.34 -0.51 0.00 0.00 176.95 178.11 1p1f s ASP 148 N -3.37 -0.33 0.00 2.95 2.15 0.02 -1.67 116.67 116.42 1p1f s ASP 148 Ca 0.27 0.60 0.11 0.00 0.43 0.00 0.00 52.55 53.96 1p1f s ASP 148 Cb 0.04 0.77 0.63 0.00 -0.30 0.00 0.00 42.92 44.05 1p1f s ASP 148 CO 0.10 -0.10 1.05 2.30 -0.17 0.00 0.00 175.17 178.35 1p1f n ILE 149 N 2.46 0.00 -4.18 4.11 -5.35 -1.26 -3.56 119.36 111.58 1p1f n ILE 149 Ca -0.14 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.15 1p1f n ILE 149 Cb 0.57 -0.69 -0.16 0.00 -1.74 0.00 0.00 39.64 37.61 1p1f n ILE 149 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1p1f s ASN 150 N -1.91 0.90 0.00 7.28 3.04 -1.26 -0.66 114.94 122.32 1p1f s ASN 150 Ca 0.16 -0.13 0.24 0.00 0.04 0.00 0.00 52.86 53.17 1p1f s ASN 150 Cb 0.07 -0.41 1.42 0.00 -1.54 0.00 0.00 41.25 40.80 1p1f s ASN 150 CO 0.12 -0.04 1.81 -0.46 -3.04 0.00 0.00 177.10 175.50 1p1f n ASN 151 N 3.90 0.00 -4.63 -4.21 0.23 -1.26 -4.77 115.26 104.53 1p1f n ASN 151 Ca -0.24 -0.88 -0.57 0.00 -0.53 0.00 0.00 54.58 52.36 1p1f n ASN 151 Cb 0.51 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.14 1p1f n ASN 151 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1p1f n ALA 152 N -0.96 -1.35 -1.21 -2.53 0.00 -1.26 -4.69 120.51 108.51 1p1f n ALA 152 Ca 0.18 0.50 -0.31 0.00 0.00 0.00 0.00 53.44 53.80 1p1f n ALA 152 Cb 0.08 -2.03 0.10 0.00 0.00 0.00 0.00 19.45 17.60 1p1f n ALA 152 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1p1f s ASP 153 N 1.56 4.38 0.56 0.00 -4.77 -1.26 -4.46 116.67 112.67 1p1f s ASP 153 Ca 0.92 1.86 0.25 0.00 -3.30 0.00 0.00 52.55 52.27 1p1f s ASP 153 Cb -1.12 -2.53 1.51 0.00 -1.09 0.00 0.00 42.92 39.70 1p1f s ASP 153 CO 0.59 -2.12 2.11 -0.07 0.70 0.00 0.00 175.17 176.37 1p1f h LEU 154 N -1.18 0.00 -0.12 2.11 4.07 -0.74 -0.63 115.31 118.82 1p1f h LEU 154 Ca -0.43 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.50 1p1f h LEU 154 Cb 1.23 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.97 1p1f h LEU 154 CO 0.51 0.00 -0.01 0.22 -1.08 0.00 0.00 178.44 178.07 1p1f h TYR 155 N 0.00 0.24 -0.91 1.13 3.20 -1.73 -0.90 116.97 118.00 1p1f h TYR 155 Ca 0.09 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1p1f h TYR 155 Cb 0.42 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 1p1f h TYR 155 CO 0.00 0.48 0.60 0.93 -1.64 0.00 0.00 178.16 178.53 1p1f h GLU 156 N -0.07 1.16 -0.88 1.82 5.08 -1.60 -0.52 114.58 119.55 1p1f h GLU 156 Ca 0.03 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1p1f h GLU 156 Cb 0.39 -0.26 -0.06 0.00 0.50 0.00 0.00 28.75 29.32 1p1f h GLU 156 CO 0.01 0.76 0.55 0.00 -1.00 0.00 0.00 179.01 179.34 1p1f h ALA 157 N 1.45 1.21 0.62 3.43 0.00 -0.81 0.17 119.26 125.33 1p1f h ALA 157 Ca 0.35 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1p1f h ALA 157 Cb -0.06 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.48 1p1f h ALA 157 CO -0.09 0.32 -0.30 0.52 0.00 0.00 0.00 179.25 179.70 1p1f h MET 158 N 1.02 -0.80 -0.03 0.00 2.86 0.32 0.23 114.93 118.52 1p1f h MET 158 Ca 0.38 0.05 0.03 0.00 -2.06 0.00 0.00 59.70 58.11 1p1f h MET 158 Cb 0.15 0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.93 1p1f h MET 158 CO -0.17 -0.53 -0.38 1.96 1.06 0.00 0.00 176.91 178.86 1p1f h GLN 159 N -0.85 -0.50 -0.92 1.72 4.20 -0.98 0.02 115.11 117.81 1p1f h GLN 159 Ca -0.09 0.03 0.16 0.00 0.06 0.00 0.00 58.65 58.82 1p1f h GLN 159 Cb 0.64 0.11 -0.10 0.00 0.30 0.00 0.00 27.48 28.44 1p1f h GLN 159 CO 0.14 -0.33 0.51 -0.09 -0.67 0.00 0.00 178.83 178.39 1p1f h ARG 160 N -0.52 0.67 -0.40 1.46 2.43 -0.58 -2.38 114.38 115.07 1p1f h ARG 160 Ca 0.06 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.04 1p1f h ARG 160 Cb 0.61 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1p1f h ARG 160 CO -0.32 0.45 -0.36 0.77 -1.51 0.00 0.00 179.97 179.00 1p1f h SER 161 N 0.69 1.01 -5.35 -3.80 0.02 0.58 -3.49 113.55 103.22 1p1f h SER 161 Ca 0.51 -0.45 -0.31 0.00 -0.84 0.00 0.00 61.79 60.70 1p1f h SER 161 Cb 0.75 -0.28 0.15 0.00 0.14 0.00 0.00 62.40 63.16 1p1f h SER 161 CO -0.37 1.25 -0.70 0.00 -1.14 0.00 0.00 176.83 175.87 1p1f n GLN 162 N -4.07 -6.19 -0.07 3.45 6.02 -0.11 -4.68 117.38 111.73 1p1f n GLN 162 Ca -0.02 0.78 -0.12 0.00 -0.01 0.00 0.00 57.00 57.63 1p1f n GLN 162 Cb 0.53 -5.59 -0.06 0.00 1.02 0.00 0.00 30.24 26.15 1p1f n GLN 162 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1p1f n VAL 163 N -3.96 0.75 -2.75 5.09 0.31 -1.26 -4.60 118.33 111.92 1p1f n VAL 163 Ca -0.24 -0.25 -0.27 0.00 -0.01 0.00 0.00 64.34 63.57 1p1f n VAL 163 Cb 0.65 -1.27 -0.00 0.00 -0.91 0.00 0.00 33.84 32.30 1p1f n VAL 163 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1p1f s LEU 164 N -6.18 3.69 0.18 7.52 2.01 -1.26 -5.03 118.68 119.60 1p1f s LEU 164 Ca -0.18 0.87 -0.33 0.00 0.01 0.00 0.00 54.13 54.50 1p1f s LEU 164 Cb 0.06 -3.81 -0.13 0.00 0.01 0.00 0.00 46.19 42.32 1p1f s LEU 164 CO 0.28 -0.53 1.68 -0.62 1.01 0.00 0.00 176.35 178.17 1p1f n GLU 165 N -2.14 2.53 -0.34 1.70 -0.58 -1.26 -4.78 120.64 115.77 1p1f n GLU 165 Ca -0.00 0.91 0.19 0.00 -0.42 0.00 0.00 57.16 57.85 1p1f n GLU 165 Cb 0.55 -2.74 0.42 0.00 -0.57 0.00 0.00 31.44 29.11 1p1f n GLU 165 CO 0.00 0.00 0.00 -0.92 -0.48 0.00 0.00 177.13 175.73 1p1f h TYR 166 N 6.65 0.94 -0.37 -0.32 3.20 -1.96 0.44 116.97 125.55 1p1f h TYR 166 Ca -0.44 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.37 1p1f h TYR 166 Cb 1.22 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 1p1f h TYR 166 CO 0.65 0.03 -0.15 0.22 -1.64 0.00 0.00 178.16 177.28 1p1f h ASP 167 N 0.51 0.77 0.14 -2.11 1.82 -1.89 -1.10 116.42 114.56 1p1f h ASP 167 Ca 0.65 -0.39 0.00 0.00 -0.39 0.00 0.00 57.03 56.90 1p1f h ASP 167 Cb 1.35 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 41.13 1p1f h ASP 167 CO -0.46 0.99 -0.14 0.25 -1.61 0.00 0.00 179.24 178.27 1p1f h LEU 168 N 0.55 -0.37 -0.62 2.28 5.85 -0.54 0.10 115.31 122.56 1p1f h LEU 168 Ca 0.09 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.95 1p1f h LEU 168 Cb 0.68 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.76 1p1f h LEU 168 CO 0.05 -0.21 0.21 1.56 -0.34 0.00 0.00 178.44 179.71 1p1f h GLN 169 N -0.31 0.37 -0.28 1.25 4.20 -0.74 -0.32 115.11 119.28 1p1f h GLN 169 Ca 0.00 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.74 1p1f h GLN 169 Cb 0.29 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 1p1f h GLN 169 CO -0.04 0.24 0.00 1.96 -0.67 0.00 0.00 178.83 180.33 1p1f h GLN 170 N 0.38 0.09 -0.59 1.46 1.08 -0.36 0.65 115.11 117.82 1p1f h GLN 170 Ca 0.32 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.50 1p1f h GLN 170 Cb 0.42 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.80 1p1f h GLN 170 CO -0.34 0.06 0.30 0.00 -0.95 0.00 0.00 178.83 177.90 1p1f h ARG 171 N 0.09 0.82 0.00 1.46 3.08 0.35 -2.37 114.38 117.81 1p1f h ARG 171 Ca 0.13 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1p1f h ARG 171 Cb 0.17 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1p1f h ARG 171 CO -0.22 0.62 -0.22 -0.07 -1.07 0.00 0.00 179.97 179.02 1p1f h LEU 172 N 0.83 0.00 -0.35 3.04 3.38 -0.16 -3.40 115.31 118.64 1p1f h LEU 172 Ca 0.21 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1p1f h LEU 172 Cb 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1p1f h LEU 172 CO -0.03 0.02 -0.21 1.17 0.09 0.00 0.00 178.44 179.48 1p1f n LYS 173 N -2.54 -0.15 -0.24 1.13 4.81 0.22 -0.22 118.16 121.16 1p1f n LYS 173 Ca 0.04 1.01 0.03 0.00 -0.87 0.00 0.00 58.31 58.52 1p1f n LYS 173 Cb 0.48 -1.50 0.11 0.00 0.02 0.00 0.00 35.03 34.14 1p1f n LYS 173 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1p1f h ALA 174 N -0.31 0.61 0.03 3.14 0.00 -1.78 0.19 119.26 121.14 1p1f h ALA 174 Ca 0.06 0.25 -0.22 0.00 0.00 0.00 0.00 54.91 55.00 1p1f h ALA 174 Cb 0.14 0.47 0.02 0.00 0.00 0.00 0.00 17.79 18.42 1p1f h ALA 174 CO -0.33 -0.42 -0.87 0.87 0.00 0.00 0.00 179.25 178.51 1p1f h LYS 175 N 0.05 0.53 0.00 0.00 6.56 -1.71 -3.26 116.57 118.74 1p1f h LYS 175 Ca 0.37 -0.61 -0.01 0.00 -1.06 0.00 0.00 60.65 59.34 1p1f h LYS 175 Cb 0.60 0.18 -0.00 0.00 -0.57 0.00 0.00 32.23 32.45 1p1f h LYS 175 CO -0.68 1.23 -0.03 0.52 -2.06 0.00 0.00 179.45 178.43 1p1f h MET 176 N 0.10 0.00 -0.45 3.15 2.86 -0.04 -2.54 114.93 118.01 1p1f h MET 176 Ca -0.12 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 1p1f h MET 176 Cb 1.56 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.21 1p1f h MET 176 CO 0.17 0.03 -0.09 0.77 1.06 0.00 0.00 176.91 178.85 1p1f h SER 177 N 0.00 0.86 0.35 1.22 0.02 -1.02 -2.58 113.55 112.40 1p1f h SER 177 Ca -0.00 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1p1f h SER 177 Cb 0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1p1f h SER 177 CO 0.00 1.01 0.00 0.18 -1.14 0.00 0.00 176.83 176.88 1p1f n LEU 178 N -4.29 0.06 -4.54 5.07 4.77 -0.96 -4.48 117.00 112.63 1p1f n LEU 178 Ca -0.00 0.52 -0.42 0.00 -0.03 0.00 0.00 56.01 56.08 1p1f n LEU 178 Cb 0.37 -0.51 -0.08 0.00 -2.33 0.00 0.00 43.42 40.87 1p1f n LEU 178 CO 0.43 -0.36 0.25 -0.69 -1.33 0.00 0.00 177.39 175.69 1p1f s VAL 179 N -3.04 4.98 -0.10 4.08 1.01 -1.07 -5.03 120.40 121.23 1p1f s VAL 179 Ca 0.04 0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.25 1p1f s VAL 179 Cb 0.07 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1p1f s VAL 179 CO 0.19 -0.33 -0.15 -0.54 0.00 0.00 0.00 175.10 174.27 1p1f s LYS 180 N 2.46 2.15 0.46 2.72 1.02 -1.26 -0.48 119.74 126.81 1p1f s LYS 180 Ca 0.19 -0.54 -0.24 0.00 0.02 0.00 0.00 55.97 55.40 1p1f s LYS 180 Cb -0.15 -1.80 -0.07 0.00 -0.52 0.00 0.00 37.83 35.28 1p1f s LYS 180 CO 0.15 -0.03 1.28 -1.25 -0.92 0.00 0.00 175.35 174.57 1p1f s PRO 181 N 0.89 3.66 0.74 -1.68 0.04 -1.26 -4.91 135.00 132.47 1p1f s PRO 181 Ca -0.09 2.06 -0.11 0.00 0.04 0.00 0.00 61.00 62.90 1p1f s PRO 181 Cb -0.15 -2.50 0.04 0.00 0.04 0.00 0.00 34.50 31.93 1p1f s PRO 181 CO 0.00 -0.72 1.08 -0.51 0.04 0.00 0.00 177.00 176.89 1p1f s LEU 182 N -2.94 3.00 0.39 -3.56 1.43 -0.41 -4.69 118.68 111.90 1p1f s LEU 182 Ca 0.63 1.66 -0.26 0.00 -1.03 0.00 0.00 54.13 55.13 1p1f s LEU 182 Cb -0.36 -4.42 -0.09 0.00 0.03 0.00 0.00 46.19 41.36 1p1f s LEU 182 CO 0.44 -1.77 1.23 -2.84 0.23 0.00 0.00 176.35 173.64 1p1f s PRO 183 N -5.00 4.06 0.00 1.29 0.02 -1.26 -0.80 135.00 133.31 1p1f s PRO 183 Ca 0.60 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.60 1p1f s PRO 183 Cb -0.15 -2.75 0.00 0.00 0.02 0.00 0.00 34.50 31.61 1p1f s PRO 183 CO 0.55 -0.36 0.00 0.45 -0.33 0.00 0.00 177.00 177.31 1p1f n SER 184 N 0.18 0.18 -4.07 2.53 2.88 0.13 -4.66 113.62 110.80 1p1f n SER 184 Ca 0.04 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.26 1p1f n SER 184 Cb 0.45 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.75 1p1f n SER 184 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1p1f s ILE 185 N 2.37 1.89 -0.27 2.46 1.01 -1.26 -0.90 121.20 126.50 1p1f s ILE 185 Ca 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.68 1p1f s ILE 185 Cb 0.00 -1.77 0.01 0.00 0.01 0.00 0.00 42.46 40.71 1p1f s ILE 185 CO 0.00 0.43 0.03 -0.47 0.00 0.00 0.00 174.94 174.93 1p1f s TYR 186 N 1.34 3.10 -0.56 3.97 6.04 -1.26 -4.85 117.35 125.14 1p1f s TYR 186 Ca 0.03 -1.07 0.04 0.00 0.04 0.00 0.00 57.07 56.11 1p1f s TYR 186 Cb -0.14 -2.19 0.14 0.00 -1.04 0.00 0.00 41.96 38.73 1p1f s TYR 186 CO -0.11 -0.59 0.32 0.71 -1.54 0.00 0.00 175.55 174.34 1p1f s TYR 187 N 1.46 3.05 0.07 4.97 4.12 -1.26 -4.66 117.35 125.10 1p1f s TYR 187 Ca 0.03 -3.09 -0.08 0.00 0.02 0.00 0.00 57.07 53.95 1p1f s TYR 187 Cb -0.17 -2.59 0.04 0.00 -1.52 0.00 0.00 41.96 37.72 1p1f s TYR 187 CO 0.00 -0.69 0.53 -2.30 0.02 0.00 0.00 175.55 173.11 1p1f n PRO 188 N 2.84 -0.11 0.00 -1.71 -0.02 -1.26 -0.94 135.00 133.80 1p1f n PRO 188 Ca 0.10 0.53 0.02 0.00 -2.02 0.00 0.00 63.50 62.14 1p1f n PRO 188 Cb 0.34 -0.78 0.14 0.00 -0.02 0.00 0.00 33.50 33.17 1p1f n PRO 188 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1p1f n ASP 189 N -4.48 0.00 -1.31 2.55 8.00 -1.26 -2.95 116.55 117.10 1p1f n ASP 189 Ca 0.02 -0.03 0.12 0.00 0.71 0.00 0.00 54.79 55.61 1p1f n ASP 189 Cb 0.12 -0.10 0.31 0.00 -0.02 0.00 0.00 41.12 41.43 1p1f n ASP 189 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1p1f n PHE 190 N -1.10 0.92 0.00 1.24 3.01 -0.12 -4.92 117.46 116.50 1p1f n PHE 190 Ca 0.03 -0.46 0.00 0.00 1.01 0.00 0.00 57.45 58.03 1p1f n PHE 190 Cb 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 1p1f n PHE 190 CO 0.00 0.00 0.00 0.44 1.01 0.00 0.00 176.76 178.21 1p1f n ILE 191 N 1.60 0.00 -4.10 4.37 -5.35 -1.15 -2.05 119.36 112.68 1p1f n ILE 191 Ca 0.24 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.61 1p1f n ILE 191 Cb 0.61 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 38.40 1p1f n ILE 191 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1p1f s ALA 192 N -1.32 0.67 -0.11 -1.28 0.00 -1.26 -4.98 121.76 113.47 1p1f s ALA 192 Ca 0.00 -1.04 0.15 0.00 0.00 0.00 0.00 51.96 51.06 1p1f s ALA 192 Cb 0.00 0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.21 1p1f s ALA 192 CO 0.00 -0.17 1.19 0.00 0.00 0.00 0.00 175.76 176.78 1p1f h ALA 193 N 3.71 0.63 0.00 0.00 0.00 -2.01 -3.20 119.26 118.39 1p1f h ALA 193 Ca -0.35 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 53.89 1p1f h ALA 193 Cb 1.18 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1p1f h ALA 193 CO 0.54 0.83 -0.01 -0.91 0.00 0.00 0.00 179.25 179.70 1p1f h ASN 194 N 0.00 0.00 -0.60 0.00 2.35 -2.01 0.19 115.58 115.52 1p1f h ASN 194 Ca -0.07 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.42 1p1f h ASN 194 Cb 1.52 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 39.73 1p1f h ASN 194 CO 0.07 0.01 0.20 0.00 -1.65 0.00 0.00 177.43 176.06 1p1f n GLN 195 N -3.28 2.41 -0.11 0.81 1.13 -1.21 -4.56 117.38 112.58 1p1f n GLN 195 Ca -0.03 -3.08 -0.24 0.00 -1.94 0.00 0.00 57.00 51.71 1p1f n GLN 195 Cb 0.10 -2.00 -0.11 0.00 0.11 0.00 0.00 30.24 28.34 1p1f n GLN 195 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1p1f n ASP 196 N -0.89 1.94 -0.08 1.08 4.64 0.68 -4.17 116.55 119.75 1p1f n ASP 196 Ca 0.41 0.31 0.00 0.00 -1.38 0.00 0.00 54.79 54.13 1p1f n ASP 196 Cb 1.27 -0.85 0.00 0.00 -1.04 0.00 0.00 41.12 40.50 1p1f n ASP 196 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 1p1f n GLU 197 N -4.15 0.59 -0.00 -0.67 0.00 -1.26 -1.91 120.64 113.24 1p1f n GLU 197 Ca -0.42 0.00 0.09 0.00 0.00 0.00 0.00 57.16 56.83 1p1f n GLU 197 Cb 0.83 -1.04 -0.13 0.00 0.00 0.00 0.00 31.44 31.10 1p1f n GLU 197 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1p1f n ARG 198 N -0.39 0.71 -2.71 3.44 0.63 -1.26 -4.86 116.66 112.22 1p1f n ARG 198 Ca 0.00 -0.08 -0.42 0.00 -0.92 0.00 0.00 57.85 56.43 1p1f n ARG 198 Cb 0.02 -1.42 -0.03 0.00 0.45 0.00 0.00 32.46 31.48 1p1f n ARG 198 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1p1f s ALA 199 N -3.04 2.97 -0.10 5.13 0.00 -0.80 -4.06 121.76 121.86 1p1f s ALA 199 Ca 0.00 -2.24 0.14 0.00 0.00 0.00 0.00 51.96 49.86 1p1f s ALA 199 Cb 0.13 -4.26 0.27 0.00 0.00 0.00 0.00 23.12 19.26 1p1f s ALA 199 CO 0.78 -3.27 1.13 0.27 0.00 0.00 0.00 175.76 174.68 1p1f n ASN 200 N 8.09 1.45 -3.10 0.00 2.04 0.16 -4.80 115.26 119.11 1p1f n ASN 200 Ca 0.21 -2.86 -0.16 0.00 -0.44 0.00 0.00 54.58 51.33 1p1f n ASN 200 Cb 0.49 -0.38 -0.01 0.00 -2.53 0.00 0.00 39.78 37.36 1p1f n ASN 200 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1p1f n ASN 201 N -0.74 0.32 -4.72 0.53 4.05 -0.75 -4.54 115.26 109.41 1p1f n ASN 201 Ca 0.11 -3.11 -0.23 0.00 0.45 0.00 0.00 54.58 51.81 1p1f n ASN 201 Cb 0.74 -0.20 -0.06 0.00 1.23 0.00 0.00 39.78 41.49 1p1f n ASN 201 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1p1f n ILE 203 N -1.02 0.02 -3.35 0.00 -5.35 -0.07 -4.75 119.36 104.83 1p1f n ILE 203 Ca -0.06 -0.51 -0.41 0.00 -0.27 0.00 0.00 62.75 61.50 1p1f n ILE 203 Cb 0.59 1.00 -0.02 0.00 -1.74 0.00 0.00 39.64 39.47 1p1f n ILE 203 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1p1f n ASN 204 N 0.02 5.24 -4.12 7.28 6.94 -1.26 -4.96 115.26 124.39 1p1f n ASN 204 Ca 0.00 -3.19 -0.21 0.00 -0.02 0.00 0.00 54.58 51.17 1p1f n ASN 204 Cb 0.02 -1.21 -0.14 0.00 -2.36 0.00 0.00 39.78 36.09 1p1f n ASN 204 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1p1f s LEU 205 N -1.78 2.11 0.00 -4.53 1.43 -1.26 -1.65 118.68 113.00 1p1f s LEU 205 Ca 0.31 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 1p1f s LEU 205 Cb -0.04 -0.62 0.03 0.00 0.03 0.00 0.00 46.19 45.59 1p1f s LEU 205 CO -0.04 0.08 0.18 -0.90 0.23 0.00 0.00 176.35 175.90 1p1f n ASP 206 N 2.27 0.16 0.27 2.29 3.85 -1.15 -4.86 116.55 119.38 1p1f n ASP 206 Ca -0.16 -1.15 0.12 0.00 -0.71 0.00 0.00 54.79 52.88 1p1f n ASP 206 Cb 0.55 -0.12 0.76 0.00 -1.35 0.00 0.00 41.12 40.96 1p1f n ASP 206 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1p1f h GLU 207 N 0.00 0.00 -2.02 0.11 3.07 -2.02 -1.75 114.58 111.97 1p1f h GLU 207 Ca -0.06 0.00 -0.69 0.00 -0.50 0.00 0.00 59.36 58.11 1p1f h GLU 207 Cb 0.20 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 27.87 1p1f h GLU 207 CO 0.06 0.00 0.88 1.63 -1.40 0.00 0.00 179.01 180.18 1p1f n LYS 208 N -4.23 2.77 -2.19 2.33 4.76 -1.26 -4.91 118.16 115.43 1p1f n LYS 208 Ca -0.03 -3.21 0.00 0.00 -2.87 0.00 0.00 58.31 52.21 1p1f n LYS 208 Cb 0.11 -2.24 0.00 0.00 -1.84 0.00 0.00 35.03 31.05 1p1f n LYS 208 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1p1f n GLY 209 N -0.06 0.00 3.13 0.72 0.00 -0.66 -4.84 105.19 103.48 1p1f n GLY 209 Ca 0.52 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.29 1p1f n GLY 209 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p1f s ASN 210 N -2.85 2.02 0.27 1.61 0.01 -1.26 -4.88 114.94 109.86 1p1f s ASN 210 Ca 0.00 -0.32 -0.27 0.00 -0.71 0.00 0.00 52.86 51.56 1p1f s ASN 210 Cb 0.00 -0.46 -0.15 0.00 0.41 0.00 0.00 41.25 41.05 1p1f s ASN 210 CO 0.00 0.16 0.72 0.52 -1.51 0.00 0.00 177.10 176.99 1p1f n VAL 211 N 3.01 1.93 -3.57 1.60 0.31 -1.26 -2.93 118.33 117.42 1p1f n VAL 211 Ca -0.17 -0.50 -0.05 0.00 -0.01 0.00 0.00 64.34 63.61 1p1f n VAL 211 Cb 0.53 -0.48 -0.07 0.00 -0.91 0.00 0.00 33.84 32.91 1p1f n VAL 211 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1p1f s THR 212 N -1.10 -0.80 -0.08 2.52 -1.32 -0.66 -4.88 115.64 109.32 1p1f s THR 212 Ca 0.61 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 61.16 1p1f s THR 212 Cb -0.78 -0.83 0.00 0.00 -1.51 0.00 0.00 72.50 69.38 1p1f s THR 212 CO 0.58 0.02 0.89 0.35 -2.21 0.00 0.00 174.62 174.25 1p1f n THR 213 N 5.41 0.86 -4.58 5.08 -2.24 -1.26 -4.70 114.28 112.85 1p1f n THR 213 Ca -0.08 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.38 1p1f n THR 213 Cb 0.50 -0.93 -0.17 0.00 -2.10 0.00 0.00 70.33 67.63 1p1f n THR 213 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1p1f s ARG 214 N -0.02 2.83 0.00 -0.78 3.52 -1.26 -4.60 118.95 118.64 1p1f s ARG 214 Ca 0.00 -0.78 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 1p1f s ARG 214 Cb 0.00 -2.32 0.00 0.00 -1.56 0.00 0.00 34.95 31.07 1p1f s ARG 214 CO 0.00 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 1p1f n GLY 215 N 4.15 1.55 0.36 8.12 0.00 -1.26 -4.94 105.19 113.16 1p1f n GLY 215 Ca -0.20 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.90 1p1f n GLY 215 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p1f n LYS 216 N -0.62 -0.09 0.30 1.61 5.02 -1.26 0.97 118.16 124.09 1p1f n LYS 216 Ca 0.00 1.54 0.16 0.00 -2.02 0.00 0.00 58.31 57.99 1p1f n LYS 216 Cb 0.00 -2.32 0.96 0.00 -0.02 0.00 0.00 35.03 33.64 1p1f n LYS 216 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1p1f h TRP 217 N 0.00 0.00 -0.07 2.13 2.91 -1.88 0.18 115.95 119.22 1p1f h TRP 217 Ca 0.50 0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.41 1p1f h TRP 217 Cb 0.82 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.47 1p1f h TRP 217 CO -0.72 0.00 -0.37 1.15 -1.03 0.00 0.00 178.44 177.47 1p1f h THR 218 N 0.00 1.41 -0.32 2.65 2.02 0.22 -2.27 112.91 116.62 1p1f h THR 218 Ca -0.00 -1.76 0.02 0.00 0.77 0.00 0.00 66.41 65.44 1p1f h THR 218 Cb 0.00 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 1p1f h THR 218 CO 0.00 0.51 0.17 0.45 0.37 0.00 0.00 175.52 177.02 1p1f h HIS 219 N -0.10 0.31 -0.95 3.16 3.86 -0.87 0.28 115.15 120.84 1p1f h HIS 219 Ca -0.03 0.01 0.17 0.00 -1.16 0.00 0.00 60.37 59.37 1p1f h HIS 219 Cb 1.02 -0.09 -0.10 0.00 1.06 0.00 0.00 27.41 29.30 1p1f h HIS 219 CO 0.13 0.17 0.55 1.25 0.86 0.00 0.00 177.93 180.90 1p1f h LEU 220 N 0.35 0.71 -0.38 2.43 7.12 -0.66 0.38 115.31 125.26 1p1f h LEU 220 Ca 0.13 0.09 -0.13 0.00 0.13 0.00 0.00 57.88 58.11 1p1f h LEU 220 Cb 0.03 -0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 1p1f h LEU 220 CO -0.08 0.28 -0.61 1.56 -0.13 0.00 0.00 178.44 179.45 1p1f h GLN 221 N 0.74 0.00 0.28 1.25 1.08 -0.62 -2.78 115.11 115.06 1p1f h GLN 221 Ca 0.53 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.72 1p1f h GLN 221 Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1p1f h GLN 221 CO -0.37 0.61 -0.13 -0.09 -0.95 0.00 0.00 178.83 177.90 1p1f h ARG 222 N 0.00 -0.36 -0.58 1.46 9.65 0.31 -2.36 114.38 122.50 1p1f h ARG 222 Ca -0.01 0.02 0.11 0.00 -1.10 0.00 0.00 59.98 59.01 1p1f h ARG 222 Cb 1.30 0.08 -0.09 0.00 -1.39 0.00 0.00 29.97 29.87 1p1f h ARG 222 CO 0.08 -0.01 0.07 0.82 2.80 0.00 0.00 179.97 183.72 1p1f h ILE 223 N -0.89 0.59 -0.93 1.20 1.08 -0.56 0.20 117.51 118.20 1p1f h ILE 223 Ca -0.04 -0.06 0.10 0.00 -0.39 0.00 0.00 64.86 64.46 1p1f h ILE 223 Cb 0.51 0.39 -0.07 0.00 -3.07 0.00 0.00 36.82 34.58 1p1f h ILE 223 CO 0.06 0.03 0.60 0.03 -0.69 0.00 0.00 178.15 178.18 1p1f h ARG 224 N 0.19 0.92 -0.36 2.37 3.08 -1.52 -0.50 114.38 118.56 1p1f h ARG 224 Ca 0.30 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 60.13 1p1f h ARG 224 Cb 0.47 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1p1f h ARG 224 CO -0.44 0.61 -0.42 -0.09 -1.07 0.00 0.00 179.97 178.56 1p1f h ARG 225 N 0.95 0.92 -0.06 0.04 9.65 -0.18 -2.50 114.38 123.19 1p1f h ARG 225 Ca 0.43 -0.50 0.03 0.00 -1.10 0.00 0.00 59.98 58.84 1p1f h ARG 225 Cb 0.39 0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 28.93 1p1f h ARG 225 CO -0.19 1.15 -0.45 -0.44 2.80 0.00 0.00 179.97 182.84 1p1f h ASP 226 N 0.74 -1.39 -0.58 -3.80 3.45 0.76 0.12 116.42 115.71 1p1f h ASP 226 Ca 0.05 0.17 0.11 0.00 0.43 0.00 0.00 57.03 57.79 1p1f h ASP 226 Cb 1.01 0.55 -0.11 0.00 -0.56 0.00 0.00 39.33 40.22 1p1f h ASP 226 CO 0.10 -0.46 -0.27 0.40 -1.57 0.00 0.00 179.24 177.44 1p1f h ILE 227 N -0.56 0.24 -0.01 0.35 2.04 -1.22 0.38 117.51 118.73 1p1f h ILE 227 Ca 0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.92 1p1f h ILE 227 Cb 0.66 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 1p1f h ILE 227 CO -0.36 0.00 -0.06 1.56 0.00 0.00 0.00 178.15 179.28 1p1f h GLN 228 N -0.12 -0.10 -0.21 2.37 4.20 -0.84 -1.84 115.11 118.57 1p1f h GLN 228 Ca 0.25 0.01 0.04 0.00 0.06 0.00 0.00 58.65 59.01 1p1f h GLN 228 Cb 0.52 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.29 1p1f h GLN 228 CO -0.66 -0.07 -0.00 -0.91 -0.67 0.00 0.00 178.83 176.52 1p1f h ASN 229 N -0.10 -0.09 -0.32 1.46 -0.26 -0.03 -2.54 115.58 113.70 1p1f h ASN 229 Ca 0.03 0.05 0.07 0.00 -0.56 0.00 0.00 56.30 55.88 1p1f h ASN 229 Cb 0.14 0.09 -0.08 0.00 -1.06 0.00 0.00 38.32 37.41 1p1f h ASN 229 CO -0.07 -0.02 -0.36 0.15 -1.06 0.00 0.00 177.43 176.07 1p1f h PHE 230 N 0.06 -1.03 -0.14 1.19 3.57 -0.73 -0.87 116.94 119.00 1p1f h PHE 230 Ca 0.10 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1p1f h PHE 230 Cb 0.13 0.50 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 1p1f h PHE 230 CO -0.18 -0.41 -0.20 0.87 -2.23 0.00 0.00 178.31 176.15 1p1f h LYS 231 N -0.33 -0.15 0.00 1.11 1.79 -0.96 -2.60 116.57 115.44 1p1f h LYS 231 Ca 0.14 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 1p1f h LYS 231 Cb 0.56 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1p1f h LYS 231 CO -0.50 -0.10 -0.12 1.05 -1.08 0.00 0.00 179.45 178.71 1p1f h GLU 232 N -0.15 0.00 0.00 3.15 4.11 -1.29 0.06 114.58 120.46 1p1f h GLU 232 Ca 0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.43 1p1f h GLU 232 Cb 0.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1p1f h GLU 232 CO -0.21 0.12 -0.13 0.93 0.07 0.00 0.00 179.01 179.79 1p1f h GLU 233 N 0.00 0.00 -0.00 1.06 5.08 -0.83 -3.10 114.58 116.79 1p1f h GLU 233 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p1f h GLU 233 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1p1f h GLU 233 CO 0.02 0.13 -0.41 0.09 -1.00 0.00 0.00 179.01 177.84 1p1f n ASN 234 N -3.20 0.96 -2.11 1.42 3.02 -0.97 -4.99 115.26 109.39 1p1f n ASN 234 Ca 0.02 -0.98 -0.14 0.00 -0.03 0.00 0.00 54.58 53.45 1p1f n ASN 234 Cb 0.46 0.74 0.04 0.00 -0.61 0.00 0.00 39.78 40.41 1p1f n ASN 234 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p1f n ALA 235 N -0.74 -0.68 -2.30 5.41 0.00 -0.14 -5.02 120.51 117.04 1p1f n ALA 235 Ca 0.04 0.21 -0.26 0.00 0.00 0.00 0.00 53.44 53.43 1p1f n ALA 235 Cb 0.22 -3.02 0.01 0.00 0.00 0.00 0.00 19.45 16.65 1p1f n ALA 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1p1f s LEU 236 N -4.42 3.61 0.00 0.00 1.43 -0.34 -5.02 118.68 113.94 1p1f s LEU 236 Ca 0.27 0.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.07 1p1f s LEU 236 Cb -0.12 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1p1f s LEU 236 CO 0.33 -0.66 0.00 0.47 0.23 0.00 0.00 176.35 176.73 1p1f n ASP 237 N -2.23 3.87 -4.54 2.29 10.43 -1.26 -4.67 116.55 120.44 1p1f n ASP 237 Ca 0.01 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 57.05 1p1f n ASP 237 Cb 0.56 0.00 -0.11 0.00 1.84 0.00 0.00 41.12 43.41 1p1f n ASP 237 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1p1f s LYS 238 N -1.97 2.37 -0.06 -1.24 1.02 -1.26 -5.07 119.74 113.53 1p1f s LYS 238 Ca 0.00 -0.82 -0.07 0.00 0.02 0.00 0.00 55.97 55.09 1p1f s LYS 238 Cb 0.00 -2.38 0.02 0.00 -0.52 0.00 0.00 37.83 34.95 1p1f s LYS 238 CO 0.00 0.58 0.20 0.08 -0.92 0.00 0.00 175.35 175.28 1p1f s VAL 239 N -0.98 0.01 0.06 3.17 1.01 -1.26 -1.23 120.40 121.19 1p1f s VAL 239 Ca 0.16 -0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1p1f s VAL 239 Cb -0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 1p1f s VAL 239 CO 0.07 -0.06 -0.20 -0.63 0.00 0.00 0.00 175.10 174.29 1p1f s ILE 240 N -0.12 1.60 -0.06 2.22 1.01 -0.18 -3.85 121.20 121.81 1p1f s ILE 240 Ca -0.02 -1.28 0.05 0.00 0.00 0.00 0.00 60.65 59.40 1p1f s ILE 240 Cb -0.02 -1.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 1p1f s ILE 240 CO 0.01 0.09 -0.22 -0.69 0.00 0.00 0.00 174.94 174.13 1p1f s VAL 241 N -0.92 1.84 -0.06 2.92 1.01 -0.35 -2.04 120.40 122.80 1p1f s VAL 241 Ca 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1p1f s VAL 241 Cb -0.09 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1p1f s VAL 241 CO 0.02 0.51 -0.04 -0.22 0.00 0.00 0.00 175.10 175.38 1p1f s LEU 242 N 0.00 1.14 -0.47 3.92 0.20 -1.04 -0.55 118.68 121.87 1p1f s LEU 242 Ca -0.06 -0.15 -0.25 0.00 0.69 0.00 0.00 54.13 54.36 1p1f s LEU 242 Cb -0.14 -0.52 0.03 0.00 -0.43 0.00 0.00 46.19 45.13 1p1f s LEU 242 CO 0.04 -0.09 0.89 0.86 -0.29 0.00 0.00 176.35 177.76 1p1f s TRP 243 N 1.27 2.92 -0.15 5.38 -0.11 0.75 -2.20 118.94 126.80 1p1f s TRP 243 Ca -0.05 0.26 0.15 0.00 1.22 0.00 0.00 56.10 57.68 1p1f s TRP 243 Cb -0.14 -3.91 0.41 0.00 -1.50 0.00 0.00 33.47 28.33 1p1f s TRP 243 CO -0.02 -1.11 1.20 -2.37 -4.62 0.00 0.00 176.95 170.03 1p1f n THR 244 N 6.32 1.58 -1.48 5.86 5.66 -0.26 -0.42 114.28 131.53 1p1f n THR 244 Ca 0.04 -2.55 0.00 0.00 -3.05 0.00 0.00 64.05 58.49 1p1f n THR 244 Cb 0.48 0.09 0.00 0.00 -1.55 0.00 0.00 70.33 69.35 1p1f n THR 244 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1p1f n ALA 245 N -0.70 0.00 -1.05 1.79 0.00 0.37 -4.57 120.51 116.35 1p1f n ALA 245 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.28 1p1f n ALA 245 Cb 0.80 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.38 1p1f n ALA 245 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1p1f s ASN 246 N -1.00 3.71 -0.20 0.00 0.01 -1.26 -4.87 114.94 111.32 1p1f s ASN 246 Ca 0.00 1.87 -0.28 0.00 -0.71 0.00 0.00 52.86 53.74 1p1f s ASN 246 Cb 0.00 -2.47 0.00 0.00 0.41 0.00 0.00 41.25 39.19 1p1f s ASN 246 CO 0.00 -2.55 0.98 -0.89 -1.51 0.00 0.00 177.10 173.13 1p1f s THR 247 N -2.81 4.74 0.00 1.60 2.01 -1.26 -5.01 115.64 114.91 1p1f s THR 247 Ca 0.63 1.92 0.00 0.00 0.31 0.00 0.00 61.69 64.56 1p1f s THR 247 Cb -0.19 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.05 1p1f s THR 247 CO 0.57 -0.11 0.00 -0.62 -0.69 0.00 0.00 174.62 173.77 1p1f n GLU 248 N 5.93 0.50 -4.28 4.92 1.02 -1.26 -4.65 120.64 122.83 1p1f n GLU 248 Ca 0.10 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.94 1p1f n GLU 248 Cb 0.47 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.79 1p1f n GLU 248 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1p1f s ARG 249 N -1.78 2.14 0.68 3.49 1.70 -0.87 -4.68 118.95 119.62 1p1f s ARG 249 Ca 0.00 -1.00 -0.17 0.00 -0.47 0.00 0.00 55.73 54.09 1p1f s ARG 249 Cb 0.00 -2.30 -0.02 0.00 -0.57 0.00 0.00 34.95 32.06 1p1f s ARG 249 CO 0.00 0.52 0.90 0.66 -1.08 0.00 0.00 175.30 176.30 1p1f n TYR 250 N 0.85 0.51 -4.00 5.89 4.01 -1.26 -4.84 117.16 118.32 1p1f n TYR 250 Ca -0.14 0.40 -0.35 0.00 -0.16 0.00 0.00 57.90 57.65 1p1f n TYR 250 Cb 0.52 -2.08 -0.12 0.00 -0.31 0.00 0.00 39.34 37.35 1p1f n TYR 250 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1p1f s VAL 251 N -1.72 4.11 -0.25 -0.72 -7.23 -1.26 -5.03 120.40 108.30 1p1f s VAL 251 Ca 0.74 -0.26 -0.30 0.00 -1.81 0.00 0.00 61.98 60.35 1p1f s VAL 251 Cb -0.37 -2.87 -0.07 0.00 0.56 0.00 0.00 36.38 33.63 1p1f s VAL 251 CO 0.50 0.41 2.21 1.21 -0.31 0.00 0.00 175.10 179.12 1p1f n GLU 252 N 4.33 1.71 -2.65 4.82 4.07 -1.26 -4.91 120.64 126.75 1p1f n GLU 252 Ca -0.17 0.47 -0.43 0.00 -0.06 0.00 0.00 57.16 56.97 1p1f n GLU 252 Cb 0.52 -3.00 -0.02 0.00 -0.06 0.00 0.00 31.44 28.88 1p1f n GLU 252 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1p1f s VAL 253 N 7.92 4.53 0.07 6.31 1.01 -1.26 -4.93 120.40 134.05 1p1f s VAL 253 Ca 1.03 1.73 0.07 0.00 0.00 0.00 0.00 61.98 64.81 1p1f s VAL 253 Cb -0.50 -4.40 -0.03 0.00 0.00 0.00 0.00 36.38 31.46 1p1f s VAL 253 CO 0.40 -0.45 -0.19 -0.94 0.00 0.00 0.00 175.10 173.92 1p1f s SER 254 N 1.62 2.25 0.75 3.32 1.04 -1.26 -5.03 113.70 116.38 1p1f s SER 254 Ca 0.45 -0.58 -0.14 0.00 0.48 0.00 0.00 55.95 56.15 1p1f s SER 254 Cb -0.12 -0.14 0.05 0.00 0.10 0.00 0.00 66.02 65.90 1p1f s SER 254 CO 0.15 0.07 1.19 -2.16 0.98 0.00 0.00 173.24 173.47 1p1f s PRO 255 N -1.50 2.07 0.00 4.02 0.04 -1.26 -2.66 135.00 135.70 1p1f s PRO 255 Ca 0.05 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1p1f s PRO 255 Cb -0.09 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1p1f s PRO 255 CO 0.03 -1.88 0.00 0.41 0.04 0.00 0.00 177.00 175.60 1p1f n GLY 256 N 0.27 2.26 0.00 0.56 0.00 -1.26 -4.76 105.19 102.26 1p1f n GLY 256 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1p1f n GLY 256 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p1f n VAL 257 N -0.26 0.00 -1.42 1.61 0.31 -1.09 -4.72 118.33 112.76 1p1f n VAL 257 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1p1f n VAL 257 Cb 0.00 -0.20 0.20 0.00 -0.91 0.00 0.00 33.84 32.92 1p1f n VAL 257 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1p1f n ASN 258 N 0.00 2.69 0.11 4.52 2.04 -1.18 -1.30 115.26 122.14 1p1f n ASN 258 Ca 0.00 -3.76 0.12 0.00 -0.44 0.00 0.00 54.58 50.49 1p1f n ASN 258 Cb 0.00 -0.68 0.02 0.00 -2.53 0.00 0.00 39.78 36.59 1p1f n ASN 258 CO 0.00 0.00 0.00 -2.24 -0.44 0.00 0.00 177.26 174.58 1p1f h ASP 259 N 1.00 0.00 -4.99 0.53 -0.00 -1.88 -2.39 116.42 108.69 1p1f h ASP 259 Ca 0.30 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.03 57.19 1p1f h ASP 259 Cb 1.90 0.00 -0.20 0.00 -0.00 0.00 0.00 39.33 41.02 1p1f h ASP 259 CO 0.53 0.01 -0.43 0.28 -0.00 0.00 0.00 179.24 179.63 1p1f s THR 260 N -3.35 0.08 0.00 1.15 -1.32 -1.26 -3.63 115.64 107.31 1p1f s THR 260 Ca 0.00 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 59.83 1p1f s THR 260 Cb 0.09 -0.51 0.00 0.00 -1.51 0.00 0.00 72.50 70.58 1p1f s THR 260 CO 0.78 -0.36 0.37 0.80 -2.21 0.00 0.00 174.62 174.00 1p1f n MET 261 N 1.35 0.00 -0.29 7.08 0.00 -1.22 -1.35 117.12 122.70 1p1f n MET 261 Ca -0.22 0.37 0.11 0.00 -0.00 0.00 0.00 57.70 57.95 1p1f n MET 261 Cb 0.56 -0.69 0.26 0.00 0.00 0.00 0.00 33.22 33.34 1p1f n MET 261 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1p1f h GLU 262 N 0.00 0.18 -0.31 2.12 3.07 -1.96 -0.15 114.58 117.54 1p1f h GLU 262 Ca 0.00 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.87 1p1f h GLU 262 Cb 0.00 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.84 1p1f h GLU 262 CO 0.00 0.12 0.15 -0.91 -1.40 0.00 0.00 179.01 176.97 1p1f h ASN 263 N 0.19 0.22 0.07 1.42 4.21 -1.56 0.10 115.58 120.22 1p1f h ASN 263 Ca 0.52 0.02 0.02 0.00 1.21 0.00 0.00 56.30 58.06 1p1f h ASN 263 Cb 1.01 -0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 38.16 1p1f h ASN 263 CO -0.66 0.16 -0.16 0.25 -1.29 0.00 0.00 177.43 175.73 1p1f h LEU 264 N 0.31 -0.46 -1.86 1.61 5.85 0.28 1.44 115.31 122.48 1p1f h LEU 264 Ca 0.13 0.06 0.18 0.00 0.84 0.00 0.00 57.88 59.09 1p1f h LEU 264 Cb 0.05 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1p1f h LEU 264 CO -0.10 -0.23 0.48 -0.07 -0.34 0.00 0.00 178.44 178.18 1p1f h LEU 265 N -0.31 0.12 0.05 2.25 3.38 -0.79 0.34 115.31 120.36 1p1f h LEU 265 Ca 0.03 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 1p1f h LEU 265 Cb 0.34 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1p1f h LEU 265 CO -0.11 0.06 -0.95 -0.61 0.09 0.00 0.00 178.44 176.92 1p1f h GLN 266 N 0.13 0.11 0.00 1.13 5.75 0.63 -2.47 115.11 120.39 1p1f h GLN 266 Ca 0.33 -0.20 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 1p1f h GLN 266 Cb 1.13 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.76 1p1f h GLN 266 CO -0.04 1.09 0.33 0.77 -2.65 0.00 0.00 178.83 178.33 1p1f h SER 267 N -0.69 0.00 0.00 -0.69 0.02 0.27 1.03 113.55 113.48 1p1f h SER 267 Ca -0.22 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.71 1p1f h SER 267 Cb 1.42 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.96 1p1f h SER 267 CO -0.03 0.00 -0.14 0.40 -1.14 0.00 0.00 176.83 175.93 1p1f h ILE 268 N 0.00 0.67 -0.11 3.27 2.04 -0.97 0.04 117.51 122.45 1p1f h ILE 268 Ca 0.00 -1.54 0.03 0.00 1.00 0.00 0.00 64.86 64.35 1p1f h ILE 268 Cb 0.67 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1p1f h ILE 268 CO 0.00 0.23 0.19 0.11 0.00 0.00 0.00 178.15 178.68 1p1f h LYS 269 N -1.00 0.00 -0.02 2.37 1.57 0.16 0.13 116.57 119.78 1p1f h LYS 269 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1p1f h LYS 269 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1p1f h LYS 269 CO -0.01 0.00 -0.14 0.09 -0.57 0.00 0.00 179.45 178.81 1p1f n ASN 270 N -3.45 1.70 -3.42 0.86 5.03 0.31 -4.81 115.26 111.49 1p1f n ASN 270 Ca -0.00 -1.41 -0.21 0.00 0.87 0.00 0.00 54.58 53.83 1p1f n ASN 270 Cb 0.28 0.11 0.06 0.00 -1.02 0.00 0.00 39.78 39.21 1p1f n ASN 270 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1p1f n ASP 271 N 0.11 -5.98 -4.78 6.41 10.43 0.03 -4.94 116.55 117.84 1p1f n ASP 271 Ca 0.15 -0.82 -0.39 0.00 2.57 0.00 0.00 54.79 56.30 1p1f n ASP 271 Cb 0.41 -4.54 -0.06 0.00 1.84 0.00 0.00 41.12 38.77 1p1f n ASP 271 CO 0.00 0.00 0.00 -2.28 -1.07 0.00 0.00 177.20 173.85 1p1f s HIS 272 N -3.42 3.89 -2.00 1.24 2.46 -0.02 -4.91 115.29 112.53 1p1f s HIS 272 Ca 0.45 1.67 0.01 0.00 0.47 0.00 0.00 55.06 57.66 1p1f s HIS 272 Cb -0.10 -2.80 0.04 0.00 -0.13 0.00 0.00 32.58 29.60 1p1f s HIS 272 CO 0.78 0.47 0.48 -1.91 -2.47 0.00 0.00 174.74 172.10 1p1f n GLU 273 N 1.43 0.03 -0.02 2.88 2.13 -1.26 -0.96 120.64 124.86 1p1f n GLU 273 Ca -0.04 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.84 1p1f n GLU 273 Cb 0.49 -1.44 -0.14 0.00 0.27 0.00 0.00 31.44 30.62 1p1f n GLU 273 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1p1f n GLU 274 N -0.94 0.66 -2.11 5.31 1.02 -1.26 -4.89 120.64 118.44 1p1f n GLU 274 Ca 0.01 -0.14 -0.43 0.00 -0.02 0.00 0.00 57.16 56.58 1p1f n GLU 274 Cb 0.00 -1.43 -0.03 0.00 -0.02 0.00 0.00 31.44 29.97 1p1f n GLU 274 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1p1f s ILE 275 N -3.11 3.70 0.43 -3.67 -1.09 -0.14 -4.87 121.20 112.45 1p1f s ILE 275 Ca -0.07 0.80 0.06 0.00 -2.23 0.00 0.00 60.65 59.21 1p1f s ILE 275 Cb 0.10 -3.68 0.01 0.00 -1.58 0.00 0.00 42.46 37.32 1p1f s ILE 275 CO 0.74 -0.25 0.60 0.00 -1.23 0.00 0.00 174.94 174.80 1p1f s ALA 276 N 4.99 4.35 0.18 9.38 0.00 -1.26 -4.91 121.76 134.49 1p1f s ALA 276 Ca 0.71 -1.56 -0.14 0.00 0.00 0.00 0.00 51.96 50.98 1p1f s ALA 276 Cb -0.26 -1.74 0.13 0.00 0.00 0.00 0.00 23.12 21.25 1p1f s ALA 276 CO 0.29 -0.34 1.77 -1.35 0.00 0.00 0.00 175.76 176.13 1p1f h PRO 277 N 0.56 0.42 -0.92 0.00 0.11 -1.94 -2.25 132.00 127.98 1p1f h PRO 277 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1p1f h PRO 277 Cb 1.28 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 1p1f h PRO 277 CO 0.48 0.28 0.59 0.66 -0.21 0.00 0.00 178.00 179.79 1p1f h SER 278 N 0.43 1.08 -0.62 -2.05 4.64 -1.95 -1.76 113.55 113.31 1p1f h SER 278 Ca 0.21 -0.04 0.06 0.00 -0.47 0.00 0.00 61.79 61.55 1p1f h SER 278 Cb 0.16 -0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 61.92 1p1f h SER 278 CO -0.17 0.80 0.33 0.74 -0.87 0.00 0.00 176.83 177.65 1p1f h THR 279 N 1.26 0.95 -0.45 2.95 2.02 -1.73 0.84 112.91 118.75 1p1f h THR 279 Ca 0.34 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.29 1p1f h THR 279 Cb -0.11 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.55 1p1f h THR 279 CO -0.07 0.11 0.24 0.40 0.37 0.00 0.00 175.52 176.57 1p1f h ILE 280 N 0.62 1.17 -0.33 3.11 1.08 -0.90 0.18 117.51 122.44 1p1f h ILE 280 Ca 0.28 -0.44 -0.02 0.00 -0.39 0.00 0.00 64.86 64.29 1p1f h ILE 280 Cb 0.19 0.64 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1p1f h ILE 280 CO -0.19 0.18 0.13 -0.26 -0.69 0.00 0.00 178.15 177.32 1p1f h PHE 281 N 0.58 0.51 0.28 1.37 -1.00 -0.45 0.50 116.94 118.73 1p1f h PHE 281 Ca 0.16 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 1p1f h PHE 281 Cb 0.07 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 1p1f h PHE 281 CO -0.02 0.49 -0.20 0.00 -1.61 0.00 0.00 178.31 176.97 1p1f h ALA 282 N 0.97 -0.46 -0.39 2.45 0.00 0.91 2.04 119.26 124.78 1p1f h ALA 282 Ca 0.11 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1p1f h ALA 282 Cb 0.20 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1p1f h ALA 282 CO -0.01 -0.77 0.19 0.00 0.00 0.00 0.00 179.25 178.66 1p1f h ALA 283 N 0.21 0.48 -0.18 0.00 0.00 -0.54 0.56 119.26 119.79 1p1f h ALA 283 Ca -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1p1f h ALA 283 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1p1f h ALA 283 CO 0.01 -0.17 0.11 0.00 0.00 0.00 0.00 179.25 179.20 1p1f h ALA 284 N 1.21 0.23 0.52 0.00 0.00 0.46 0.63 119.26 122.31 1p1f h ALA 284 Ca 0.17 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1p1f h ALA 284 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1p1f h ALA 284 CO -0.12 -0.27 -0.40 1.03 0.00 0.00 0.00 179.25 179.49 1p1f h SER 285 N 0.22 -1.05 0.17 0.00 0.87 0.38 -2.32 113.55 111.83 1p1f h SER 285 Ca 0.07 0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1p1f h SER 285 Cb 0.01 0.33 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 1p1f h SER 285 CO -0.01 -0.58 -0.52 0.40 -0.53 0.00 0.00 176.83 175.58 1p1f h ILE 286 N -0.90 0.01 0.00 2.23 2.04 0.34 -0.94 117.51 120.30 1p1f h ILE 286 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1p1f h ILE 286 Cb 0.76 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1p1f h ILE 286 CO 0.00 0.00 0.22 0.18 0.00 0.00 0.00 178.15 178.55 1p1f n LEU 287 N -5.50 0.39 -0.72 1.44 4.77 0.22 0.84 117.00 118.44 1p1f n LEU 287 Ca -0.09 0.61 0.10 0.00 -0.03 0.00 0.00 56.01 56.60 1p1f n LEU 287 Cb 0.42 -0.58 0.06 0.00 -2.33 0.00 0.00 43.42 40.99 1p1f n LEU 287 CO 0.17 -0.74 0.50 -0.62 -1.33 0.00 0.00 177.39 175.37 1p1f n GLU 288 N -2.09 1.74 -1.02 3.23 -0.58 -0.40 -4.97 120.64 116.56 1p1f n GLU 288 Ca -0.01 -1.51 -0.01 0.00 -0.42 0.00 0.00 57.16 55.22 1p1f n GLU 288 Cb 0.24 -1.39 -0.00 0.00 -0.57 0.00 0.00 31.44 29.72 1p1f n GLU 288 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1p1f n GLY 289 N 1.19 0.47 3.79 0.62 0.00 0.25 -5.03 105.19 106.48 1p1f n GLY 289 Ca 0.11 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1p1f n GLY 289 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p1f s VAL 290 N -1.98 5.40 0.79 1.61 -7.23 -0.94 -4.92 120.40 113.13 1p1f s VAL 290 Ca 0.00 0.30 -0.14 0.00 -1.81 0.00 0.00 61.98 60.33 1p1f s VAL 290 Cb 0.00 -3.49 0.04 0.00 0.56 0.00 0.00 36.38 33.50 1p1f s VAL 290 CO 0.00 0.51 0.98 -2.65 -0.31 0.00 0.00 175.10 173.63 1p1f n PRO 291 N 2.84 0.23 -4.07 4.82 -0.02 -1.25 -4.03 135.00 133.53 1p1f n PRO 291 Ca -0.17 0.14 -0.18 0.00 -2.02 0.00 0.00 63.50 61.28 1p1f n PRO 291 Cb 0.53 -2.25 -0.16 0.00 -0.02 0.00 0.00 33.50 31.60 1p1f n PRO 291 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1p1f s TYR 292 N -2.05 0.51 -0.13 6.00 6.14 -0.99 -1.21 117.35 125.62 1p1f s TYR 292 Ca 0.71 -0.10 0.02 0.00 0.64 0.00 0.00 57.07 58.34 1p1f s TYR 292 Cb -0.30 -0.49 0.01 0.00 0.42 0.00 0.00 41.96 41.59 1p1f s TYR 292 CO 0.53 -0.13 -0.20 0.42 0.64 0.00 0.00 175.55 176.81 1p1f s ILE 293 N 0.79 1.89 -0.71 3.14 1.01 0.28 -2.14 121.20 125.47 1p1f s ILE 293 Ca -0.09 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.49 1p1f s ILE 293 Cb -0.12 -1.69 0.10 0.00 0.01 0.00 0.00 42.46 40.76 1p1f s ILE 293 CO -0.01 0.52 0.90 0.21 0.00 0.00 0.00 174.94 176.56 1p1f s ASN 294 N 0.92 6.31 -0.02 3.58 3.04 -1.22 -0.18 114.94 127.38 1p1f s ASN 294 Ca -0.06 -1.49 0.04 0.00 0.04 0.00 0.00 52.86 51.40 1p1f s ASN 294 Cb -0.15 -2.36 0.15 0.00 -1.54 0.00 0.00 41.25 37.35 1p1f s ASN 294 CO -0.03 -1.19 0.99 0.61 -3.04 0.00 0.00 177.10 174.44 1p1f n GLY 295 N 5.28 0.47 3.37 1.21 0.00 0.44 -2.07 105.19 113.89 1p1f n GLY 295 Ca 0.02 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1p1f n GLY 295 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p1f s SER 296 N -0.71 2.88 0.28 1.61 0.01 -1.25 -3.07 113.70 113.46 1p1f s SER 296 Ca 0.11 -0.94 -0.03 0.00 1.31 0.00 0.00 55.95 56.41 1p1f s SER 296 Cb 0.07 -0.19 0.41 0.00 0.21 0.00 0.00 66.02 66.52 1p1f s SER 296 CO 0.06 -0.04 1.94 1.55 0.41 0.00 0.00 173.24 177.15 1p1f h PRO 297 N 2.88 1.14 -6.58 12.44 0.13 -1.89 -2.39 132.00 137.74 1p1f h PRO 297 Ca -0.41 -0.07 -0.59 0.00 -0.87 0.00 0.00 66.00 64.06 1p1f h PRO 297 Cb 1.22 -0.26 0.15 0.00 0.13 0.00 0.00 31.00 32.24 1p1f h PRO 297 CO 0.55 0.76 -0.06 0.00 -0.23 0.00 0.00 178.00 179.02 1p1f n GLN 298 N -4.43 0.97 -2.74 0.86 0.00 -1.26 -4.73 117.38 106.05 1p1f n GLN 298 Ca 0.12 0.36 -0.43 0.00 0.00 0.00 0.00 57.00 57.04 1p1f n GLN 298 Cb 0.07 -1.88 -0.01 0.00 0.00 0.00 0.00 30.24 28.42 1p1f n GLN 298 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1p1f s ASN 299 N -0.93 6.85 0.38 2.61 4.22 -1.26 -4.79 114.94 122.02 1p1f s ASN 299 Ca 0.66 -2.46 0.22 0.00 -2.14 0.00 0.00 52.86 49.14 1p1f s ASN 299 Cb -0.53 -2.50 0.25 0.00 1.28 0.00 0.00 41.25 39.75 1p1f s ASN 299 CO 0.55 -1.06 1.49 0.71 -2.04 0.00 0.00 177.10 176.75 1p1f h THR 300 N 5.45 0.11 -0.87 0.54 1.35 -1.93 -3.38 112.91 114.18 1p1f h THR 300 Ca 0.34 -1.15 -0.73 0.00 -0.55 0.00 0.00 66.41 64.32 1p1f h THR 300 Cb 0.91 1.97 -0.09 0.00 -1.73 0.00 0.00 68.15 69.20 1p1f h THR 300 CO 1.34 0.06 2.70 0.49 -0.25 0.00 0.00 175.52 179.86 1p1f n PHE 301 N -3.04 2.69 -1.22 4.73 3.01 -1.26 -4.78 117.46 117.59 1p1f n PHE 301 Ca 0.03 -2.88 -0.33 0.00 1.01 0.00 0.00 57.45 55.28 1p1f n PHE 301 Cb 0.56 -2.05 0.11 0.00 -0.01 0.00 0.00 39.48 38.09 1p1f n PHE 301 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1p1f s VAL 302 N 0.18 2.51 0.30 -4.37 -7.23 -1.26 -4.63 120.40 105.90 1p1f s VAL 302 Ca 0.54 0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.92 1p1f s VAL 302 Cb 0.16 -2.59 0.40 0.00 0.56 0.00 0.00 36.38 34.92 1p1f s VAL 302 CO -0.07 -0.17 1.58 1.55 -0.31 0.00 0.00 175.10 177.68 1p1f h PRO 303 N -0.88 0.02 -0.77 4.82 0.13 -1.85 0.02 132.00 133.49 1p1f h PRO 303 Ca -0.45 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 1p1f h PRO 303 Cb 1.27 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1p1f h PRO 303 CO 0.48 0.01 0.35 0.78 -0.23 0.00 0.00 178.00 179.39 1p1f h GLY 304 N 0.02 1.22 1.37 1.56 0.00 -1.49 -1.27 103.07 104.48 1p1f h GLY 304 Ca 0.58 -0.63 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1p1f h GLY 304 CO -0.90 0.60 -0.23 -2.00 0.00 0.00 0.00 176.54 174.00 1p1f h LEU 305 N 1.10 0.73 -0.43 3.11 5.85 -1.28 -2.35 115.31 122.05 1p1f h LEU 305 Ca 0.26 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 1p1f h LEU 305 Cb 0.16 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1p1f h LEU 305 CO -0.03 0.94 -0.04 0.58 -0.34 0.00 0.00 178.44 179.55 1p1f h VAL 306 N 0.63 1.27 0.00 1.05 2.07 -0.98 -2.08 116.25 118.21 1p1f h VAL 306 Ca 0.09 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1p1f h VAL 306 Cb 0.72 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1p1f h VAL 306 CO 0.06 0.38 -0.09 -0.61 0.02 0.00 0.00 177.57 177.32 1p1f h GLN 307 N 0.62 0.00 -0.21 1.57 4.15 -1.05 -1.16 115.11 119.03 1p1f h GLN 307 Ca 0.12 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.33 1p1f h GLN 307 Cb 0.55 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.25 1p1f h GLN 307 CO 0.03 0.09 -0.68 1.25 -1.93 0.00 0.00 178.83 177.60 1p1f h LEU 308 N 0.00 0.96 -1.42 -2.39 6.46 -0.92 -1.48 115.31 116.52 1p1f h LEU 308 Ca -0.00 -0.59 -0.02 0.00 -0.12 0.00 0.00 57.88 57.15 1p1f h LEU 308 Cb 0.21 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 1p1f h LEU 308 CO 0.01 1.38 0.11 0.00 -0.62 0.00 0.00 178.44 179.33 1p1f h ALA 309 N 0.60 1.55 0.22 1.25 0.00 -0.58 0.14 119.26 122.44 1p1f h ALA 309 Ca -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1p1f h ALA 309 Cb 1.30 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1p1f h ALA 309 CO 0.14 0.35 -0.10 0.93 0.00 0.00 0.00 179.25 180.57 1p1f h GLU 310 N 0.50 -0.28 -0.95 0.00 5.08 -1.15 0.41 114.58 118.18 1p1f h GLU 310 Ca 0.12 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.65 1p1f h GLU 310 Cb 0.15 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 29.36 1p1f h GLU 310 CO -0.01 0.10 0.56 1.25 -1.00 0.00 0.00 179.01 179.92 1p1f h HIS 311 N -0.85 0.99 0.07 4.33 2.76 -1.00 -2.34 115.15 119.12 1p1f h HIS 311 Ca -0.03 0.03 -0.24 0.00 -2.20 0.00 0.00 60.37 57.93 1p1f h HIS 311 Cb 0.51 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.17 1p1f h HIS 311 CO 0.06 0.28 -1.10 0.93 -1.30 0.00 0.00 177.93 176.81 1p1f h GLU 312 N 0.79 0.22 -0.68 5.26 4.39 -0.68 -3.48 114.58 120.40 1p1f h GLU 312 Ca 0.52 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1p1f h GLU 312 Cb 0.70 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1p1f h GLU 312 CO -0.34 1.12 0.00 0.41 -1.16 0.00 0.00 179.01 179.04 1p1f n GLY 313 N 1.31 0.84 3.75 -3.84 0.00 0.14 -5.03 105.19 102.36 1p1f n GLY 313 Ca -0.06 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.05 1p1f n GLY 313 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1f s THR 314 N -2.68 3.77 0.24 2.61 2.01 -0.89 -5.05 115.64 115.65 1p1f s THR 314 Ca 0.00 -1.63 0.03 0.00 0.31 0.00 0.00 61.69 60.41 1p1f s THR 314 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 1p1f s THR 314 CO 0.00 -0.31 0.38 -0.36 -0.69 0.00 0.00 174.62 173.64 1p1f s PHE 315 N -2.27 3.47 0.05 4.92 0.40 -1.26 -4.59 117.98 118.69 1p1f s PHE 315 Ca 0.34 0.09 -0.07 0.00 -0.60 0.00 0.00 56.93 56.69 1p1f s PHE 315 Cb -0.06 -1.66 -0.01 0.00 0.51 0.00 0.00 43.02 41.80 1p1f s PHE 315 CO 0.23 0.40 0.13 0.96 0.70 0.00 0.00 175.22 177.64 1p1f s ILE 316 N -1.99 0.13 -0.04 0.64 -4.36 -0.30 -2.36 121.20 112.92 1p1f s ILE 316 Ca 0.35 -1.09 0.04 0.00 -0.26 0.00 0.00 60.65 59.69 1p1f s ILE 316 Cb -0.10 -1.00 -0.00 0.00 1.25 0.00 0.00 42.46 42.61 1p1f s ILE 316 CO 0.30 -0.60 -0.17 0.00 0.24 0.00 0.00 174.94 174.70 1p1f s ALA 317 N -2.86 1.54 -0.32 2.27 0.00 -0.91 -2.49 121.76 118.99 1p1f s ALA 317 Ca -0.03 -0.70 -0.34 0.00 0.00 0.00 0.00 51.96 50.89 1p1f s ALA 317 Cb 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 23.12 22.50 1p1f s ALA 317 CO -0.06 0.28 2.18 0.41 0.00 0.00 0.00 175.76 178.57 1p1f n GLY 318 N 3.15 0.59 0.87 0.00 0.00 -1.26 -3.43 105.19 105.10 1p1f n GLY 318 Ca -0.18 0.91 -0.13 0.00 0.00 0.00 0.00 46.02 46.62 1p1f n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1f n ASP 319 N 9.94 -0.18 -1.59 1.61 10.43 -1.15 -4.53 116.55 131.08 1p1f n ASP 319 Ca 0.39 0.29 0.00 0.00 2.57 0.00 0.00 54.79 58.04 1p1f n ASP 319 Cb 0.26 -0.24 0.00 0.00 1.84 0.00 0.00 41.12 42.98 1p1f n ASP 319 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1p1f n ASP 320 N 0.45 -6.26 -4.59 -2.24 2.03 -0.88 -1.03 116.55 104.02 1p1f n ASP 320 Ca 0.05 0.94 -0.46 0.00 0.52 0.00 0.00 54.79 55.84 1p1f n ASP 320 Cb 0.04 -3.43 -0.04 0.00 -0.72 0.00 0.00 41.12 36.97 1p1f n ASP 320 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1p1f n LEU 321 N 1.10 3.18 -4.58 -2.67 4.77 -1.17 0.16 117.00 117.79 1p1f n LEU 321 Ca 0.00 0.54 -0.40 0.00 -0.03 0.00 0.00 56.01 56.11 1p1f n LEU 321 Cb 0.00 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 39.62 1p1f n LEU 321 CO 0.00 -0.42 1.72 -0.75 -1.33 0.00 0.00 177.39 176.61 1p1f s LYS 322 N 5.50 2.85 0.00 3.23 2.20 -0.53 -4.57 119.74 128.43 1p1f s LYS 322 Ca 0.99 1.33 0.00 0.00 -0.36 0.00 0.00 55.97 57.94 1p1f s LYS 322 Cb -0.56 -4.36 0.00 0.00 -1.51 0.00 0.00 37.83 31.40 1p1f s LYS 322 CO 0.43 -2.43 0.00 -1.13 -0.36 0.00 0.00 175.35 171.86 1p1f n SER 323 N 12.39 0.00 -0.13 1.43 3.41 -1.26 -4.77 113.62 124.68 1p1f n SER 323 Ca 0.27 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.61 1p1f n SER 323 Cb 0.49 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 1p1f n SER 323 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p1f n GLY 324 N 1.17 -0.41 0.30 5.00 0.00 -1.26 -3.50 105.19 106.49 1p1f n GLY 324 Ca 0.00 -0.14 0.09 0.00 0.00 0.00 0.00 46.02 45.96 1p1f n GLY 324 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1p1f h GLN 325 N -0.74 0.19 0.02 1.61 4.15 -1.97 -0.94 115.11 117.44 1p1f h GLN 325 Ca -0.65 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 58.75 1p1f h GLN 325 Cb 1.66 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.31 1p1f h GLN 325 CO -0.34 0.13 -0.01 1.15 -1.93 0.00 0.00 178.83 177.83 1p1f h THR 326 N 0.20 1.48 -0.64 2.39 2.02 -1.94 -3.04 112.91 113.38 1p1f h THR 326 Ca 0.10 -1.86 0.14 0.00 0.77 0.00 0.00 66.41 65.56 1p1f h THR 326 Cb 0.15 2.68 -0.11 0.00 -1.74 0.00 0.00 68.15 69.14 1p1f h THR 326 CO -0.02 0.46 0.04 0.11 0.37 0.00 0.00 175.52 176.48 1p1f h LYS 327 N -0.87 0.14 0.00 6.66 1.57 -1.52 0.26 116.57 122.81 1p1f h LYS 327 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1p1f h LYS 327 Cb 0.77 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1p1f h LYS 327 CO 0.00 0.09 0.00 -0.11 -0.57 0.00 0.00 179.45 178.87 1p1f n LEU 328 N -5.26 0.13 -0.01 2.94 7.94 -0.39 -2.62 117.00 119.74 1p1f n LEU 328 Ca 0.10 0.53 -0.06 0.00 -1.11 0.00 0.00 56.01 55.47 1p1f n LEU 328 Cb 0.38 -0.51 -0.13 0.00 0.53 0.00 0.00 43.42 43.69 1p1f n LEU 328 CO 0.11 -0.29 -0.46 1.17 -1.11 0.00 0.00 177.39 176.80 1p1f n LYS 329 N -1.64 0.63 -0.45 1.96 4.81 0.87 -2.00 118.16 122.33 1p1f n LYS 329 Ca 0.03 0.28 0.04 0.00 -0.87 0.00 0.00 58.31 57.80 1p1f n LYS 329 Cb 0.19 -1.80 0.22 0.00 0.02 0.00 0.00 35.03 33.66 1p1f n LYS 329 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1p1f n SER 330 N -3.00 3.41 0.00 3.14 3.41 -0.93 -1.48 113.62 118.17 1p1f n SER 330 Ca -0.15 -2.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 1p1f n SER 330 Cb 1.00 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1p1f n SER 330 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1p1f n VAL 331 N 0.41 0.00 -0.03 -3.33 0.31 -1.21 -3.38 118.33 111.10 1p1f n VAL 331 Ca 0.15 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.35 1p1f n VAL 331 Cb 0.71 -1.25 -0.08 0.00 -0.91 0.00 0.00 33.84 32.31 1p1f n VAL 331 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1p1f h LEU 332 N 0.00 0.15 -0.64 7.52 7.12 -1.44 -1.80 115.31 126.23 1p1f h LEU 332 Ca 0.00 -0.45 -0.07 0.00 0.13 0.00 0.00 57.88 57.49 1p1f h LEU 332 Cb 0.86 -0.04 -0.03 0.00 -0.53 0.00 0.00 40.66 40.93 1p1f h LEU 332 CO 0.00 0.57 0.13 0.00 -0.13 0.00 0.00 178.44 179.01 1p1f h ALA 333 N 0.59 0.84 0.69 1.25 0.00 -1.51 -2.63 119.26 118.49 1p1f h ALA 333 Ca 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1p1f h ALA 333 Cb 0.52 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1p1f h ALA 333 CO 0.01 0.58 -0.40 0.37 0.00 0.00 0.00 179.25 179.82 1p1f h GLN 334 N 0.95 -0.97 -0.92 0.00 5.75 -1.73 -2.57 115.11 115.61 1p1f h GLN 334 Ca 0.20 0.07 0.29 0.00 -0.15 0.00 0.00 58.65 59.05 1p1f h GLN 334 Cb 0.40 0.22 -0.17 0.00 1.07 0.00 0.00 27.48 29.00 1p1f h GLN 334 CO 0.01 -0.65 0.15 0.34 -2.65 0.00 0.00 178.83 176.03 1p1f n PHE 335 N -4.93 0.72 -0.15 3.99 7.35 -0.68 -0.66 117.46 123.11 1p1f n PHE 335 Ca -0.12 1.11 -0.11 0.00 -0.76 0.00 0.00 57.45 57.56 1p1f n PHE 335 Cb 0.41 -1.28 -0.01 0.00 0.35 0.00 0.00 39.48 38.96 1p1f n PHE 335 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1p1f h LEU 336 N 0.00 0.92 -0.57 -2.13 4.07 -1.13 -2.81 115.31 113.66 1p1f h LEU 336 Ca 0.62 -0.38 -0.02 0.00 0.08 0.00 0.00 57.88 58.18 1p1f h LEU 336 Cb 1.41 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 42.89 1p1f h LEU 336 CO -0.83 1.10 -0.08 0.58 -1.08 0.00 0.00 178.44 178.13 1p1f h VAL 337 N 0.74 0.15 0.00 1.22 2.07 -0.51 -0.27 116.25 119.66 1p1f h VAL 337 Ca 0.11 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1p1f h VAL 337 Cb 0.72 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 1p1f h VAL 337 CO 0.05 0.07 0.00 0.47 0.02 0.00 0.00 177.57 178.19 1p1f n ASP 338 N -3.14 0.64 -0.79 0.57 10.43 -0.23 -3.11 116.55 120.91 1p1f n ASP 338 Ca 0.02 0.58 0.07 0.00 2.57 0.00 0.00 54.79 58.03 1p1f n ASP 338 Cb 0.47 -0.74 0.22 0.00 1.84 0.00 0.00 41.12 42.91 1p1f n ASP 338 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1p1f n ALA 339 N -1.73 2.70 -1.07 2.24 0.00 -1.08 -4.95 120.51 116.63 1p1f n ALA 339 Ca 0.05 -1.90 -0.02 0.00 0.00 0.00 0.00 53.44 51.56 1p1f n ALA 339 Cb 0.38 -0.61 -0.01 0.00 0.00 0.00 0.00 19.45 19.21 1p1f n ALA 339 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p1f n GLY 340 N -0.17 0.57 3.80 0.00 0.00 -1.18 -5.02 105.19 103.18 1p1f n GLY 340 Ca 0.18 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1p1f n GLY 340 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1f s ILE 341 N -1.97 5.25 -0.56 -0.61 1.01 -0.13 -4.99 121.20 119.19 1p1f s ILE 341 Ca 0.00 0.59 -0.12 0.00 0.00 0.00 0.00 60.65 61.12 1p1f s ILE 341 Cb 0.00 -3.62 0.14 0.00 0.01 0.00 0.00 42.46 38.99 1p1f s ILE 341 CO 0.00 0.50 0.48 -0.75 0.00 0.00 0.00 174.94 175.17 1p1f s LYS 342 N -0.40 2.85 0.10 2.79 2.20 -1.14 -3.66 119.74 122.47 1p1f s LYS 342 Ca 0.19 -1.90 -0.31 0.00 -0.36 0.00 0.00 55.97 53.60 1p1f s LYS 342 Cb -0.14 -4.14 -0.07 0.00 -1.51 0.00 0.00 37.83 31.97 1p1f s LYS 342 CO 0.08 -1.26 1.34 -1.25 -0.36 0.00 0.00 175.35 173.90 1p1f s PRO 343 N 1.19 4.34 -0.03 4.03 0.04 -1.26 0.67 135.00 143.98 1p1f s PRO 343 Ca 0.07 2.00 0.15 0.00 0.04 0.00 0.00 61.00 63.26 1p1f s PRO 343 Cb -0.25 -3.29 -0.24 0.00 0.04 0.00 0.00 34.50 30.77 1p1f s PRO 343 CO -0.01 -0.40 0.32 1.55 0.04 0.00 0.00 177.00 178.50 1p1f n VAL 344 N 3.98 0.05 -3.79 -0.36 3.14 -0.68 -4.86 118.33 115.82 1p1f n VAL 344 Ca 0.11 -0.37 -0.13 0.00 -2.96 0.00 0.00 64.34 61.00 1p1f n VAL 344 Cb 0.43 0.11 -0.09 0.00 -1.06 0.00 0.00 33.84 33.23 1p1f n VAL 344 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1p1f s SER 345 N -3.83 -0.17 -0.18 6.55 0.15 -0.99 -2.25 113.70 112.98 1p1f s SER 345 Ca -0.06 0.11 -0.08 0.00 0.70 0.00 0.00 55.95 56.63 1p1f s SER 345 Cb 0.10 0.34 0.08 0.00 -1.71 0.00 0.00 66.02 64.82 1p1f s SER 345 CO 0.64 -0.37 0.41 -0.63 1.20 0.00 0.00 173.24 174.49 1p1f s ILE 346 N -1.09 -0.38 -0.09 6.45 1.01 0.61 -1.59 121.20 126.12 1p1f s ILE 346 Ca -0.12 0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.70 1p1f s ILE 346 Cb -0.05 -0.64 0.01 0.00 0.01 0.00 0.00 42.46 41.79 1p1f s ILE 346 CO 0.03 0.06 -0.16 0.00 0.00 0.00 0.00 174.94 174.87 1p1f s ALA 347 N 2.10 1.67 -0.20 9.38 0.00 -0.46 -2.48 121.76 131.77 1p1f s ALA 347 Ca -0.05 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 1p1f s ALA 347 Cb -0.10 -0.74 -0.00 0.00 0.00 0.00 0.00 23.12 22.27 1p1f s ALA 347 CO -0.13 0.07 -0.09 -1.12 0.00 0.00 0.00 175.76 174.50 1p1f s SER 348 N 0.73 4.04 0.18 0.00 0.01 -0.26 -1.17 113.70 117.23 1p1f s SER 348 Ca -0.12 -0.43 0.10 0.00 1.31 0.00 0.00 55.95 56.82 1p1f s SER 348 Cb -0.16 -1.67 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 1p1f s SER 348 CO 0.03 0.02 -0.18 -0.31 0.41 0.00 0.00 173.24 173.20 1p1f s TYR 349 N 1.25 2.45 -0.28 2.43 2.02 0.92 -0.07 117.35 126.07 1p1f s TYR 349 Ca 0.03 -0.30 -0.26 0.00 -0.37 0.00 0.00 57.07 56.17 1p1f s TYR 349 Cb -0.14 -1.22 0.17 0.00 -0.40 0.00 0.00 41.96 40.37 1p1f s TYR 349 CO -0.04 0.49 1.31 0.54 -1.57 0.00 0.00 175.55 176.29 1p1f s ASN 350 N -2.68 -0.16 -0.33 2.29 2.20 0.38 -0.90 114.94 115.74 1p1f s ASN 350 Ca 0.22 0.28 0.17 0.00 -0.94 0.00 0.00 52.86 52.59 1p1f s ASN 350 Cb -0.08 0.28 0.45 0.00 -2.00 0.00 0.00 41.25 39.89 1p1f s ASN 350 CO 0.12 -0.07 1.06 0.00 -2.94 0.00 0.00 177.10 175.26 1p1f n HIS 351 N 1.50 0.40 0.00 1.54 1.44 -1.13 -1.61 115.22 117.36 1p1f n HIS 351 Ca -0.09 -2.53 0.00 0.00 -2.01 0.00 0.00 57.72 53.08 1p1f n HIS 351 Cb 0.57 0.06 0.00 0.00 0.12 0.00 0.00 29.99 30.74 1p1f n HIS 351 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1p1f n VAL 376 N -0.26 0.00 0.07 0.61 0.31 -1.26 -2.21 118.33 115.60 1p1f n VAL 376 Ca 0.06 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.42 1p1f n VAL 376 Cb 0.83 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.81 1p1f n VAL 376 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1p1f n ILE 377 N -0.09 0.52 -0.25 2.52 -5.35 -1.26 -4.59 119.36 110.84 1p1f n ILE 377 Ca 0.00 -0.76 0.02 0.00 -0.27 0.00 0.00 62.75 61.75 1p1f n ILE 377 Cb 0.00 0.80 0.15 0.00 -1.74 0.00 0.00 39.64 38.86 1p1f n ILE 377 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1p1f h ASP 378 N 1.15 0.46 0.00 7.28 3.45 -1.99 -0.83 116.42 125.93 1p1f h ASP 378 Ca 0.00 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.53 1p1f h ASP 378 Cb 0.45 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.21 1p1f h ASP 378 CO 0.00 0.25 0.00 -0.90 -1.57 0.00 0.00 179.24 177.02 1p1f n ASP 379 N -4.87 3.84 0.00 6.45 5.75 -1.26 -2.24 116.55 124.22 1p1f n ASP 379 Ca 0.12 -2.05 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1p1f n ASP 379 Cb 0.30 -0.76 0.00 0.00 -1.03 0.00 0.00 41.12 39.64 1p1f n ASP 379 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1p1f n ILE 380 N 1.09 0.00 0.30 2.12 5.41 -0.37 -4.45 119.36 123.46 1p1f n ILE 380 Ca 0.00 0.00 0.17 0.00 1.00 0.00 0.00 62.75 63.92 1p1f n ILE 380 Cb 0.45 -0.28 0.93 0.00 -0.71 0.00 0.00 39.64 40.03 1p1f n ILE 380 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1p1f h ILE 381 N 0.00 0.30 0.00 1.39 2.04 -1.11 -1.72 117.51 118.41 1p1f h ILE 381 Ca 0.00 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1p1f h ILE 381 Cb 0.00 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1p1f h ILE 381 CO 0.00 0.04 -1.48 0.00 0.00 0.00 0.00 178.15 176.71 1p1f n ALA 382 N -2.20 2.90 1.82 1.87 0.00 -0.95 -4.14 120.51 119.82 1p1f n ALA 382 Ca -0.02 -0.41 0.01 0.00 0.00 0.00 0.00 53.44 53.01 1p1f n ALA 382 Cb 0.16 -0.90 0.02 0.00 0.00 0.00 0.00 19.45 18.72 1p1f n ALA 382 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p1f n SER 383 N -2.31 0.26 -3.15 0.00 3.41 -0.65 -4.60 113.62 106.59 1p1f n SER 383 Ca -0.01 -2.00 0.04 0.00 -0.26 0.00 0.00 58.87 56.63 1p1f n SER 383 Cb 0.53 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.42 1p1f n SER 383 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1p1f s ASN 384 N -0.95 -1.39 0.00 4.04 3.84 -1.24 -4.99 114.94 114.26 1p1f s ASN 384 Ca 0.03 0.59 0.22 0.00 0.21 0.00 0.00 52.86 53.90 1p1f s ASN 384 Cb 0.01 2.05 0.54 0.00 -0.55 0.00 0.00 41.25 43.30 1p1f s ASN 384 CO 0.02 -0.26 1.46 -0.90 -2.79 0.00 0.00 177.10 174.63 1p1f n ASP 385 N 5.42 3.37 0.07 -4.21 3.85 -1.26 -1.91 116.55 121.88 1p1f n ASP 385 Ca 0.01 -1.97 -0.21 0.00 -0.71 0.00 0.00 54.79 51.90 1p1f n ASP 385 Cb 0.52 -0.34 -0.13 0.00 -1.35 0.00 0.00 41.12 39.83 1p1f n ASP 385 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 1p1f h ILE 386 N 4.00 1.33 0.00 2.12 2.04 -1.96 -3.37 117.51 121.66 1p1f h ILE 386 Ca 0.00 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.47 1p1f h ILE 386 Cb 0.90 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 1p1f h ILE 386 CO 0.00 0.72 -0.02 -0.07 0.00 0.00 0.00 178.15 178.77 1p1f h LEU 387 N 0.15 0.00 -8.52 1.44 4.07 -1.95 -3.45 115.31 107.04 1p1f h LEU 387 Ca -0.16 0.00 -0.70 0.00 0.08 0.00 0.00 57.88 57.09 1p1f h LEU 387 Cb 1.78 0.00 -0.20 0.00 1.08 0.00 0.00 40.66 43.32 1p1f h LEU 387 CO 0.21 0.29 -0.28 -0.31 -1.08 0.00 0.00 178.44 177.27 1p1f s TYR 388 N -1.34 3.19 0.38 1.13 1.51 -0.80 -4.66 117.35 116.76 1p1f s TYR 388 Ca -0.01 -0.46 -0.07 0.00 -1.01 0.00 0.00 57.07 55.52 1p1f s TYR 388 Cb 0.00 -2.81 0.03 0.00 -0.11 0.00 0.00 41.96 39.08 1p1f s TYR 388 CO 0.01 -0.67 0.63 0.27 -1.11 0.00 0.00 175.55 174.68 1p1f n ASN 389 N 5.45 -1.79 0.24 2.29 0.23 -0.43 -4.08 115.26 117.17 1p1f n ASN 389 Ca -0.09 -2.81 0.09 0.00 -0.53 0.00 0.00 54.58 51.24 1p1f n ASN 389 Cb 0.47 3.15 0.58 0.00 -2.08 0.00 0.00 39.78 41.90 1p1f n ASN 389 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1p1f h ASP 390 N 2.02 0.00 0.08 0.53 3.45 -1.93 0.38 116.42 120.95 1p1f h ASP 390 Ca -0.30 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.15 1p1f h ASP 390 Cb 1.23 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.01 1p1f h ASP 390 CO 0.40 0.19 -0.04 0.11 -1.57 0.00 0.00 179.24 178.33 1p1f h LYS 391 N 0.00 -0.10 0.00 3.56 1.79 -1.97 -3.36 116.57 116.48 1p1f h LYS 391 Ca -0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1p1f h LYS 391 Cb 0.42 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1p1f h LYS 391 CO 0.02 -0.07 -0.04 1.28 -1.08 0.00 0.00 179.45 179.57 1p1f n LEU 392 N -4.73 0.79 0.00 2.94 4.77 -1.24 -5.04 117.00 114.49 1p1f n LEU 392 Ca -0.01 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1p1f n LEU 392 Cb 0.04 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1p1f n LEU 392 CO 0.03 -0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 1p1f n GLY 393 N 1.32 2.39 0.00 -0.72 0.00 0.13 -4.87 105.19 103.44 1p1f n GLY 393 Ca 0.05 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1p1f n GLY 393 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1p1f n LYS 394 N 1.54 0.28 -3.42 1.61 2.85 -1.22 -1.31 118.16 118.49 1p1f n LYS 394 Ca 0.00 -0.51 -0.38 0.00 -1.05 0.00 0.00 58.31 56.37 1p1f n LYS 394 Cb 0.00 -0.56 -0.07 0.00 -0.65 0.00 0.00 35.03 33.74 1p1f n LYS 394 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1p1f s LYS 395 N -0.10 4.19 -0.23 -1.58 1.02 -1.26 -4.98 119.74 116.80 1p1f s LYS 395 Ca 0.00 0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.17 1p1f s LYS 395 Cb 0.00 -3.52 0.03 0.00 -0.52 0.00 0.00 37.83 33.83 1p1f s LYS 395 CO 0.00 0.02 -0.12 0.08 -0.92 0.00 0.00 175.35 174.41 1p1f s VAL 396 N 1.14 2.44 -0.41 3.17 1.01 -1.26 -4.87 120.40 121.61 1p1f s VAL 396 Ca 0.18 -1.15 -0.29 0.00 0.00 0.00 0.00 61.98 60.73 1p1f s VAL 396 Cb -0.14 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.02 1p1f s VAL 396 CO 0.07 0.25 1.47 -1.81 0.00 0.00 0.00 175.10 175.08 1p1f s ASP 397 N 1.26 6.25 0.25 3.32 -0.00 -0.95 -4.88 116.67 121.92 1p1f s ASP 397 Ca -0.01 0.84 0.10 0.00 -0.00 0.00 0.00 52.55 53.48 1p1f s ASP 397 Cb -0.16 -2.54 -0.04 0.00 -0.00 0.00 0.00 42.92 40.18 1p1f s ASP 397 CO -0.07 -1.50 -0.03 -2.28 -0.00 0.00 0.00 175.17 171.28 1p1f s HIS 398 N 5.71 2.66 -0.30 4.23 2.46 -1.23 0.22 115.29 129.05 1p1f s HIS 398 Ca 0.63 -0.23 -0.18 0.00 0.47 0.00 0.00 55.06 55.76 1p1f s HIS 398 Cb -0.14 -1.20 0.18 0.00 -0.13 0.00 0.00 32.58 31.29 1p1f s HIS 398 CO 0.32 0.61 1.19 0.00 -2.47 0.00 0.00 174.74 174.40 1p1f s ILE 400 N 2.34 5.24 -0.19 0.00 1.01 -1.26 -1.11 121.20 127.23 1p1f s ILE 400 Ca -0.02 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 1p1f s ILE 400 Cb -0.04 -3.80 0.08 0.00 0.01 0.00 0.00 42.46 38.71 1p1f s ILE 400 CO -0.15 -0.27 0.15 -0.69 0.00 0.00 0.00 174.94 173.99 1p1f s VAL 401 N -1.95 -0.20 -0.66 2.92 1.01 0.90 -4.93 120.40 117.49 1p1f s VAL 401 Ca 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1p1f s VAL 401 Cb -0.10 -0.63 0.17 0.00 0.00 0.00 0.00 36.38 35.81 1p1f s VAL 401 CO 0.30 -0.25 0.47 -0.63 0.00 0.00 0.00 175.10 174.98 1p1f s ILE 402 N 2.23 3.42 0.25 2.22 1.01 -1.26 -0.47 121.20 128.60 1p1f s ILE 402 Ca 0.04 -3.44 -0.05 0.00 0.00 0.00 0.00 60.65 57.21 1p1f s ILE 402 Cb -0.16 -3.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.02 1p1f s ILE 402 CO -0.11 -0.92 0.51 -0.54 0.00 0.00 0.00 174.94 173.88 1p1f s LYS 403 N -0.59 3.64 -0.01 2.79 -0.14 -0.63 -4.99 119.74 119.81 1p1f s LYS 403 Ca 0.20 -0.01 -0.02 0.00 -1.36 0.00 0.00 55.97 54.78 1p1f s LYS 403 Cb -0.17 -2.70 -0.04 0.00 -1.68 0.00 0.00 37.83 33.24 1p1f s LYS 403 CO -0.06 0.29 0.13 1.52 -0.76 0.00 0.00 175.35 176.47 1p1f s TYR 404 N -1.95 3.41 -0.30 3.18 -0.85 -1.26 -3.91 117.35 115.66 1p1f s TYR 404 Ca 0.43 0.29 0.02 0.00 -0.52 0.00 0.00 57.07 57.29 1p1f s TYR 404 Cb -0.11 -1.79 0.16 0.00 0.38 0.00 0.00 41.96 40.60 1p1f s TYR 404 CO 0.28 0.60 0.41 -1.64 -1.52 0.00 0.00 175.55 173.68 1p1f s MET 405 N -1.77 0.44 0.50 -3.49 -1.94 -1.26 -5.05 119.30 106.74 1p1f s MET 405 Ca 0.24 0.03 0.20 0.00 -1.71 0.00 0.00 55.69 54.45 1p1f s MET 405 Cb -0.12 -0.34 1.27 0.00 2.01 0.00 0.00 34.83 37.65 1p1f s MET 405 CO 0.15 -1.06 2.03 -0.22 -0.01 0.00 0.00 175.02 175.92 1p1f h LYS 406 N 8.04 0.10 0.00 2.03 3.64 -1.97 -3.30 116.57 125.10 1p1f h LYS 406 Ca -0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1p1f h LYS 406 Cb 1.11 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1p1f h LYS 406 CO 0.26 0.06 0.00 -2.30 -2.27 0.00 0.00 179.45 175.20 1p1f n PRO 407 N -4.44 0.00 -0.24 1.90 -0.02 -1.26 -2.28 135.00 128.65 1p1f n PRO 407 Ca 0.06 0.71 0.31 0.00 -2.02 0.00 0.00 63.50 62.56 1p1f n PRO 407 Cb 0.41 -1.39 0.56 0.00 -0.02 0.00 0.00 33.50 33.06 1p1f n PRO 407 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p1f h VAL 408 N 0.00 0.08 -0.04 -1.45 2.07 -1.93 -3.47 116.25 111.52 1p1f h VAL 408 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1p1f h VAL 408 Cb 0.00 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.90 1p1f h VAL 408 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 1p1f n GLY 409 N -1.71 -0.01 0.00 2.17 0.00 -0.97 -3.11 105.19 101.56 1p1f n GLY 409 Ca 0.24 -0.97 0.01 0.00 0.00 0.00 0.00 46.02 45.30 1p1f n GLY 409 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1f n ASP 410 N -0.43 0.00 -3.74 1.61 4.64 -1.26 -4.09 116.55 113.27 1p1f n ASP 410 Ca 0.00 -0.51 -0.42 0.00 -1.38 0.00 0.00 54.79 52.48 1p1f n ASP 410 Cb 0.00 0.00 0.01 0.00 -1.04 0.00 0.00 41.12 40.09 1p1f n ASP 410 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 1p1f n SER 411 N -0.59 6.77 -4.60 1.67 7.64 -1.18 -3.20 113.62 120.12 1p1f n SER 411 Ca 0.01 -3.34 -0.41 0.00 1.01 0.00 0.00 58.87 56.14 1p1f n SER 411 Cb 0.01 -1.32 0.02 0.00 -1.01 0.00 0.00 64.21 61.91 1p1f n SER 411 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1p1f n LYS 412 N 1.67 1.24 -3.98 1.43 0.00 -1.02 -4.68 118.16 112.82 1p1f n LYS 412 Ca 0.44 0.45 -0.31 0.00 0.00 0.00 0.00 58.31 58.89 1p1f n LYS 412 Cb 0.30 -2.04 -0.15 0.00 0.00 0.00 0.00 35.03 33.14 1p1f n LYS 412 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1p1f s VAL 413 N -1.34 1.77 -0.11 3.15 1.01 -0.94 -2.37 120.40 121.57 1p1f s VAL 413 Ca 0.65 -1.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 1p1f s VAL 413 Cb -0.53 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1p1f s VAL 413 CO 0.55 -0.11 0.11 0.00 0.00 0.00 0.00 175.10 175.66 1p1f s ALA 414 N 1.28 3.75 -0.06 5.51 0.00 0.14 -2.85 121.76 129.53 1p1f s ALA 414 Ca -0.06 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.23 1p1f s ALA 414 Cb -0.19 -1.86 0.02 0.00 0.00 0.00 0.00 23.12 21.09 1p1f s ALA 414 CO -0.06 0.62 -0.05 -1.64 0.00 0.00 0.00 175.76 174.62 1p1f s MET 415 N -1.02 0.98 -0.02 0.00 -1.94 -0.08 -0.22 119.30 117.00 1p1f s MET 415 Ca 0.15 -0.13 0.05 0.00 -1.71 0.00 0.00 55.69 54.05 1p1f s MET 415 Cb -0.12 -1.00 -0.01 0.00 2.01 0.00 0.00 34.83 35.71 1p1f s MET 415 CO 0.04 -0.12 -0.16 -0.51 -0.01 0.00 0.00 175.02 174.27 1p1f s ASP 416 N 1.11 1.87 -0.17 3.03 1.11 0.76 -0.06 116.67 124.32 1p1f s ASP 416 Ca -0.08 -0.29 0.01 0.00 0.18 0.00 0.00 52.55 52.37 1p1f s ASP 416 Cb -0.14 -0.28 0.03 0.00 1.07 0.00 0.00 42.92 43.60 1p1f s ASP 416 CO -0.01 0.18 -0.13 -0.70 1.18 0.00 0.00 175.17 175.69 1p1f s GLU 417 N -0.26 2.25 -0.21 8.23 2.56 -0.31 -0.35 118.70 130.61 1p1f s GLU 417 Ca 0.04 -0.69 -0.04 0.00 0.00 0.00 0.00 54.97 54.28 1p1f s GLU 417 Cb -0.07 -2.26 -0.02 0.00 2.00 0.00 0.00 34.13 33.78 1p1f s GLU 417 CO -0.00 -0.31 -0.02 0.71 -0.56 0.00 0.00 175.26 175.08 1p1f s TYR 418 N 1.44 2.99 -0.44 5.30 1.51 -0.27 -1.35 117.35 126.52 1p1f s TYR 418 Ca 0.03 -0.69 0.04 0.00 -1.01 0.00 0.00 57.07 55.43 1p1f s TYR 418 Cb -0.14 -2.09 0.12 0.00 -0.11 0.00 0.00 41.96 39.74 1p1f s TYR 418 CO -0.10 -0.39 0.17 -0.47 -1.11 0.00 0.00 175.55 173.65 1p1f s TYR 419 N 1.22 3.34 0.54 2.71 5.04 -0.62 -1.01 117.35 128.57 1p1f s TYR 419 Ca 0.03 -3.05 0.04 0.00 -2.44 0.00 0.00 57.07 51.64 1p1f s TYR 419 Cb -0.14 -2.80 0.04 0.00 0.35 0.00 0.00 41.96 39.40 1p1f s TYR 419 CO -0.00 -0.83 0.74 -1.12 -1.34 0.00 0.00 175.55 173.00 1p1f s SER 420 N 0.25 5.26 0.01 4.32 0.01 -0.37 -1.68 113.70 121.50 1p1f s SER 420 Ca 0.14 -0.23 0.03 0.00 1.31 0.00 0.00 55.95 57.20 1p1f s SER 420 Cb -0.23 -0.62 -0.03 0.00 0.21 0.00 0.00 66.02 65.34 1p1f s SER 420 CO -0.04 -1.13 -0.06 -1.61 0.41 0.00 0.00 173.24 170.81 1p1f s GLU 421 N -4.68 2.58 0.37 12.44 2.02 0.21 -1.52 118.70 130.11 1p1f s GLU 421 Ca 0.58 -0.71 0.08 0.00 0.02 0.00 0.00 54.97 54.94 1p1f s GLU 421 Cb -0.09 -2.53 -0.06 0.00 0.10 0.00 0.00 34.13 31.55 1p1f s GLU 421 CO 0.38 0.60 0.05 -0.51 0.02 0.00 0.00 175.26 175.80 1p1f s LEU 422 N -1.47 3.00 0.70 1.80 1.43 -0.53 -2.90 118.68 120.73 1p1f s LEU 422 Ca 0.18 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 52.05 1p1f s LEU 422 Cb -0.11 -1.32 0.01 0.00 0.03 0.00 0.00 46.19 44.80 1p1f s LEU 422 CO 0.08 -0.34 1.06 1.15 0.23 0.00 0.00 176.35 178.53 1p1f n MET 423 N -1.03 0.63 -3.92 1.70 0.00 -1.26 -3.65 117.12 109.60 1p1f n MET 423 Ca -0.03 0.27 -0.30 0.00 0.00 0.00 0.00 57.70 57.64 1p1f n MET 423 Cb 0.63 -2.30 0.02 0.00 0.00 0.00 0.00 33.22 31.57 1p1f n MET 423 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1p1f n LEU 424 N -1.81 -2.52 0.00 3.17 4.77 -1.26 -3.18 117.00 116.17 1p1f n LEU 424 Ca 0.14 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 1p1f n LEU 424 Cb 0.49 -2.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.07 1p1f n LEU 424 CO 0.48 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 1p1f n GLY 425 N -1.66 3.08 3.67 -0.72 0.00 -1.24 -5.05 105.19 103.27 1p1f n GLY 425 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1p1f n GLY 425 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p1f s GLY 426 N -2.21 1.61 0.22 -0.02 0.00 -1.19 -4.88 107.32 100.84 1p1f s GLY 426 Ca 0.00 -0.88 -0.08 0.00 0.00 0.00 0.00 44.72 43.76 1p1f s GLY 426 CO 0.00 -0.07 0.33 0.30 0.00 0.00 0.00 173.10 173.65 1p1f s HIS 427 N -3.16 0.65 -0.11 1.90 3.76 -1.26 -1.45 115.29 115.62 1p1f s HIS 427 Ca 0.70 -0.96 -0.02 0.00 -0.15 0.00 0.00 55.06 54.63 1p1f s HIS 427 Cb -0.10 -0.11 0.04 0.00 1.11 0.00 0.00 32.58 33.51 1p1f s HIS 427 CO 0.56 -0.83 0.02 1.21 -0.85 0.00 0.00 174.74 174.85 1p1f s ASN 428 N -3.06 2.01 -0.42 1.40 2.47 -0.58 -4.77 114.94 112.00 1p1f s ASN 428 Ca 0.28 -0.33 -0.09 0.00 0.42 0.00 0.00 52.86 53.13 1p1f s ASN 428 Cb 0.03 -0.46 0.07 0.00 -1.45 0.00 0.00 41.25 39.44 1p1f s ASN 428 CO 0.09 -0.24 0.26 -0.60 -3.72 0.00 0.00 177.10 172.89 1p1f s ARG 429 N 1.96 2.62 -0.46 0.43 3.52 -1.26 -1.24 118.95 124.52 1p1f s ARG 429 Ca 0.03 -1.43 -0.10 0.00 -0.13 0.00 0.00 55.73 54.10 1p1f s ARG 429 Cb -0.14 -3.78 0.11 0.00 -1.56 0.00 0.00 34.95 29.58 1p1f s ARG 429 CO -0.06 -0.94 0.34 0.42 -0.81 0.00 0.00 175.30 174.25 1p1f s ILE 430 N 1.44 4.32 -0.37 4.11 1.01 -0.18 -4.97 121.20 126.56 1p1f s ILE 430 Ca 0.03 -1.65 -0.10 0.00 0.00 0.00 0.00 60.65 58.92 1p1f s ILE 430 Cb -0.23 -3.78 0.03 0.00 0.01 0.00 0.00 42.46 38.49 1p1f s ILE 430 CO 0.02 -0.71 0.20 -0.94 0.00 0.00 0.00 174.94 173.51 1p1f s SER 431 N 2.61 5.69 -0.14 3.58 1.04 -1.26 -1.11 113.70 124.11 1p1f s SER 431 Ca 0.05 -1.04 -0.06 0.00 0.48 0.00 0.00 55.95 55.38 1p1f s SER 431 Cb -0.26 -2.01 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 1p1f s SER 431 CO 0.00 -0.39 0.08 -0.51 0.98 0.00 0.00 173.24 173.40 1p1f s ILE 432 N 1.53 4.96 -0.13 -1.02 2.07 0.53 -4.97 121.20 124.18 1p1f s ILE 432 Ca 0.02 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.30 1p1f s ILE 432 Cb -0.19 -3.18 0.00 0.00 0.13 0.00 0.00 42.46 39.22 1p1f s ILE 432 CO 0.06 0.55 -0.22 -2.28 -1.91 0.00 0.00 174.94 171.14 1p1f s HIS 433 N -0.39 2.65 -0.13 3.50 5.65 -1.26 -0.17 115.29 125.13 1p1f s HIS 433 Ca 0.10 -1.16 -0.04 0.00 0.25 0.00 0.00 55.06 54.21 1p1f s HIS 433 Cb -0.12 -1.78 0.07 0.00 -1.18 0.00 0.00 32.58 29.57 1p1f s HIS 433 CO 0.02 -0.50 0.23 1.21 -0.65 0.00 0.00 174.74 175.05 1p1f s ASN 434 N 0.60 0.64 0.01 9.88 2.47 0.70 -5.01 114.94 124.23 1p1f s ASN 434 Ca -0.12 0.37 0.08 0.00 0.42 0.00 0.00 52.86 53.61 1p1f s ASN 434 Cb -0.16 0.54 -0.03 0.00 -1.45 0.00 0.00 41.25 40.15 1p1f s ASN 434 CO 0.03 -0.26 -0.23 0.54 -3.72 0.00 0.00 177.10 173.46 1p1f s VAL 435 N 2.37 2.33 0.04 -5.21 0.11 -1.26 -0.68 120.40 118.10 1p1f s VAL 435 Ca 0.03 -1.18 -0.13 0.00 -2.93 0.00 0.00 61.98 57.77 1p1f s VAL 435 Cb -0.13 -1.89 0.04 0.00 -1.53 0.00 0.00 36.38 32.88 1p1f s VAL 435 CO -0.09 0.46 0.60 0.00 -3.33 0.00 0.00 175.10 172.75 1p1f s GLU 437 N -2.02 2.78 0.06 0.00 2.02 -1.26 -2.42 118.70 117.86 1p1f s GLU 437 Ca 0.14 -1.90 -0.11 0.00 0.02 0.00 0.00 54.97 53.12 1p1f s GLU 437 Cb -0.01 -4.09 -0.02 0.00 0.10 0.00 0.00 34.13 30.11 1p1f s GLU 437 CO 0.01 -1.25 0.91 -0.25 0.02 0.00 0.00 175.26 174.70 1p1f n ASP 438 N 4.78 -0.37 -0.47 -0.19 10.43 -1.20 0.25 116.55 129.79 1p1f n ASP 438 Ca -0.06 0.99 0.39 0.00 2.57 0.00 0.00 54.79 58.68 1p1f n ASP 438 Cb 0.41 -0.27 0.68 0.00 1.84 0.00 0.00 41.12 43.78 1p1f n ASP 438 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1p1f h SER 439 N 0.00 0.20 0.70 -2.24 0.02 -1.94 2.54 113.55 112.83 1p1f h SER 439 Ca 0.06 0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 61.00 1p1f h SER 439 Cb 0.14 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 1p1f h SER 439 CO -0.33 -0.15 -0.55 -0.07 -1.14 0.00 0.00 176.83 174.59 1p1f h LEU 440 N 0.07 0.00 0.15 5.07 4.07 -0.59 0.43 115.31 124.51 1p1f h LEU 440 Ca 0.83 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 58.43 1p1f h LEU 440 Cb 2.71 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 44.45 1p1f h LEU 440 CO -0.35 0.55 -1.84 -0.07 -1.08 0.00 0.00 178.44 175.65 1p1f h LEU 441 N 0.00 0.49 -0.82 1.67 3.38 0.40 -3.38 115.31 117.06 1p1f h LEU 441 Ca -0.01 -0.87 -0.12 0.00 0.09 0.00 0.00 57.88 56.97 1p1f h LEU 441 Cb 1.05 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1p1f h LEU 441 CO 0.07 1.76 -0.59 0.00 0.09 0.00 0.00 178.44 179.78 1p1f h ALA 442 N 0.17 1.02 -0.28 1.53 0.00 0.93 -3.23 119.26 119.40 1p1f h ALA 442 Ca -0.37 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 53.89 1p1f h ALA 442 Cb 2.06 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.76 1p1f h ALA 442 CO 0.13 0.73 -0.28 1.15 0.00 0.00 0.00 179.25 180.98 1p1f h THR 443 N 0.00 1.30 -0.05 0.00 2.02 -1.09 -2.53 112.91 112.56 1p1f h THR 443 Ca -0.01 -1.45 -0.10 0.00 0.77 0.00 0.00 66.41 65.62 1p1f h THR 443 Cb 1.05 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 1p1f h THR 443 CO 0.08 0.46 -0.42 1.55 0.37 0.00 0.00 175.52 177.56 1p1f h PRO 444 N 0.42 0.11 -0.62 6.66 0.13 -1.73 -1.28 132.00 135.69 1p1f h PRO 444 Ca 0.04 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1p1f h PRO 444 Cb 0.85 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.95 1p1f h PRO 444 CO 0.07 0.52 0.27 -0.07 -0.23 0.00 0.00 178.00 178.56 1p1f h LEU 445 N 0.09 0.81 -0.62 1.56 4.07 -1.56 0.17 115.31 119.85 1p1f h LEU 445 Ca 0.01 -0.10 -0.13 0.00 0.08 0.00 0.00 57.88 57.74 1p1f h LEU 445 Cb 0.79 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1p1f h LEU 445 CO 0.06 0.72 -0.30 0.40 -1.08 0.00 0.00 178.44 178.24 1p1f h ILE 446 N 0.89 1.28 -0.66 1.22 2.04 -1.05 -1.22 117.51 120.00 1p1f h ILE 446 Ca 0.21 -1.44 -0.05 0.00 1.00 0.00 0.00 64.86 64.58 1p1f h ILE 446 Cb 0.14 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1p1f h ILE 446 CO -0.02 0.48 0.21 0.40 0.00 0.00 0.00 178.15 179.21 1p1f h ILE 447 N 0.65 1.24 0.46 -0.67 2.04 -0.02 -2.70 117.51 118.51 1p1f h ILE 447 Ca 0.08 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 1p1f h ILE 447 Cb 0.83 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1p1f h ILE 447 CO 0.07 0.32 -0.22 0.44 0.00 0.00 0.00 178.15 178.76 1p1f h ASP 448 N 0.97 -0.52 -0.57 1.72 3.32 -0.20 -1.90 116.42 119.24 1p1f h ASP 448 Ca 0.22 -0.02 0.11 0.00 0.02 0.00 0.00 57.03 57.36 1p1f h ASP 448 Cb 0.27 0.13 -0.11 0.00 0.22 0.00 0.00 39.33 39.84 1p1f h ASP 448 CO -0.01 -0.32 -0.23 -0.07 -1.72 0.00 0.00 179.24 176.89 1p1f h LEU 449 N -0.68 -0.81 -0.63 1.55 3.38 -1.17 0.29 115.31 117.25 1p1f h LEU 449 Ca -0.06 0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1p1f h LEU 449 Cb 0.51 0.45 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 1p1f h LEU 449 CO 0.10 -0.25 0.36 -0.07 0.09 0.00 0.00 178.44 178.67 1p1f h LEU 450 N -0.09 0.56 -0.25 1.67 3.38 -1.33 0.45 115.31 119.70 1p1f h LEU 450 Ca 0.26 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1p1f h LEU 450 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1p1f h LEU 450 CO -0.63 0.38 -0.06 0.58 0.09 0.00 0.00 178.44 178.79 1p1f h VAL 451 N 0.69 1.28 -0.20 1.22 2.07 -0.47 -1.93 116.25 118.92 1p1f h VAL 451 Ca 0.27 -1.08 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 1p1f h VAL 451 Cb 0.10 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1p1f h VAL 451 CO -0.14 0.34 0.01 -0.03 0.02 0.00 0.00 177.57 177.77 1p1f h MET 452 N 0.23 0.34 -0.54 1.57 -1.53 -0.03 -1.80 114.93 113.16 1p1f h MET 452 Ca 0.06 -0.10 -0.12 0.00 -3.44 0.00 0.00 59.70 56.10 1p1f h MET 452 Cb 0.53 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.53 1p1f h MET 452 CO 0.03 0.53 -0.12 1.79 0.14 0.00 0.00 176.91 179.27 1p1f h THR 453 N 0.11 1.27 -0.84 -0.77 1.35 -0.14 0.24 112.91 114.14 1p1f h THR 453 Ca 0.06 -1.28 0.04 0.00 -0.55 0.00 0.00 66.41 64.68 1p1f h THR 453 Cb 0.36 0.97 -0.05 0.00 -1.73 0.00 0.00 68.15 67.70 1p1f h THR 453 CO 0.01 0.45 0.55 -0.08 -0.25 0.00 0.00 175.52 176.20 1p1f h GLU 454 N 0.92 0.97 0.37 4.72 4.22 -1.34 -0.69 114.58 123.75 1p1f h GLU 454 Ca 0.14 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.50 1p1f h GLU 454 Cb 0.69 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1p1f h GLU 454 CO 0.05 0.64 -0.18 0.35 -2.18 0.00 0.00 179.01 177.69 1p1f h PHE 455 N 1.00 -0.46 -1.00 0.92 3.57 -0.51 -2.90 116.94 117.56 1p1f h PHE 455 Ca 0.34 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 62.01 1p1f h PHE 455 Cb 0.09 0.15 -0.10 0.00 2.79 0.00 0.00 35.95 38.89 1p1f h PHE 455 CO -0.00 -0.19 0.62 0.00 -2.23 0.00 0.00 178.31 176.50 1p1f h THR 457 N 0.80 0.00 -0.02 0.00 1.35 -0.93 0.03 112.91 114.14 1p1f h THR 457 Ca 0.56 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.42 1p1f h THR 457 Cb 0.83 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1p1f h THR 457 CO -0.35 0.00 -0.18 0.54 -0.25 0.00 0.00 175.52 175.28 1p1f n ARG 458 N -2.24 1.76 -3.60 4.72 1.74 0.07 -4.91 116.66 114.20 1p1f n ARG 458 Ca -0.01 -1.45 -0.38 0.00 -0.77 0.00 0.00 57.85 55.23 1p1f n ARG 458 Cb 0.17 -1.42 -0.11 0.00 -1.02 0.00 0.00 32.46 30.08 1p1f n ARG 458 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p1f s VAL 459 N -2.04 5.15 0.10 1.55 1.01 -0.00 -0.88 120.40 125.29 1p1f s VAL 459 Ca 0.22 0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.34 1p1f s VAL 459 Cb 0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1p1f s VAL 459 CO 0.38 0.21 -0.24 -0.94 0.00 0.00 0.00 175.10 174.51 1p1f s SER 460 N 1.73 2.97 0.16 3.32 1.04 0.10 -4.42 113.70 118.60 1p1f s SER 460 Ca 0.07 -0.69 0.01 0.00 0.48 0.00 0.00 55.95 55.81 1p1f s SER 460 Cb -0.16 -0.20 -0.00 0.00 0.10 0.00 0.00 66.02 65.76 1p1f s SER 460 CO 0.10 0.15 0.02 0.00 0.98 0.00 0.00 173.24 174.48 1p1f n TYR 461 N 1.16 0.26 -3.35 5.02 0.18 -1.03 0.14 117.16 119.54 1p1f n TYR 461 Ca -0.18 -0.85 0.02 0.00 1.88 0.00 0.00 57.90 58.77 1p1f n TYR 461 Cb 0.53 -0.07 -0.03 0.00 -0.38 0.00 0.00 39.34 39.39 1p1f n TYR 461 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1p1f s LYS 462 N -2.58 0.36 0.25 -3.48 2.20 -1.06 -1.02 119.74 114.42 1p1f s LYS 462 Ca 0.03 0.82 -0.31 0.00 -0.36 0.00 0.00 55.97 56.15 1p1f s LYS 462 Cb 0.00 0.48 -0.11 0.00 -1.51 0.00 0.00 37.83 36.69 1p1f s LYS 462 CO 0.02 -0.22 1.57 0.15 -0.36 0.00 0.00 175.35 176.51 1p1f s LYS 463 N 2.69 4.17 0.07 4.03 1.02 -1.26 -2.28 119.74 128.17 1p1f s LYS 463 Ca 0.01 2.48 0.09 0.00 0.02 0.00 0.00 55.97 58.57 1p1f s LYS 463 Cb -0.09 -3.07 -0.03 0.00 -0.52 0.00 0.00 37.83 34.11 1p1f s LYS 463 CO -0.17 -0.60 -0.22 0.08 -0.92 0.00 0.00 175.35 173.52 1p1f s VAL 464 N 0.37 2.48 -0.20 3.17 1.01 0.78 -4.61 120.40 123.40 1p1f s VAL 464 Ca 0.65 -1.39 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 1p1f s VAL 464 Cb -0.46 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1p1f s VAL 464 CO 0.42 0.28 0.29 -0.62 0.00 0.00 0.00 175.10 175.47 1p1f s ASP 465 N -1.55 6.34 0.47 3.32 -1.08 -1.26 -4.14 116.67 118.77 1p1f s ASP 465 Ca 0.14 0.39 0.12 0.00 -0.52 0.00 0.00 52.55 52.69 1p1f s ASP 465 Cb -0.10 -2.18 1.09 0.00 -1.46 0.00 0.00 42.92 40.27 1p1f s ASP 465 CO 0.05 0.03 2.10 1.55 0.52 0.00 0.00 175.17 179.41 1p1f h PRO 466 N 7.16 0.20 0.00 4.34 0.13 -2.00 -3.28 132.00 138.54 1p1f h PRO 466 Ca -0.38 -0.02 -0.30 0.00 -0.87 0.00 0.00 66.00 64.43 1p1f h PRO 466 Cb 1.16 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1p1f h PRO 466 CO 0.72 0.15 -1.80 1.33 -0.23 0.00 0.00 178.00 178.17 1p1f n VAL 467 N -4.49 1.52 -2.49 1.56 0.24 -1.26 -4.83 118.33 108.58 1p1f n VAL 467 Ca -0.01 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.71 1p1f n VAL 467 Cb 0.10 -2.03 -0.03 0.00 -1.47 0.00 0.00 33.84 30.42 1p1f n VAL 467 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1p1f s LYS 468 N -2.49 3.39 0.22 7.34 2.20 -1.24 -4.98 119.74 124.18 1p1f s LYS 468 Ca -0.33 0.31 -0.31 0.00 -0.36 0.00 0.00 55.97 55.28 1p1f s LYS 468 Cb 0.10 -4.08 -0.10 0.00 -1.51 0.00 0.00 37.83 32.24 1p1f s LYS 468 CO 0.49 -1.83 1.55 -2.00 -0.36 0.00 0.00 175.35 173.20 1p1f s GLU 469 N 5.27 4.20 -0.36 4.03 2.12 -1.26 -3.89 118.70 128.81 1p1f s GLU 469 Ca 0.47 2.41 -0.13 0.00 0.36 0.00 0.00 54.97 58.08 1p1f s GLU 469 Cb -0.09 -3.11 0.02 0.00 0.26 0.00 0.00 34.13 31.21 1p1f s GLU 469 CO 0.24 -0.57 0.36 -3.47 -0.54 0.00 0.00 175.26 171.29 1p1f n ASP 470 N 3.12 -7.55 -3.03 -1.70 2.03 -1.26 -4.97 116.55 103.19 1p1f n ASP 470 Ca 0.11 0.73 -0.26 0.00 0.52 0.00 0.00 54.79 55.88 1p1f n ASP 470 Cb 0.38 -4.56 -0.05 0.00 -0.72 0.00 0.00 41.12 36.18 1p1f n ASP 470 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1p1f n ALA 471 N 0.18 4.34 0.00 -1.67 0.00 -1.25 -5.05 120.51 117.06 1p1f n ALA 471 Ca 0.04 -4.59 0.00 0.00 0.00 0.00 0.00 53.44 48.90 1p1f n ALA 471 Cb 0.35 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.02 1p1f n ALA 471 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p1f n GLY 472 N -0.03 3.46 3.75 0.00 0.00 -1.26 -4.72 105.19 106.39 1p1f n GLY 472 Ca 0.30 -1.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 1p1f n GLY 472 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1f s LYS 473 N -2.23 2.73 0.60 1.61 0.00 -1.26 -5.03 119.74 116.17 1p1f s LYS 473 Ca 0.00 -0.97 -0.17 0.00 0.00 0.00 0.00 55.97 54.83 1p1f s LYS 473 Cb 0.00 -2.54 -0.03 0.00 0.00 0.00 0.00 37.83 35.27 1p1f s LYS 473 CO 0.00 0.47 1.10 -0.06 0.00 0.00 0.00 175.35 176.86 1p1f s PHE 474 N -1.79 2.72 0.21 1.78 0.40 -1.26 -4.77 117.98 115.28 1p1f s PHE 474 Ca 0.30 1.54 0.01 0.00 -0.60 0.00 0.00 56.93 58.18 1p1f s PHE 474 Cb -0.10 -3.17 -0.00 0.00 0.51 0.00 0.00 43.02 40.26 1p1f s PHE 474 CO 0.22 -1.51 0.03 0.39 0.70 0.00 0.00 175.22 175.05 1p1f n GLU 475 N -1.95 1.14 -4.43 0.44 1.02 -0.19 -4.94 120.64 111.75 1p1f n GLU 475 Ca 0.10 -1.64 -0.22 0.00 -0.02 0.00 0.00 57.16 55.39 1p1f n GLU 475 Cb 0.52 0.63 -0.10 0.00 -0.02 0.00 0.00 31.44 32.47 1p1f n GLU 475 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1p1f s ASN 476 N -2.22 3.03 0.35 1.62 0.02 -1.26 -2.47 114.94 114.01 1p1f s ASN 476 Ca 0.04 -1.10 -0.26 0.00 -1.02 0.00 0.00 52.86 50.52 1p1f s ASN 476 Cb 0.00 -0.21 -0.13 0.00 0.02 0.00 0.00 41.25 40.93 1p1f s ASN 476 CO 0.03 -0.18 0.98 0.49 0.02 0.00 0.00 177.10 178.45 1p1f n PHE 477 N -0.55 1.14 -1.68 2.20 3.72 -1.26 -4.77 117.46 116.25 1p1f n PHE 477 Ca -0.06 0.63 -0.47 0.00 -0.05 0.00 0.00 57.45 57.50 1p1f n PHE 477 Cb 0.62 -2.23 -0.04 0.00 -0.94 0.00 0.00 39.48 36.88 1p1f n PHE 477 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1p1f n TYR 478 N -0.13 2.36 -0.02 1.38 -0.00 -1.26 -4.73 117.16 114.75 1p1f n TYR 478 Ca 0.09 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 58.02 1p1f n TYR 478 Cb 0.35 -2.66 0.04 0.00 -0.00 0.00 0.00 39.34 37.07 1p1f n TYR 478 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.86 174.56 1p1f n PRO 479 N 6.01 -0.00 -2.80 2.98 -0.02 -1.26 -3.62 135.00 136.29 1p1f n PRO 479 Ca 0.21 0.08 -0.43 0.00 -2.02 0.00 0.00 63.50 61.34 1p1f n PRO 479 Cb 0.31 -0.15 -0.01 0.00 -0.02 0.00 0.00 33.50 33.62 1p1f n PRO 479 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1p1f s VAL 480 N -3.90 4.56 -0.86 -1.45 1.01 -1.26 -1.15 120.40 117.35 1p1f s VAL 480 Ca -0.00 -1.84 -0.24 0.00 0.00 0.00 0.00 61.98 59.90 1p1f s VAL 480 Cb 0.02 -4.96 -0.18 0.00 0.00 0.00 0.00 36.38 31.26 1p1f s VAL 480 CO 0.05 -1.73 2.26 0.18 0.00 0.00 0.00 175.10 175.86 1p1f n LEU 481 N 7.05 1.24 0.00 3.92 4.77 -1.04 -4.75 117.00 128.20 1p1f n LEU 481 Ca 0.35 -1.68 0.15 0.00 -0.03 0.00 0.00 56.01 54.79 1p1f n LEU 481 Cb 0.47 -1.55 0.86 0.00 -2.33 0.00 0.00 43.42 40.87 1p1f n LEU 481 CO 0.62 -2.79 1.04 0.35 -1.33 0.00 0.00 177.39 175.28 1p1f n THR 482 N 8.44 0.01 0.64 -5.08 -2.24 -1.26 -2.93 114.28 111.86 1p1f n THR 482 Ca 0.45 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.31 1p1f n THR 482 Cb 0.42 -0.54 0.36 0.00 -2.10 0.00 0.00 70.33 68.47 1p1f n THR 482 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1p1f n PHE 483 N -1.04 0.00 1.03 4.78 0.99 -1.26 -2.32 117.46 119.65 1p1f n PHE 483 Ca 0.21 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.78 1p1f n PHE 483 Cb 0.12 -0.38 0.09 0.00 -1.00 0.00 0.00 39.48 38.31 1p1f n PHE 483 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1p1f n LEU 484 N -1.38 2.54 0.31 4.37 4.32 -1.15 -4.47 117.00 121.54 1p1f n LEU 484 Ca 0.06 -0.87 0.16 0.00 -0.02 0.00 0.00 56.01 55.33 1p1f n LEU 484 Cb 0.15 -0.00 0.85 0.00 -1.62 0.00 0.00 43.42 42.80 1p1f n LEU 484 CO 0.13 0.44 1.09 0.28 -1.22 0.00 0.00 177.39 178.10 1p1f h SER 485 N 3.71 0.00 -0.50 -1.43 0.02 -1.70 -1.13 113.55 112.52 1p1f h SER 485 Ca 0.00 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1p1f h SER 485 Cb 0.88 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 1p1f h SER 485 CO 0.00 0.00 0.34 0.22 -1.14 0.00 0.00 176.83 176.25 1p1f h TYR 486 N 0.00 0.48 -0.54 3.45 5.03 -1.85 -1.43 116.97 122.11 1p1f h TYR 486 Ca 0.00 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.32 1p1f h TYR 486 Cb 0.46 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.59 1p1f h TYR 486 CO 0.00 0.27 0.00 0.91 -1.32 0.00 0.00 178.16 178.02 1p1f n TRP 487 N -4.48 1.55 -4.20 -3.82 8.01 -0.43 -4.86 117.44 109.21 1p1f n TRP 487 Ca 0.06 -0.70 -0.19 0.00 -1.31 0.00 0.00 57.50 55.36 1p1f n TRP 487 Cb 0.21 -0.34 -0.16 0.00 -2.01 0.00 0.00 31.31 29.01 1p1f n TRP 487 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1p1f s LEU 488 N -2.32 1.50 0.04 -0.99 1.43 -0.54 -1.45 118.68 116.35 1p1f s LEU 488 Ca 0.49 -0.13 -0.27 0.00 -1.03 0.00 0.00 54.13 53.19 1p1f s LEU 488 Cb 0.35 -0.44 -0.17 0.00 0.03 0.00 0.00 46.19 45.97 1p1f s LEU 488 CO 0.18 -0.02 1.42 0.11 0.23 0.00 0.00 176.35 178.28 1p1f h LYS 489 N 6.88 -0.48 -3.48 1.70 1.57 0.16 -3.37 116.57 119.54 1p1f h LYS 489 Ca -0.36 0.03 -0.73 0.00 -1.87 0.00 0.00 60.65 57.72 1p1f h LYS 489 Cb 1.16 0.11 -0.33 0.00 0.08 0.00 0.00 32.23 33.25 1p1f h LYS 489 CO 0.48 -0.22 -0.05 0.00 -0.57 0.00 0.00 179.45 179.10 1p1f s ALA 490 N -5.37 4.15 -0.08 3.86 0.00 -0.20 -5.01 121.76 119.10 1p1f s ALA 490 Ca -0.15 -3.65 -0.35 0.00 0.00 0.00 0.00 51.96 47.81 1p1f s ALA 490 Cb 0.03 -2.99 -0.13 0.00 0.00 0.00 0.00 23.12 20.03 1p1f s ALA 490 CO 0.58 -2.17 1.81 -2.30 0.00 0.00 0.00 175.76 173.69 1p1f n PRO 491 N 2.85 1.99 -2.79 0.00 -0.02 -1.26 -2.92 135.00 132.87 1p1f n PRO 491 Ca 0.18 0.73 -0.43 0.00 -2.02 0.00 0.00 63.50 61.96 1p1f n PRO 491 Cb 0.39 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 1p1f n PRO 491 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1p1f s LEU 492 N 3.54 4.27 0.23 2.45 2.96 -1.26 -4.81 118.68 126.06 1p1f s LEU 492 Ca 0.92 -1.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 1p1f s LEU 492 Cb -0.75 -2.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.44 1p1f s LEU 492 CO 0.52 -1.40 0.25 0.42 -1.32 0.00 0.00 176.35 174.83 1p1f s THR 493 N 4.04 4.78 0.44 3.68 -4.23 -1.26 -4.58 115.64 118.50 1p1f s THR 493 Ca 0.31 -1.18 -0.24 0.00 -1.18 0.00 0.00 61.69 59.39 1p1f s THR 493 Cb -0.09 -3.57 -0.08 0.00 1.34 0.00 0.00 72.50 70.10 1p1f s THR 493 CO 0.02 -0.30 1.24 0.00 -0.54 0.00 0.00 174.62 175.03 1p1f s ARG 494 N -3.77 3.83 0.14 3.99 1.70 -1.26 -4.92 118.95 118.66 1p1f s ARG 494 Ca 0.33 1.98 -0.33 0.00 -0.47 0.00 0.00 55.73 57.24 1p1f s ARG 494 Cb -0.09 -2.58 -0.17 0.00 -0.57 0.00 0.00 34.95 31.54 1p1f s ARG 494 CO 0.26 -0.55 0.86 -0.35 -1.08 0.00 0.00 175.30 174.45 1p1f n PRO 495 N -0.20 0.36 0.00 3.89 -0.04 -1.26 -2.44 135.00 135.31 1p1f n PRO 495 Ca 0.06 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1p1f n PRO 495 Cb 0.46 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 1p1f n PRO 495 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p1f n GLY 496 N 1.81 3.06 3.86 0.55 0.00 -1.26 -5.03 105.19 108.18 1p1f n GLY 496 Ca 0.17 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 1p1f n GLY 496 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1f s PHE 497 N -0.74 3.53 0.02 1.61 0.40 -1.02 -5.07 117.98 116.70 1p1f s PHE 497 Ca 0.00 1.31 0.00 0.00 -0.60 0.00 0.00 56.93 57.64 1p1f s PHE 497 Cb 0.00 -2.69 -0.04 0.00 0.51 0.00 0.00 43.02 40.80 1p1f s PHE 497 CO 0.00 -0.46 0.09 -1.01 0.70 0.00 0.00 175.22 174.54 1p1f s HIS 498 N -2.82 3.28 -0.26 0.36 3.76 -1.26 -4.84 115.29 113.52 1p1f s HIS 498 Ca 0.56 0.18 -0.25 0.00 -0.15 0.00 0.00 55.06 55.40 1p1f s HIS 498 Cb -0.10 -1.71 -0.00 0.00 1.11 0.00 0.00 32.58 31.87 1p1f s HIS 498 CO 0.41 0.55 0.86 -1.25 -0.85 0.00 0.00 174.74 174.45 1p1f s PRO 499 N -1.94 4.14 0.01 8.40 0.04 -1.26 -5.02 135.00 139.37 1p1f s PRO 499 Ca 0.25 0.93 -0.19 0.00 0.04 0.00 0.00 61.00 62.03 1p1f s PRO 499 Cb -0.12 -3.67 -0.06 0.00 0.04 0.00 0.00 34.50 30.70 1p1f s PRO 499 CO 0.17 -0.58 0.54 0.54 0.04 0.00 0.00 177.00 177.70 1p1f s VAL 500 N 2.95 4.90 -0.43 -0.36 0.11 -1.26 -4.89 120.40 121.42 1p1f s VAL 500 Ca 0.36 1.13 0.07 0.00 -2.93 0.00 0.00 61.98 60.61 1p1f s VAL 500 Cb -0.15 -3.87 -0.04 0.00 -1.53 0.00 0.00 36.38 30.79 1p1f s VAL 500 CO 0.09 0.48 0.37 0.59 -3.33 0.00 0.00 175.10 173.30 1p1f n ASN 501 N 2.33 0.59 -4.53 3.54 4.13 -1.26 -4.96 115.26 115.08 1p1f n ASN 501 Ca -0.09 -0.79 -0.55 0.00 1.68 0.00 0.00 54.58 54.82 1p1f n ASN 501 Cb 0.51 0.78 -0.08 0.00 -1.54 0.00 0.00 39.78 39.45 1p1f n ASN 501 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1p1f n GLY 502 N 0.99 0.57 0.08 7.41 0.00 -1.26 -4.81 105.19 108.17 1p1f n GLY 502 Ca 0.02 0.96 -0.13 0.00 0.00 0.00 0.00 46.02 46.87 1p1f n GLY 502 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p1f h LEU 503 N 9.67 -0.10 -0.86 0.99 5.85 -1.91 0.00 115.31 128.95 1p1f h LEU 503 Ca -0.33 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.47 1p1f h LEU 503 Cb 1.33 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.32 1p1f h LEU 503 CO 1.00 -0.05 0.51 0.78 -0.34 0.00 0.00 178.44 180.33 1p1f h ASN 504 N -0.14 0.74 -0.64 1.25 2.35 -1.87 -0.75 115.58 116.52 1p1f h ASN 504 Ca -0.01 0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.73 1p1f h ASN 504 Cb 0.11 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.35 1p1f h ASN 504 CO 0.02 0.43 0.21 0.11 -1.65 0.00 0.00 177.43 176.55 1p1f h LYS 505 N 0.86 0.99 -0.47 0.81 1.57 -1.86 -1.25 116.57 117.22 1p1f h LYS 505 Ca 0.41 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 1p1f h LYS 505 Cb 0.34 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1p1f h LYS 505 CO -0.23 0.86 0.17 1.96 -0.57 0.00 0.00 179.45 181.64 1p1f h GLN 506 N 0.92 0.68 -0.05 3.15 4.20 0.31 -2.67 115.11 121.65 1p1f h GLN 506 Ca 0.21 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.73 1p1f h GLN 506 Cb 0.28 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1p1f h GLN 506 CO -0.01 0.58 -0.30 -0.09 -0.67 0.00 0.00 178.83 178.34 1p1f h ARG 507 N 0.68 0.30 -0.55 1.46 2.43 -0.83 -3.15 114.38 114.72 1p1f h ARG 507 Ca 0.16 -0.25 0.08 0.00 -0.81 0.00 0.00 59.98 59.17 1p1f h ARG 507 Cb 0.16 0.05 -0.10 0.00 -0.42 0.00 0.00 29.97 29.66 1p1f h ARG 507 CO -0.01 0.90 -0.44 1.15 -1.51 0.00 0.00 179.97 180.06 1p1f h THR 508 N -0.23 0.09 -0.84 0.20 2.02 -1.02 0.20 112.91 113.33 1p1f h THR 508 Ca -0.02 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.33 1p1f h THR 508 Cb 0.97 0.09 -0.10 0.00 -1.74 0.00 0.00 68.15 67.36 1p1f h THR 508 CO 0.06 0.00 0.39 0.00 0.37 0.00 0.00 175.52 176.34 1p1f h ALA 509 N 0.57 1.27 -0.06 6.16 0.00 -1.55 0.58 119.26 126.23 1p1f h ALA 509 Ca 0.17 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1p1f h ALA 509 Cb 0.57 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1p1f h ALA 509 CO -0.67 -0.20 0.04 -0.07 0.00 0.00 0.00 179.25 178.35 1p1f h LEU 510 N 0.51 0.07 0.41 0.00 3.38 -0.70 -1.21 115.31 117.76 1p1f h LEU 510 Ca 0.48 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.41 1p1f h LEU 510 Cb 0.77 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1p1f h LEU 510 CO -0.42 0.07 -0.20 -0.08 0.09 0.00 0.00 178.44 177.90 1p1f h GLU 511 N 0.06 -0.53 -0.37 1.13 4.81 0.20 -2.39 114.58 117.50 1p1f h GLU 511 Ca 0.02 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1p1f h GLU 511 Cb 0.01 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1p1f h GLU 511 CO -0.00 -0.34 0.19 -0.91 -0.73 0.00 0.00 179.01 177.22 1p1f h ASN 512 N -0.57 0.44 -0.25 1.04 -0.26 -0.00 -0.35 115.58 115.63 1p1f h ASN 512 Ca -0.06 -0.03 0.01 0.00 -0.56 0.00 0.00 56.30 55.66 1p1f h ASN 512 Cb 0.43 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 1p1f h ASN 512 CO 0.09 0.37 0.15 0.15 -1.06 0.00 0.00 177.43 177.13 1p1f h PHE 513 N 0.51 0.29 -0.61 1.19 -0.00 -1.02 0.37 116.94 117.67 1p1f h PHE 513 Ca 0.13 0.01 -0.10 0.00 -0.00 0.00 0.00 57.97 58.01 1p1f h PHE 513 Cb 0.03 -0.10 -0.02 0.00 -0.00 0.00 0.00 35.95 35.87 1p1f h PHE 513 CO 0.00 0.18 0.00 -0.07 -0.00 0.00 0.00 178.31 178.42 1p1f h LEU 514 N 0.31 1.05 0.65 0.59 3.38 -0.83 -2.35 115.31 118.11 1p1f h LEU 514 Ca 0.09 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1p1f h LEU 514 Cb -0.02 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.45 1p1f h LEU 514 CO -0.03 1.10 -0.31 0.03 0.09 0.00 0.00 178.44 179.32 1p1f h ARG 515 N 0.98 -0.84 -0.67 1.13 3.08 -0.80 -2.83 114.38 114.43 1p1f h ARG 515 Ca 0.17 0.06 0.26 0.00 0.07 0.00 0.00 59.98 60.54 1p1f h ARG 515 Cb 0.56 0.19 -0.12 0.00 0.08 0.00 0.00 29.97 30.68 1p1f h ARG 515 CO 0.03 -0.56 0.27 -0.11 -1.07 0.00 0.00 179.97 178.53 1p1f n LEU 516 N -4.52 0.15 0.17 3.04 0.00 0.13 0.22 117.00 116.18 1p1f n LEU 516 Ca -0.11 1.12 0.13 0.00 0.00 0.00 0.00 56.01 57.16 1p1f n LEU 516 Cb 0.34 -0.51 0.47 0.00 0.00 0.00 0.00 43.42 43.72 1p1f n LEU 516 CO 0.26 -1.22 0.89 -0.07 0.00 0.00 0.00 177.39 177.25 1p1f h LEU 517 N 0.00 0.00 -2.86 -1.96 3.38 -1.17 -2.86 115.31 109.84 1p1f h LEU 517 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.50 1p1f h LEU 517 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1p1f h LEU 517 CO -0.55 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.28 1p1f n ILE 518 N -2.56 1.00 -0.25 1.22 -5.35 0.59 -4.82 119.36 109.19 1p1f n ILE 518 Ca 0.03 -1.00 0.00 0.00 -0.27 0.00 0.00 62.75 61.51 1p1f n ILE 518 Cb 0.34 0.50 0.00 0.00 -1.74 0.00 0.00 39.64 38.74 1p1f n ILE 518 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1p1f n GLY 519 N 0.76 0.75 3.88 3.28 0.00 -0.88 -4.67 105.19 108.31 1p1f n GLY 519 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1p1f n GLY 519 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p1f s LEU 520 N 0.00 4.34 0.00 0.99 1.43 -1.08 -4.95 118.68 119.41 1p1f s LEU 520 Ca 0.00 0.70 -0.15 0.00 -1.03 0.00 0.00 54.13 53.64 1p1f s LEU 520 Cb 0.00 -2.99 0.22 0.00 0.03 0.00 0.00 46.19 43.45 1p1f s LEU 520 CO 0.00 0.16 1.00 -0.81 0.23 0.00 0.00 176.35 176.93 1p1f n PRO 521 N 0.77 -1.89 -1.38 1.29 -0.04 -1.26 -2.69 135.00 129.80 1p1f n PRO 521 Ca -0.07 -1.57 -0.30 0.00 -0.04 0.00 0.00 63.50 61.52 1p1f n PRO 521 Cb 0.52 -1.23 0.11 0.00 -0.04 0.00 0.00 33.50 32.87 1p1f n PRO 521 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1p1f s SER 522 N -4.48 3.98 -0.12 3.54 1.04 -1.26 -4.71 113.70 111.69 1p1f s SER 522 Ca 0.60 1.39 -0.30 0.00 0.48 0.00 0.00 55.95 58.13 1p1f s SER 522 Cb -0.04 -2.10 -0.02 0.00 0.10 0.00 0.00 66.02 63.97 1p1f s SER 522 CO 0.44 -2.31 1.13 -1.10 0.98 0.00 0.00 173.24 172.39 1p1f s GLN 523 N -5.05 4.33 -0.06 4.02 -1.52 -1.26 -4.88 119.66 115.25 1p1f s GLN 523 Ca 0.62 1.54 0.20 0.00 -1.95 0.00 0.00 55.36 55.78 1p1f s GLN 523 Cb -0.16 -3.61 -0.28 0.00 -0.22 0.00 0.00 33.01 28.75 1p1f s GLN 523 CO 0.55 -0.49 0.42 0.27 -0.25 0.00 0.00 175.29 175.80 1p1f n ASN 524 N 5.60 0.12 -3.93 5.90 0.23 -1.26 -5.00 115.26 116.92 1p1f n ASN 524 Ca 0.11 0.05 -0.30 0.00 -0.53 0.00 0.00 54.58 53.91 1p1f n ASN 524 Cb 0.47 1.46 0.02 0.00 -2.08 0.00 0.00 39.78 39.65 1p1f n ASN 524 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1p1f n GLU 525 N -2.48 -5.31 -0.09 -3.83 -0.58 -1.26 -4.91 120.64 102.18 1p1f n GLU 525 Ca -0.13 0.58 -0.17 0.00 -0.42 0.00 0.00 57.16 57.02 1p1f n GLU 525 Cb 0.76 -5.43 -0.13 0.00 -0.57 0.00 0.00 31.44 26.07 1p1f n GLU 525 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1p1f n LEU 526 N -4.64 2.32 -3.66 -4.62 4.77 -1.26 -5.02 117.00 104.90 1p1f n LEU 526 Ca 0.02 -0.02 -0.29 0.00 -0.03 0.00 0.00 56.01 55.69 1p1f n LEU 526 Cb 0.53 -0.67 0.04 0.00 -2.33 0.00 0.00 43.42 41.00 1p1f n LEU 526 CO 0.76 0.82 -0.07 0.54 -1.33 0.00 0.00 177.39 178.11 1p1f n ARG 527 N -3.21 -1.74 0.00 3.23 1.74 -1.26 -4.77 116.66 110.65 1p1f n ARG 527 Ca -0.40 0.51 0.08 0.00 -0.77 0.00 0.00 57.85 57.27 1p1f n ARG 527 Cb 1.03 -4.40 0.38 0.00 -1.02 0.00 0.00 32.46 28.45 1p1f n ARG 527 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1p1f n PHE 528 N -4.11 0.00 -0.82 -1.55 3.72 -1.26 -2.46 117.46 110.98 1p1f n PHE 528 Ca -0.12 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.10 1p1f n PHE 528 Cb 0.61 -0.39 0.16 0.00 -0.94 0.00 0.00 39.48 38.92 1p1f n PHE 528 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1p1f n GLU 529 N -1.39 2.21 0.00 -1.08 0.00 -1.26 -1.35 120.64 117.76 1p1f n GLU 529 Ca 0.06 -2.49 0.00 0.00 0.00 0.00 0.00 57.16 54.73 1p1f n GLU 529 Cb 0.16 -1.99 0.00 0.00 0.00 0.00 0.00 31.44 29.61 1p1f n GLU 529 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1p1f n GLU 530 N -0.75 0.00 0.08 3.44 2.13 -1.07 -4.85 120.64 119.62 1p1f n GLU 530 Ca 0.47 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 58.11 1p1f n GLU 530 Cb 1.44 -0.33 -0.14 0.00 0.27 0.00 0.00 31.44 32.67 1p1f n GLU 530 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1p1f h ARG 531 N 0.00 0.31 -4.63 5.31 2.47 -1.59 -3.42 114.38 112.84 1p1f h ARG 531 Ca 0.00 -0.53 -0.68 0.00 -1.26 0.00 0.00 59.98 57.51 1p1f h ARG 531 Cb 0.00 0.20 -0.37 0.00 -1.65 0.00 0.00 29.97 28.15 1p1f h ARG 531 CO 0.00 1.20 -0.65 -0.51 0.56 0.00 0.00 179.97 180.57 1p1f s LEU 532 N -7.13 4.81 0.00 3.04 1.02 -0.46 -5.07 118.68 114.89 1p1f s LEU 532 Ca -0.10 -1.98 0.23 0.00 0.02 0.00 0.00 54.13 52.31 1p1f s LEU 532 Cb 0.06 -1.71 1.39 0.00 0.02 0.00 0.00 46.19 45.94 1p1f s LEU 532 CO 0.87 -0.42 1.76 0.00 0.02 0.00 0.00 176.35 178.57